*HEADER    TRANSLATION INITIATION FACTOR           04-AUG-98   2IF1      
*TITLE     HUMAN TRANSLATION INITIATION FACTOR EIF1, NMR, 29 STRUCTURES  
*COMPND    MOL_ID: 1;                                                    
*COMPND   2 MOLECULE: EIF1;                                              
*COMPND   3 CHAIN: NULL;                                                 
*COMPND   4 SYNONYM: SUI1;                                               
*COMPND   5 ENGINEERED: YES;                                             
*COMPND   6 OTHER_DETAILS: N-TERMINAL POLY-HISTIDINE TAG                 
*SOURCE    MOL_ID: 1;                                                    
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                           
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                      
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                         
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                        
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PQE31(HIS6-EIF1)                  
*KEYWDS    TRANSLATION INITIATION FACTOR                                 
*EXPDTA    NMR, 29 STRUCTURES                                            
*AUTHOR    C.M.FLETCHER,C.U.T.HELLEN,T.V.PESTOVA,G.WAGNER                
*REVDAT   1   12-OCT-04 2IF1    0   

! Upper Limit Distance Restraints from 15N NOESY-HSQC                           
                                                                                
assi ( resi   2 and name HA   ) ( resi   3 and name HN   ) 0 0 5.0              
assi ( resi   3 and name HA*  ) ( resi   3 and name HN   ) 0 0 4.0              
assi ( resi   3 and name HA*  ) ( resi   4 and name HN   ) 0 0 4.0              
assi ( resi   4 and name HB*  ) ( resi   4 and name HN   ) 0 0 5.0              
assi ( resi   4 and name HA   ) ( resi   5 and name HN   ) 0 0 5.0              
assi ( resi  10 and name HB*  ) ( resi  11 and name HN   ) 0 0 5.0              
assi ( resi  11 and name HB   ) ( resi  11 and name HN   ) 0 0 5.0              
assi ( resi  11 and name HG2* ) ( resi  11 and name HN   ) 0 0 5.0              
assi ( resi  11 and name HA   ) ( resi  12 and name HN   ) 0 0 5.0              
assi ( resi  11 and name HB   ) ( resi  12 and name HN   ) 0 0 5.0              
assi ( resi  11 and name HG2* ) ( resi  12 and name HN   ) 0 0 5.0              
assi ( resi  11 and name HN   ) ( resi  12 and name HN   ) 0 0 5.0              
assi ( resi  12 and name HA   ) ( resi  12 and name HN   ) 0 0 5.0              
assi ( resi  12 and name HB*  ) ( resi  12 and name HN   ) 0 0 4.0              
assi ( resi  12 and name HN   ) ( resi  13 and name HD*  ) 0 0 5.0              
assi ( resi  12 and name HB*  ) ( resi  14 and name HN   ) 0 0 5.0              
assi ( resi  12 and name HA   ) ( resi  15 and name HN   ) 0 0 5.0              
assi ( resi  12 and name HB*  ) ( resi  15 and name HN   ) 0 0 5.0              
assi ( resi  13 and name HA   ) ( resi  14 and name HN   ) 0 0 5.0              
assi ( resi  13 and name HB*  ) ( resi  14 and name HN   ) 0 0 4.0              
assi ( resi  13 and name HD*  ) ( resi  14 and name HN   ) 0 0 4.0              
assi ( resi  13 and name HB*  ) ( resi  15 and name HN   ) 0 0 5.0              
assi ( resi  14 and name HA   ) ( resi  14 and name HN   ) 0 0 5.0              
assi ( resi  14 and name HB*  ) ( resi  14 and name HN   ) 0 0 3.0              
assi ( resi  14 and name HG*  ) ( resi  14 and name HN   ) 0 0 4.0              
assi ( resi  14 and name HA   ) ( resi  15 and name HN   ) 0 0 5.0              
assi ( resi  14 and name HB*  ) ( resi  15 and name HN   ) 0 0 4.0              
assi ( resi  14 and name HG*  ) ( resi  15 and name HN   ) 0 0 5.0              
assi ( resi  14 and name HN   ) ( resi  15 and name HN   ) 0 0 4.0              
assi ( resi  14 and name HA   ) ( resi  17 and name HN   ) 0 0 5.0              
assi ( resi  15 and name HA   ) ( resi  15 and name HN   ) 0 0 5.0              
assi ( resi  15 and name HB*  ) ( resi  15 and name HN   ) 0 0 3.0              
assi ( resi  15 and name HA   ) ( resi  16 and name HN   ) 0 0 5.0              
assi ( resi  15 and name HB*  ) ( resi  16 and name HN   ) 0 0 5.0              
assi ( resi  16 and name HA   ) ( resi  16 and name HN   ) 0 0 5.0              
assi ( resi  16 and name HB*  ) ( resi  16 and name HN   ) 0 0 4.0              
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 5.0              
assi ( resi  16 and name HN   ) ( resi  17 and name HN   ) 0 0 5.0              
assi ( resi  17 and name HA   ) ( resi  17 and name HN   ) 0 0 4.0              
assi ( resi  17 and name HB   ) ( resi  17 and name HN   ) 0 0 3.0              
assi ( resi  17 and name HG1* ) ( resi  17 and name HN   ) 0 0 4.0              
assi ( resi  17 and name HG2* ) ( resi  17 and name HN   ) 0 0 4.0              
assi ( resi  17 and name HA   ) ( resi  18 and name HN   ) 0 0 3.0              
assi ( resi  17 and name HB   ) ( resi  18 and name HN   ) 0 0 5.0              
assi ( resi  17 and name HG1* ) ( resi  18 and name HN   ) 0 0 5.0              
assi ( resi  17 and name HG2* ) ( resi  18 and name HN   ) 0 0 4.0              
assi ( resi  17 and name HN   ) ( resi  18 and name HN   ) 0 0 5.0              
assi ( resi  18 and name HA   ) ( resi  18 and name HN   ) 0 0 5.0              
assi ( resi  18 and name HB*  ) ( resi  18 and name HN   ) 0 0 5.0              
assi ( resi  18 and name HE21 ) ( resi  18 and name HE22 ) 0 0 2.5              
assi ( resi  18 and name HE21 ) ( resi  18 and name HG*  ) 0 0 4.0              
assi ( resi  18 and name HE22 ) ( resi  18 and name HG*  ) 0 0 5.0              
assi ( resi  18 and name HG*  ) ( resi  18 and name HN   ) 0 0 4.0              
assi ( resi  18 and name HA   ) ( resi  19 and name HN   ) 0 0 3.0              
assi ( resi  18 and name HB*  ) ( resi  19 and name HN   ) 0 0 4.0              
assi ( resi  19 and name HA   ) ( resi  19 and name HN   ) 0 0 5.0              
assi ( resi  19 and name HB*  ) ( resi  19 and name HD21 ) 0 0 4.0              
assi ( resi  19 and name HB*  ) ( resi  19 and name HD22 ) 0 0 5.0              
assi ( resi  19 and name HB*  ) ( resi  19 and name HN   ) 0 0 4.0              
assi ( resi  19 and name HD21 ) ( resi  19 and name HD22 ) 0 0 2.5              
assi ( resi  19 and name HB*  ) ( resi  20 and name HN   ) 0 0 5.0              
assi ( resi  19 and name HN   ) ( resi  20 and name HN   ) 0 0 4.0              
assi ( resi  20 and name HA   ) ( resi  20 and name HN   ) 0 0 5.0              
assi ( resi  20 and name HB*  ) ( resi  20 and name HN   ) 0 0 4.0              
assi ( resi  20 and name HD*  ) ( resi  20 and name HN   ) 0 0 5.0              
assi ( resi  20 and name HA   ) ( resi  21 and name HN   ) 0 0 4.0              
assi ( resi  20 and name HB*  ) ( resi  21 and name HN   ) 0 0 5.0              
assi ( resi  20 and name HD*  ) ( resi  21 and name HN   ) 0 0 5.0              
assi ( resi  20 and name HN   ) ( resi  21 and name HN   ) 0 0 5.0              
assi ( resi  21 and name HA   ) ( resi  21 and name HN   ) 0 0 5.0              
assi ( resi  21 and name HB*  ) ( resi  21 and name HN   ) 0 0 4.0              
assi ( resi  21 and name HB*  ) ( resi  22 and name HN   ) 0 0 5.0              
assi ( resi  22 and name HA   ) ( resi  22 and name HN   ) 0 0 4.0              
assi ( resi  22 and name HB*  ) ( resi  22 and name HN   ) 0 0 4.0              
assi ( resi  22 and name HA   ) ( resi  23 and name HN   ) 0 0 4.0              
assi ( resi  22 and name HB*  ) ( resi  23 and name HN   ) 0 0 4.0              
assi ( resi  23 and (name HD* or name HE* or name HZ)) ( resi  23 and name HN   
assi ( resi  23 and name HA   ) ( resi  23 and name HN   ) 0 0 4.0              
assi ( resi  23 and name HB*  ) ( resi  23 and name HN   ) 0 0 3.0              
assi ( resi  23 and (name HD* or name HE* or name HZ)) ( resi  24 and name HN   
assi ( resi  23 and name HA   ) ( resi  24 and name HN   ) 0 0 2.5              
assi ( resi  23 and name HB*  ) ( resi  24 and name HN   ) 0 0 4.0              
assi ( resi  24 and name HA   ) ( resi  24 and name HN   ) 0 0 3.0              
assi ( resi  24 and name HB*  ) ( resi  24 and name HN   ) 0 0 4.0              
assi ( resi  24 and name HN   ) ( resi  25 and name HD*  ) 0 0 5.0              
assi ( resi  24 and name HA   ) ( resi  26 and name HN   ) 0 0 5.0              
assi ( resi  25 and name HA   ) ( resi  26 and name HN   ) 0 0 5.0              
assi ( resi  25 and name HB*  ) ( resi  26 and name HN   ) 0 0 5.0              
assi ( resi  25 and name HD*  ) ( resi  26 and name HN   ) 0 0 5.0              
assi ( resi  25 and name HG*  ) ( resi  26 and name HN   ) 0 0 5.0              
assi ( resi  26 and (name HD* or name HE* or name HZ)) ( resi  26 and name HN   
assi ( resi  26 and name HA   ) ( resi  26 and name HN   ) 0 0 4.0              
assi ( resi  26 and name HB*  ) ( resi  26 and name HN   ) 0 0 4.0              
assi ( resi  26 and name HA   ) ( resi  27 and name HN   ) 0 0 4.0              
assi ( resi  26 and name HB*  ) ( resi  27 and name HN   ) 0 0 5.0              
assi ( resi  26 and name HN   ) ( resi  27 and name HN   ) 0 0 3.0              
assi ( resi  27 and name HA   ) ( resi  27 and name HN   ) 0 0 4.0              
assi ( resi  27 and name HB*  ) ( resi  27 and name HN   ) 0 0 3.0              
assi ( resi  27 and name HA   ) ( resi  28 and name HN   ) 0 0 3.0              
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 4.0              
assi ( resi  28 and name HA   ) ( resi  28 and name HN   ) 0 0 4.0              
assi ( resi  28 and name HB*  ) ( resi  28 and name HN   ) 0 0 4.0              
assi ( resi  28 and name HA   ) ( resi  29 and name HN   ) 0 0 4.0              
assi ( resi  28 and name HB*  ) ( resi  29 and name HN   ) 0 0 5.0              
assi ( resi  29 and name HA   ) ( resi  29 and name HN   ) 0 0 4.0              
assi ( resi  29 and name HB*  ) ( resi  29 and name HN   ) 0 0 4.0              
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 4.0              
assi ( resi  30 and name HA   ) ( resi  30 and name HN   ) 0 0 4.0              
assi ( resi  30 and name HB*  ) ( resi  30 and name HN   ) 0 0 4.0              
assi ( resi  30 and name HA   ) ( resi  31 and name HN   ) 0 0 5.0              
assi ( resi  30 and name HB*  ) ( resi  31 and name HN   ) 0 0 5.0              
assi ( resi  31 and name HA   ) ( resi  31 and name HN   ) 0 0 5.0              
assi ( resi  31 and name HB*  ) ( resi  31 and name HN   ) 0 0 5.0              
assi ( resi  31 and name HG*  ) ( resi  31 and name HN   ) 0 0 5.0              
assi ( resi  31 and name HA   ) ( resi  32 and name HN   ) 0 0 5.0              
assi ( resi  31 and name HB*  ) ( resi  32 and name HN   ) 0 0 5.0              
assi ( resi  32 and name HA*  ) ( resi  32 and name HN   ) 0 0 3.0              
assi ( resi  32 and name HA*  ) ( resi  33 and name HN   ) 0 0 3.0              
assi ( resi  32 and name HA*  ) ( resi  34 and name HN   ) 0 0 5.0              
assi ( resi  33 and name HA   ) ( resi  33 and name HN   ) 0 0 4.0              
assi ( resi  33 and name HB*  ) ( resi  33 and name HN   ) 0 0 4.0              
assi ( resi  33 and name HA   ) ( resi  34 and name HN   ) 0 0 4.0              
assi ( resi  34 and name HA   ) ( resi  34 and name HN   ) 0 0 3.0              
assi ( resi  34 and name HB*  ) ( resi  34 and name HN   ) 0 0 3.0              
assi ( resi  34 and name HA   ) ( resi  35 and name HN   ) 0 0 4.0              
assi ( resi  34 and name HB*  ) ( resi  35 and name HN   ) 0 0 4.0              
assi ( resi  34 and name HN   ) ( resi  35 and name HN   ) 0 0 4.0              
assi ( resi  35 and name HA   ) ( resi  35 and name HN   ) 0 0 3.0              
assi ( resi  35 and name HB*  ) ( resi  35 and name HN   ) 0 0 2.5              
assi ( resi  35 and name HD*  ) ( resi  35 and name HN   ) 0 0 4.0              
assi ( resi  35 and name HA   ) ( resi  36 and name HN   ) 0 0 3.0              
assi ( resi  36 and name HA   ) ( resi  36 and name HN   ) 0 0 4.0              
assi ( resi  36 and name HB*  ) ( resi  36 and name HN   ) 0 0 4.0              
assi ( resi  36 and name HD*  ) ( resi  36 and name HN   ) 0 0 4.0              
assi ( resi  36 and name HN   ) ( resi  37 and name HD*  ) 0 0 5.0              
assi ( resi  37 and name HA   ) ( resi  38 and name HN   ) 0 0 5.0              
assi ( resi  37 and name HB*  ) ( resi  38 and name HN   ) 0 0 4.0              
assi ( resi  37 and name HG*  ) ( resi  38 and name HN   ) 0 0 5.0              
assi ( resi  38 and name HA   ) ( resi  38 and name HN   ) 0 0 5.0              
assi ( resi  38 and name HB*  ) ( resi  38 and name HN   ) 0 0 3.0              
assi ( resi  38 and name HA   ) ( resi  39 and name HN   ) 0 0 2.5              
assi ( resi  38 and name HB*  ) ( resi  39 and name HN   ) 0 0 4.0              
assi ( resi  39 and name HA*  ) ( resi  39 and name HN   ) 0 0 2.5              
assi ( resi  39 and name HA*  ) ( resi  40 and name HN   ) 0 0 3.0              
assi ( resi  39 and name HN   ) ( resi  40 and name HN   ) 0 0 4.0              
assi ( resi  39 and name HA*  ) ( resi  41 and name HN   ) 0 0 5.0              
assi ( resi  40 and name HA   ) ( resi  40 and name HN   ) 0 0 3.0              
assi ( resi  40 and name HG2* ) ( resi  40 and name HN   ) 0 0 4.0              
assi ( resi  40 and name HA   ) ( resi  41 and name HN   ) 0 0 5.0              
assi ( resi  40 and name HG2* ) ( resi  41 and name HN   ) 0 0 5.0              
assi ( resi  40 and name HN   ) ( resi  41 and name HB*  ) 0 0 5.0              
assi ( resi  40 and name HN   ) ( resi  41 and name HG*  ) 0 0 5.0              
assi ( resi  40 and name HN   ) ( resi  41 and name HN   ) 0 0 4.0              
assi ( resi  40 and name HG2* ) ( resi  42 and name HN   ) 0 0 5.0              
assi ( resi  41 and name HA   ) ( resi  41 and name HN   ) 0 0 5.0              
assi ( resi  41 and name HB*  ) ( resi  41 and name HN   ) 0 0 4.0              
assi ( resi  41 and name HG*  ) ( resi  41 and name HN   ) 0 0 4.0              
assi ( resi  41 and name HA   ) ( resi  42 and name HN   ) 0 0 4.0              
assi ( resi  41 and name HB*  ) ( resi  42 and name HN   ) 0 0 4.0              
assi ( resi  41 and name HG*  ) ( resi  42 and name HN   ) 0 0 5.0              
assi ( resi  41 and name HN   ) ( resi  42 and name HB*  ) 0 0 5.0              
assi ( resi  41 and name HN   ) ( resi  42 and name HN   ) 0 0 3.0              
assi ( resi  42 and name HA   ) ( resi  42 and name HN   ) 0 0 5.0              
assi ( resi  42 and name HB*  ) ( resi  42 and name HN   ) 0 0 4.0              
assi ( resi  42 and name HA   ) ( resi  43 and name HN   ) 0 0 2.5              
assi ( resi  42 and name HB*  ) ( resi  43 and name HN   ) 0 0 4.0              
assi ( resi  42 and name HN   ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  42 and name HN   ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  42 and name HN   ) ( resi  43 and name HN   ) 0 0 4.0              
assi ( resi  42 and name HB*  ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi  42 and name HB*  ) ( resi 120 and name HE22 ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi  43 and name HN   ) 0 0 3.0              
assi ( resi  43 and name HB*  ) ( resi  43 and name HN   ) 0 0 3.0              
assi ( resi  43 and name HD*  ) ( resi  43 and name HN   ) 0 0 4.0              
assi ( resi  43 and name HE*  ) ( resi  43 and name HN   ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi  44 and name HN   ) 0 0 2.5              
assi ( resi  43 and name HB*  ) ( resi  44 and name HN   ) 0 0 3.0              
assi ( resi  43 and name HD*  ) ( resi  44 and name HN   ) 0 0 5.0              
assi ( resi  43 and name HN   ) ( resi  44 and name HD*  ) 0 0 5.0              
assi ( resi  43 and name HN   ) ( resi  44 and name HN   ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi 121 and name HN   ) 0 0 5.0              
assi ( resi  43 and name HB*  ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HA   ) ( resi  44 and name HN   ) 0 0 4.0              
assi ( resi  44 and name HB   ) ( resi  44 and name HN   ) 0 0 3.0              
assi ( resi  44 and name HD*  ) ( resi  44 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HG2* ) ( resi  44 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HA   ) ( resi  45 and name HN   ) 0 0 2.5              
assi ( resi  44 and name HB   ) ( resi  45 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HD*  ) ( resi  45 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HG1* ) ( resi  45 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HG2* ) ( resi  45 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HA   ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HG2* ) ( resi  61 and name HN   ) 0 0 4.0              
assi ( resi  44 and name HG2* ) ( resi  63 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HB   ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi  44 and name HB   ) ( resi 120 and name HE22 ) 0 0 5.0              
assi ( resi  44 and name HD*  ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi  44 and name HD*  ) ( resi 120 and name HE22 ) 0 0 5.0              
assi ( resi  44 and name HB   ) ( resi 121 and name HN   ) 0 0 5.0              
assi ( resi  44 and name HB   ) ( resi 122 and name HN   ) 0 0 4.0              
assi ( resi  44 and name HN   ) ( resi 122 and name HA   ) 0 0 5.0              
assi ( resi  44 and name HN   ) ( resi 122 and name HB*  ) 0 0 5.0              
assi ( resi  44 and name HN   ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi  45 and name HN   ) 0 0 4.0              
assi ( resi  45 and name HB*  ) ( resi  45 and name HN   ) 0 0 4.0              
assi ( resi  45 and name HA   ) ( resi  46 and name HN   ) 0 0 2.5              
assi ( resi  45 and name HB*  ) ( resi  46 and name HN   ) 0 0 4.0              
assi ( resi  45 and name HD2  ) ( resi  46 and name HN   ) 0 0 4.0              
assi ( resi  45 and name HN   ) ( resi  46 and name HN   ) 0 0 5.0              
assi ( resi  45 and name HD2  ) ( resi  47 and name HN   ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  45 and name HB*  ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  45 and name HD2  ) ( resi  61 and name HE21 ) 0 0 5.0              
assi ( resi  45 and name HN   ) ( resi  61 and name HB*  ) 0 0 4.0              
assi ( resi  45 and name HN   ) ( resi  61 and name HG*  ) 0 0 5.0              
assi ( resi  45 and name HN   ) ( resi  61 and name HN   ) 0 0 4.0              
assi ( resi  45 and name HN   ) ( resi  62 and name HA*  ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi 122 and name HN   ) 0 0 4.0              
assi ( resi  45 and name HA   ) ( resi 124 and name HN   ) 0 0 5.0              
assi ( resi  46 and (name HD* or name HG2*)) ( resi  46 and name HN   ) 0 0 4.0 
assi ( resi  46 and name HA   ) ( resi  46 and name HN   ) 0 0 4.0              
assi ( resi  46 and name HB   ) ( resi  46 and name HN   ) 0 0 4.0              
assi ( resi  46 and name HG1* ) ( resi  46 and name HN   ) 0 0 4.0              
assi ( resi  46 and (name HD* or name HG2*)) ( resi  47 and name HN   ) 0 0 3.0 
assi ( resi  46 and name HA   ) ( resi  47 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HB   ) ( resi  47 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HG1* ) ( resi  47 and name HN   ) 0 0 4.0              
assi ( resi  46 and name HN   ) ( resi  47 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi  59 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi  60 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi  61 and name HN   ) 0 0 4.0              
assi ( resi  46 and name HG1* ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  46 and (name HD* or name HG2*)) ( resi 107 and name HN   ) 0 0 4.0 
assi ( resi  46 and (name HD* or name HG2*)) ( resi 108 and name HN   ) 0 0 5.0 
assi ( resi  46 and name HN   ) ( resi 122 and name HB*  ) 0 0 5.0              
assi ( resi  46 and name HN   ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HN   ) ( resi 123 and name HA   ) 0 0 4.0              
assi ( resi  46 and name HN   ) ( resi 123 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HG1* ) ( resi 124 and name HN   ) 0 0 5.0              
assi ( resi  46 and name HN   ) ( resi 124 and name HN   ) 0 0 4.0              
assi ( resi  47 and name HA   ) ( resi  47 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HB*  ) ( resi  47 and name HN   ) 0 0 4.0              
assi ( resi  47 and name HD*  ) ( resi  47 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HA   ) ( resi  48 and name HN   ) 0 0 4.0              
assi ( resi  47 and name HB*  ) ( resi  48 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HN   ) ( resi  48 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HB*  ) ( resi  59 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HN   ) ( resi  59 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HA   ) ( resi 124 and name HN   ) 0 0 4.0              
assi ( resi  47 and name HB*  ) ( resi 124 and name HN   ) 0 0 5.0              
assi ( resi  47 and name HA   ) ( resi 125 and name HN   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  48 and name HN   ) 0 0 5.0 
assi ( resi  48 and name HA   ) ( resi  48 and name HN   ) 0 0 5.0              
assi ( resi  48 and name HB   ) ( resi  48 and name HN   ) 0 0 5.0              
assi ( resi  48 and name HG1* ) ( resi  48 and name HN   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  49 and name HN   ) 0 0 4.0 
assi ( resi  48 and name HA   ) ( resi  49 and name HN   ) 0 0 2.5              
assi ( resi  48 and name HB   ) ( resi  49 and name HN   ) 0 0 5.0              
assi ( resi  48 and name HN   ) ( resi  49 and name HN   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  50 and name HE21 ) 0 0 5.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi  50 and name HE22 ) 0 0 5.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi 101 and name HN   ) 0 0 5.0 
assi ( resi  48 and name HG1* ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi  48 and name HG1* ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi 103 and name HN   ) 0 0 5.0 
assi ( resi  48 and name HG1* ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi 104 and name HN   ) 0 0 5.0 
assi ( resi  48 and name HN   ) ( resi 124 and name HN   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi 125 and name HN   ) 0 0 5.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi 126 and name HN   ) 0 0 4.0 
assi ( resi  48 and name HG1* ) ( resi 126 and name HN   ) 0 0 5.0              
assi ( resi  49 and name HA   ) ( resi  49 and name HN   ) 0 0 5.0              
assi ( resi  49 and name HB*  ) ( resi  49 and name HN   ) 0 0 5.0              
assi ( resi  49 and name HE21 ) ( resi  49 and name HE22 ) 0 0 2.5              
assi ( resi  49 and name HE21 ) ( resi  49 and name HG*  ) 0 0 4.0              
assi ( resi  49 and name HE22 ) ( resi  49 and name HG*  ) 0 0 4.0              
assi ( resi  49 and name HG*  ) ( resi  49 and name HN   ) 0 0 3.0              
assi ( resi  49 and name HE21 ) ( resi  51 and name HD*  ) 0 0 5.0              
assi ( resi  49 and name HE21 ) ( resi  57 and (name HB* or name HG)) 0 0 5.0   
assi ( resi  49 and name HE21 ) ( resi  57 and name HB*  ) 0 0 5.0              
assi ( resi  49 and name HE21 ) ( resi  57 and name HD*  ) 0 0 5.0              
assi ( resi  49 and name HE22 ) ( resi  57 and (name HB* or name HG)) 0 0 5.0   
assi ( resi  49 and name HE22 ) ( resi  57 and name HD*  ) 0 0 4.0              
assi ( resi  49 and name HE21 ) ( resi  59 and name HG2* ) 0 0 5.0              
assi ( resi  49 and name HE22 ) ( resi  59 and name HG2* ) 0 0 5.0              
assi ( resi  49 and name HN   ) ( resi  59 and name HN   ) 0 0 5.0              
assi ( resi  50 and name HA   ) ( resi  50 and name HN   ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  50 and name HE21 ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  50 and name HE22 ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  50 and name HN   ) 0 0 5.0              
assi ( resi  50 and name HE21 ) ( resi  50 and name HE22 ) 0 0 3.0              
assi ( resi  50 and name HE21 ) ( resi  50 and name HG*  ) 0 0 5.0              
assi ( resi  50 and name HE22 ) ( resi  50 and name HG*  ) 0 0 5.0              
assi ( resi  50 and name HG*  ) ( resi  50 and name HN   ) 0 0 5.0              
assi ( resi  50 and name HA   ) ( resi  51 and name HN   ) 0 0 2.5              
assi ( resi  50 and name HB*  ) ( resi  51 and name HN   ) 0 0 5.0              
assi ( resi  50 and name HG*  ) ( resi  51 and name HN   ) 0 0 4.0              
assi ( resi  50 and name HE21 ) ( resi  53 and name HA*  ) 0 0 5.0              
assi ( resi  50 and name HE22 ) ( resi  53 and name HA*  ) 0 0 5.0              
assi ( resi  50 and name HE21 ) ( resi  54 and name HA   ) 0 0 5.0              
assi ( resi  50 and name HE21 ) ( resi  54 and name HN   ) 0 0 5.0              
assi ( resi  50 and name HE22 ) ( resi  54 and name HA   ) 0 0 5.0              
assi ( resi  50 and name HE21 ) ( resi  56 and name HB   ) 0 0 5.0              
assi ( resi  50 and name HE21 ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  50 and name HE22 ) ( resi  56 and name HB   ) 0 0 5.0              
assi ( resi  50 and name HE22 ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  50 and name HN   ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  51 and name HA   ) ( resi  51 and name HN   ) 0 0 3.0              
assi ( resi  51 and name HB*  ) ( resi  51 and name HN   ) 0 0 3.0              
assi ( resi  51 and name HD*  ) ( resi  51 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 HB*  ) ( resi  52 and name HN   ) 0 0 5.0              
assi ( resi  51 and name HN   ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  51 and name HN   ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  52 and name HA   ) ( resi  52 and name HD21 ) 0 0 5.0              
assi ( resi  52 and name HA   ) ( resi  52 and name HD22 ) 0 0 5.0              
assi ( resi  52 and name HA   ) ( resi  52 and name HN   ) 0 0 5.0              
assi ( resi  52 and name HB*  ) ( resi  52 and name HD21 ) 0 0 5.0              
assi ( resi  52 and name HB*  ) ( resi  52 and name HD22 ) 0 0 5.0              
assi ( resi  52 and name HB*  ) ( resi  52 and name HN   ) 0 0 4.0              
assi ( resi  52 and name HD21 ) ( resi  52 and name HD22 ) 0 0 2.5              
assi ( resi  52 and name HA   ) ( resi  53 and name HN   ) 0 0 3.0              
assi ( resi  52 and name HB*  ) ( resi  53 and name HN   ) 0 0 5.0              
assi ( resi  52 and name HB*  ) ( resi  54 and name HN   ) 0 0 5.0              
assi ( resi  52 and name HD21 ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  52 and name HD22 ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  53 and name HA*  ) ( resi  53 and name HN   ) 0 0 3.0              
assi ( resi  53 and name HA*  ) ( resi  54 and name HN   ) 0 0 4.0              
assi ( resi  53 and name HN   ) ( resi  54 and name HB*  ) 0 0 5.0              
assi ( resi  53 and name HN   ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  53 and name HN   ) ( resi  54 and name HN   ) 0 0 4.0              
assi ( resi  54 and name HA   ) ( resi  54 and name HN   ) 0 0 3.0              
assi ( resi  54 and name HB*  ) ( resi  54 and name HN   ) 0 0 5.0              
assi ( resi  54 and name HD*  ) ( resi  54 and name HN   ) 0 0 5.0              
assi ( resi  54 and name HG*  ) ( resi  54 and name HN   ) 0 0 5.0              
assi ( resi  54 and name HA   ) ( resi  55 and name HN   ) 0 0 5.0              
assi ( resi  54 and name HB*  ) ( resi  55 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HA   ) ( resi  55 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HB*  ) ( resi  55 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HA   ) ( resi  56 and name HN   ) 0 0 2.5              
assi ( resi  55 and name HB*  ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HD*  ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HE*  ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HG*  ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  55 and name HN   ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HA   ) ( resi  56 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi  56 and name HN   ) 0 0 3.0              
assi ( resi  56 and name HG2* ) ( resi  56 and name HN   ) 0 0 4.0              
assi ( resi  56 and name HA   ) ( resi  57 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi  57 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi  57 and name HN   ) 0 0 3.0              
assi ( resi  56 and name HG2* ) ( resi  58 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HN   ) ( resi  99 and name HE22 ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi 100 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi 100 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HN   ) ( resi 100 and name HA*  ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi 101 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi 101 and name HN   ) 0 0 4.0              
assi ( resi  56 and name HG2* ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi  57 and (name HB* or name HG)) ( resi  57 and name HN   ) 0 0 4.0   
assi ( resi  57 and name HA   ) ( resi  57 and name HN   ) 0 0 5.0              
assi ( resi  57 and name HB*  ) ( resi  57 and name HN   ) 0 0 5.0              
assi ( resi  57 and name HD*  ) ( resi  57 and name HN   ) 0 0 5.0              
assi ( resi  57 and (name HB* or name HG)) ( resi  58 and name HN   ) 0 0 4.0   
assi ( resi  57 and name HA   ) ( resi  58 and name HN   ) 0 0 5.0              
assi ( resi  57 and name HB*  ) ( resi  58 and name HN   ) 0 0 5.0              
assi ( resi  57 and name HD*  ) ( resi  58 and name HN   ) 0 0 5.0              
assi ( resi  57 and (name HB* or name HG)) ( resi  97 and name HE21 ) 0 0 5.0   
assi ( resi  57 and (name HB* or name HG)) ( resi  97 and name HE22 ) 0 0 5.0   
assi ( resi  57 and name HB*  ) ( resi  97 and name HE21 ) 0 0 5.0              
assi ( resi  57 and name HB*  ) ( resi  97 and name HE22 ) 0 0 5.0              
assi ( resi  57 and name HA   ) ( resi  99 and name HN   ) 0 0 5.0              
assi ( resi  57 and (name HB* or name HG)) ( resi 100 and name HN   ) 0 0 5.0   
assi ( resi  57 and name HA   ) ( resi 100 and name HN   ) 0 0 3.0              
assi ( resi  57 and name HB*  ) ( resi 100 and name HN   ) 0 0 5.0              
assi ( resi  57 and name HD*  ) ( resi 100 and name HN   ) 0 0 4.0              
assi ( resi  58 and name HA   ) ( resi  58 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi  58 and name HN   ) 0 0 4.0              
assi ( resi  58 and name HG1  ) ( resi  58 and name HN   ) 0 0 4.0              
assi ( resi  58 and name HG2* ) ( resi  58 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HA   ) ( resi  59 and name HN   ) 0 0 2.5              
assi ( resi  58 and name HG1  ) ( resi  59 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HG2* ) ( resi  59 and name HN   ) 0 0 3.0              
assi ( resi  58 and name HB   ) ( resi  98 and name HN   ) 0 0 4.0              
assi ( resi  58 and name HN   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  58 and name HN   ) ( resi  98 and name HN   ) 0 0 4.0              
assi ( resi  58 and name HN   ) ( resi  99 and name HA   ) 0 0 5.0              
assi ( resi  58 and name HN   ) ( resi 100 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HG1  ) ( resi 101 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HA   ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi 102 and name HN   ) 0 0 4.0              
assi ( resi  58 and name HG1  ) ( resi 102 and name HN   ) 0 0 3.0              
assi ( resi  58 and name HG2* ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HN   ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HG1  ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi  58 and name HG2* ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  59 and name HN   ) 0 0 4.0              
assi ( resi  59 and name HB   ) ( resi  59 and name HN   ) 0 0 4.0              
assi ( resi  59 and name HG2* ) ( resi  59 and name HN   ) 0 0 4.0              
assi ( resi  59 and name HA   ) ( resi  60 and name HN   ) 0 0 2.5              
assi ( resi  59 and name HB   ) ( resi  60 and name HN   ) 0 0 4.0              
assi ( resi  59 and name HG2* ) ( resi  60 and name HN   ) 0 0 4.0              
assi ( resi  59 and name HN   ) ( resi  60 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  98 and name HN   ) 0 0 4.0              
assi ( resi  60 and name HA   ) ( resi  60 and name HN   ) 0 0 4.0              
assi ( resi  60 and name HB   ) ( resi  60 and name HN   ) 0 0 5.0              
assi ( resi  60 and name HG*  ) ( resi  60 and name HN   ) 0 0 3.0              
assi ( resi  60 and name HA   ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  60 and name HG*  ) ( resi  61 and name HN   ) 0 0 3.0              
assi ( resi  60 and name HN   ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  60 and name HN   ) ( resi  95 and name HB   ) 0 0 5.0              
assi ( resi  60 and name HN   ) ( resi  95 and name HG*  ) 0 0 4.0              
assi ( resi  60 and name HB   ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  60 and name HN   ) ( resi  96 and name HB   ) 0 0 4.0              
assi ( resi  60 and name HN   ) ( resi  96 and name HN   ) 0 0 4.0              
assi ( resi  60 and name HN   ) ( resi  97 and name HA   ) 0 0 4.0              
assi ( resi  60 and name HN   ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HA   ) ( resi  61 and name HN   ) 0 0 4.0              
assi ( resi  61 and name HB*  ) ( resi  61 and name HE21 ) 0 0 5.0              
assi ( resi  61 and name HB*  ) ( resi  61 and name HE22 ) 0 0 5.0              
assi ( resi  61 and name HB*  ) ( resi  61 and name HN   ) 0 0 4.0              
assi ( resi  61 and name HE21 ) ( resi  61 and name HE22 ) 0 0 2.5              
assi ( resi  61 and name HE21 ) ( resi  61 and name HG*  ) 0 0 3.0              
assi ( resi  61 and name HE22 ) ( resi  61 and name HG*  ) 0 0 4.0              
assi ( resi  61 and name HG*  ) ( resi  61 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HA   ) ( resi  62 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HB*  ) ( resi  62 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HE21 ) ( resi  62 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HG*  ) ( resi  62 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HN   ) ( resi  62 and name HN   ) 0 0 5.0              
assi ( resi  61 and name HE21 ) ( resi  92 and name HB*  ) 0 0 5.0              
assi ( resi  61 and name HE21 ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  61 and name HE21 ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  61 and name HE22 ) ( resi  92 and name HB*  ) 0 0 5.0              
assi ( resi  61 and name HE22 ) ( resi  92 and name HD*  ) 0 0 4.0              
assi ( resi  61 and name HE22 ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  61 and name HE21 ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  61 and name HE22 ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  61 and name HN   ) ( resi  95 and name HG*  ) 0 0 4.0              
assi ( resi  62 and name HA*  ) ( resi  62 and name HN   ) 0 0 3.0              
assi ( resi  62 and name HN   ) ( resi  63 and (name HG1* or name HG2*)) 0 0 5.0
assi ( resi  62 and name HN   ) ( resi  63 and name HB   ) 0 0 5.0              
assi ( resi  62 and name HN   ) ( resi  63 and name HD*  ) 0 0 5.0              
assi ( resi  62 and name HN   ) ( resi  63 and name HN   ) 0 0 4.0              
assi ( resi  62 and name HN   ) ( resi  95 and name HG*  ) 0 0 4.0              
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  63 and name HN   ) 0 0 5.0
assi ( resi  63 and name HA   ) ( resi  63 and name HN   ) 0 0 5.0              
assi ( resi  63 and name HB   ) ( resi  63 and name HN   ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi  63 and name HN   ) 0 0 5.0              
assi ( resi  63 and name HG1* ) ( resi  63 and name HN   ) 0 0 5.0              
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  64 and name HN   ) 0 0 3.0
assi ( resi  63 and name HA   ) ( resi  64 and name HN   ) 0 0 2.5              
assi ( resi  63 and name HB   ) ( resi  64 and name HN   ) 0 0 4.0              
assi ( resi  63 and name HD*  ) ( resi  64 and name HN   ) 0 0 4.0              
assi ( resi  63 and name HG1* ) ( resi  64 and name HN   ) 0 0 5.0              
assi ( resi  63 and name HN   ) ( resi  64 and name HN   ) 0 0 5.0              
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  65 and name HN   ) 0 0 5.0
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  66 and name HN   ) 0 0 5.0
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  67 and name HN   ) 0 0 4.0
assi ( resi  64 and name HA   ) ( resi  64 and name HN   ) 0 0 3.0              
assi ( resi  64 and name HB*  ) ( resi  64 and name HN   ) 0 0 3.0              
assi ( resi  64 and name HA   ) ( resi  65 and name HN   ) 0 0 4.0              
assi ( resi  64 and name HB*  ) ( resi  65 and name HN   ) 0 0 4.0              
assi ( resi  64 and name HN   ) ( resi  65 and name HN   ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  66 and name HN   ) 0 0 4.0              
assi ( resi  64 and name HN   ) ( resi  66 and name HN   ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  67 and name HN   ) 0 0 5.0              
assi ( resi  64 and name HN   ) ( resi  67 and name HB*  ) 0 0 5.0              
assi ( resi  64 and name HN   ) ( resi  67 and name HD*  ) 0 0 5.0              
assi ( resi  64 and name HN   ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  64 and name HN   ) ( resi  72 and name HD*  ) 0 0 5.0              
assi ( resi  64 and name HN   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  64 and name HN   ) ( resi 115 and name HG   ) 0 0 5.0              
assi ( resi  65 and name HA   ) ( resi  65 and name HN   ) 0 0 4.0              
assi ( resi  65 and name HB*  ) ( resi  65 and name HN   ) 0 0 4.0              
assi ( resi  65 and name HA   ) ( resi  66 and name HN   ) 0 0 4.0              
assi ( resi  65 and name HB*  ) ( resi  66 and name HN   ) 0 0 4.0              
assi ( resi  65 and name HN   ) ( resi  66 and name HN   ) 0 0 4.0              
assi ( resi  65 and name HN   ) ( resi  67 and name HN   ) 0 0 5.0              
assi ( resi  66 and name HA   ) ( resi  66 and name HN   ) 0 0 4.0              
assi ( resi  66 and name HB*  ) ( resi  66 and name HN   ) 0 0 4.0              
assi ( resi  66 and name HA   ) ( resi  67 and name HN   ) 0 0 5.0              
assi ( resi  66 and name HB*  ) ( resi  67 and name HN   ) 0 0 5.0              
assi ( resi  66 and name HN   ) ( resi  67 and name HD*  ) 0 0 5.0              
assi ( resi  66 and name HN   ) ( resi  67 and name HN   ) 0 0 4.0              
assi ( resi  67 and name HA   ) ( resi  67 and name HN   ) 0 0 4.0              
assi ( resi  67 and name HB*  ) ( resi  67 and name HN   ) 0 0 4.0              
assi ( resi  67 and name HD*  ) ( resi  67 and name HN   ) 0 0 5.0              
assi ( resi  67 and name HA   ) ( resi  68 and name HN   ) 0 0 3.0              
assi ( resi  67 and name HB*  ) ( resi  68 and name HN   ) 0 0 4.0              
assi ( resi  67 and name HD*  ) ( resi  68 and name HN   ) 0 0 5.0              
assi ( resi  67 and name HN   ) ( resi  68 and name HN   ) 0 0 5.0              
assi ( resi  67 and name HN   ) ( resi  72 and name HD*  ) 0 0 5.0              
assi ( resi  67 and name HN   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  68 and name HA   ) ( resi  68 and name HN   ) 0 0 5.0              
assi ( resi  68 and name HB*  ) ( resi  68 and name HN   ) 0 0 3.0              
assi ( resi  68 and name HA   ) ( resi  69 and name HN   ) 0 0 5.0              
assi ( resi  68 and name HB*  ) ( resi  69 and name HN   ) 0 0 5.0              
assi ( resi  68 and name HN   ) ( resi  69 and name HN   ) 0 0 5.0              
assi ( resi  68 and name HB*  ) ( resi  70 and name HN   ) 0 0 5.0              
assi ( resi  68 and name HA   ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  68 and name HB*  ) ( resi  71 and name HN   ) 0 0 4.0              
assi ( resi  69 and name HA   ) ( resi  69 and name HN   ) 0 0 4.0              
assi ( resi  69 and name HB*  ) ( resi  69 and name HN   ) 0 0 3.0              
assi ( resi  69 and name HN   ) ( resi  70 and name HN   ) 0 0 4.0              
assi ( resi  69 and name HN   ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  69 and name HN   ) ( resi  72 and name HD*  ) 0 0 4.0              
assi ( resi  70 and name HA   ) ( resi  70 and name HN   ) 0 0 3.0              
assi ( resi  70 and name HB*  ) ( resi  70 and name HN   ) 0 0 5.0              
assi ( resi  70 and name HE*  ) ( resi  70 and name HN   ) 0 0 5.0              
assi ( resi  70 and name HA   ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  70 and name HB*  ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  70 and name HN   ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  71 and name HA   ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  71 and name HB*  ) ( resi  71 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HA   ) ( resi  72 and name HN   ) 0 0 3.0              
assi ( resi  72 and name HB*  ) ( resi  72 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HD*  ) ( resi  72 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HG   ) ( resi  72 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HA   ) ( resi  73 and name HN   ) 0 0 4.0              
assi ( resi  72 and name HB*  ) ( resi  73 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HD*  ) ( resi  73 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HG   ) ( resi  73 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HD*  ) ( resi  75 and name HN   ) 0 0 5.0              
assi ( resi  72 and name HD*  ) ( resi  76 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  73 and name HN   ) 0 0 4.0              
assi ( resi  73 and name HB   ) ( resi  73 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  73 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  74 and name HN   ) 0 0 4.0              
assi ( resi  73 and name HB   ) ( resi  74 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  74 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HN   ) ( resi  74 and name HN   ) 0 0 2.5              
assi ( resi  73 and name HA   ) ( resi  75 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  75 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HN   ) ( resi  75 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  76 and name HN   ) 0 0 4.0              
assi ( resi  73 and name HG*  ) ( resi  76 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HN   ) ( resi  76 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  84 and name HN   ) 0 0 4.0              
assi ( resi  73 and name HG*  ) ( resi  85 and name HN   ) 0 0 4.0              
assi ( resi  73 and name HG*  ) ( resi  86 and name HN   ) 0 0 5.0              
assi ( resi  73 and name HN   ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  97 and name HN   ) 0 0 4.0              
assi ( resi  74 and name HA   ) ( resi  74 and name HN   ) 0 0 5.0              
assi ( resi  74 and name HB*  ) ( resi  74 and name HN   ) 0 0 5.0              
assi ( resi  74 and name HA   ) ( resi  75 and name HN   ) 0 0 4.0              
assi ( resi  74 and name HB*  ) ( resi  75 and name HN   ) 0 0 2.5              
assi ( resi  74 and name HN   ) ( resi  75 and name HN   ) 0 0 3.0              
assi ( resi  74 and name HA   ) ( resi  76 and name HN   ) 0 0 5.0              
assi ( resi  74 and name HB*  ) ( resi  76 and name HN   ) 0 0 5.0              
assi ( resi  74 and name HN   ) ( resi  76 and name HN   ) 0 0 5.0              
assi ( resi  74 and name HA   ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  75 and name HA   ) ( resi  75 and name HN   ) 0 0 3.0              
assi ( resi  75 and name HB*  ) ( resi  75 and name HN   ) 0 0 2.5              
assi ( resi  75 and name HA   ) ( resi  76 and name HN   ) 0 0 4.0              
assi ( resi  75 and name HB*  ) ( resi  76 and name HN   ) 0 0 3.0              
assi ( resi  75 and name HN   ) ( resi  76 and name HB*  ) 0 0 5.0              
assi ( resi  75 and name HN   ) ( resi  76 and name HN   ) 0 0 3.0              
assi ( resi  75 and name HA   ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  75 and name HN   ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  75 and name HA   ) ( resi  78 and name HN   ) 0 0 4.0              
assi ( resi  75 and name HN   ) ( resi  78 and name HN   ) 0 0 5.0              
assi ( resi  75 and name HA   ) ( resi  79 and name HN   ) 0 0 5.0              
assi ( resi  75 and name HN   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  76 and name HA   ) ( resi  76 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HB*  ) ( resi  76 and name HN   ) 0 0 3.0              
assi ( resi  76 and name HD*  ) ( resi  76 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HA   ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi  77 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HD*  ) ( resi  77 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HA   ) ( resi  78 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HN   ) ( resi  78 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi  79 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HA   ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HN   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 105 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 106 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HZ   ) ( resi 106 and name HN   ) 0 0 4.0              
assi ( resi  76 and name HE*  ) ( resi 109 and name HN   ) 0 0 5.0              
assi ( resi  76 and name HN   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  77 and name HA   ) ( resi  77 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HB*  ) ( resi  77 and name HN   ) 0 0 2.5              
assi ( resi  77 and name HG*  ) ( resi  77 and name HN   ) 0 0 3.0              
assi ( resi  77 and name HB*  ) ( resi  78 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HN   ) ( resi  78 and name HN   ) 0 0 4.0              
assi ( resi  77 and name HN   ) ( resi  79 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HA   ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HB*  ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HG*  ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HA   ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HB*  ) ( resi  82 and name HN   ) 0 0 4.0              
assi ( resi  77 and name HG*  ) ( resi  82 and name HN   ) 0 0 4.0              
assi ( resi  77 and name HN   ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HB*  ) ( resi  84 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HE*  ) ( resi  84 and name HN   ) 0 0 4.0              
assi ( resi  77 and name HG*  ) ( resi  84 and name HN   ) 0 0 5.0              
assi ( resi  77 and name HN   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  78 and name HA   ) ( resi  78 and name HN   ) 0 0 3.0              
assi ( resi  78 and name HB*  ) ( resi  78 and name HN   ) 0 0 5.0              
assi ( resi  78 and name HA   ) ( resi  79 and name HN   ) 0 0 4.0              
assi ( resi  78 and name HB*  ) ( resi  79 and name HN   ) 0 0 3.0              
assi ( resi  78 and name HN   ) ( resi  79 and name HA   ) 0 0 5.0              
assi ( resi  78 and name HN   ) ( resi  79 and name HN   ) 0 0 3.0              
assi ( resi  78 and name HA   ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  78 and name HN   ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  78 and name HA   ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  78 and name HN   ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HA   ) ( resi  79 and name HN   ) 0 0 3.0              
assi ( resi  79 and name HB*  ) ( resi  79 and name HN   ) 0 0 3.0              
assi ( resi  79 and name HD*  ) ( resi  79 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HG*  ) ( resi  79 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HA   ) ( resi  80 and name HN   ) 0 0 4.0              
assi ( resi  79 and name HB*  ) ( resi  80 and name HN   ) 0 0 4.0              
assi ( resi  79 and name HG*  ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HN   ) ( resi  80 and name HA   ) 0 0 5.0              
assi ( resi  79 and name HN   ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HN   ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HN   ) ( resi  80 and name HN   ) 0 0 3.0              
assi ( resi  79 and name HA   ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HB*  ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HN   ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HN   ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  79 and name HE*  ) ( resi 108 and name HE21 ) 0 0 5.0              
assi ( resi  79 and name HE*  ) ( resi 108 and name HE22 ) 0 0 5.0              
assi ( resi  80 and name HA   ) ( resi  80 and name HN   ) 0 0 4.0              
assi ( resi  80 and name HB*  ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi  80 and name HN   ) 0 0 3.0              
assi ( resi  80 and name HE*  ) ( resi  80 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HA   ) ( resi  81 and name HN   ) 0 0 4.0              
assi ( resi  80 and name HB*  ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi  81 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HN   ) ( resi  81 and name HA   ) 0 0 5.0              
assi ( resi  80 and name HA   ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HB*  ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HN   ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  80 and name HB*  ) ( resi 105 and name HD21 ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi 105 and name HD21 ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi 105 and name HD22 ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 109 and name HN   ) 0 0 5.0              
assi ( resi  81 and name HA   ) ( resi  81 and name HN   ) 0 0 2.5              
assi ( resi  81 and name HB*  ) ( resi  81 and name HN   ) 0 0 3.0              
assi ( resi  81 and name HA   ) ( resi  82 and name HN   ) 0 0 5.0              
assi ( resi  81 and name HB*  ) ( resi  82 and name HN   ) 0 0 4.0              
assi ( resi  81 and name HN   ) ( resi  82 and name HN   ) 0 0 4.0              
assi ( resi  82 and name HA   ) ( resi  82 and name HN   ) 0 0 3.0              
assi ( resi  82 and name HB*  ) ( resi  82 and name HN   ) 0 0 4.0              
assi ( resi  82 and name HB*  ) ( resi  83 and name HN   ) 0 0 4.0              
assi ( resi  82 and name HN   ) ( resi  83 and name HN   ) 0 0 5.0              
assi ( resi  82 and name HB*  ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi  82 and name HB*  ) ( resi 102 and name HE22 ) 0 0 5.0              
assi ( resi  83 and name HA   ) ( resi  83 and name HD21 ) 0 0 4.0              
assi ( resi  83 and name HA   ) ( resi  83 and name HD22 ) 0 0 5.0              
assi ( resi  83 and name HA   ) ( resi  83 and name HN   ) 0 0 4.0              
assi ( resi  83 and name HB*  ) ( resi  83 and name HD21 ) 0 0 4.0              
assi ( resi  83 and name HB*  ) ( resi  83 and name HD22 ) 0 0 4.0              
assi ( resi  83 and name HB*  ) ( resi  83 and name HN   ) 0 0 4.0              
assi ( resi  83 and name HD21 ) ( resi  83 and name HD22 ) 0 0 2.5              
assi ( resi  83 and name HD21 ) ( resi  83 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HD22 ) ( resi  83 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HA   ) ( resi  84 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HB*  ) ( resi  84 and name HN   ) 0 0 4.0              
assi ( resi  83 and name HD21 ) ( resi  84 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HD22 ) ( resi  84 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HN   ) ( resi  84 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HN   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  83 and name HB*  ) ( resi  99 and name HN   ) 0 0 5.0              
assi ( resi  83 and name HD21 ) ( resi  99 and name HB*  ) 0 0 5.0              
assi ( resi  83 and name HD21 ) ( resi  99 and name HG*  ) 0 0 5.0              
assi ( resi  83 and name HN   ) ( resi  99 and name HB*  ) 0 0 5.0              
assi ( resi  83 and name HN   ) ( resi  99 and name HG*  ) 0 0 5.0              
assi ( resi  83 and name HN   ) ( resi  99 and name HN   ) 0 0 5.0              
assi ( resi  84 and name HA*  ) ( resi  84 and name HN   ) 0 0 4.0              
assi ( resi  84 and name HA*  ) ( resi  85 and name HN   ) 0 0 3.0              
assi ( resi  84 and name HN   ) ( resi  85 and name HN   ) 0 0 5.0              
assi ( resi  84 and name HA*  ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  84 and name HN   ) ( resi  98 and name HA   ) 0 0 5.0              
assi ( resi  84 and name HN   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  84 and name HA*  ) ( resi  99 and name HN   ) 0 0 4.0              
assi ( resi  85 and name HA   ) ( resi  85 and name HN   ) 0 0 5.0              
assi ( resi  85 and name HB   ) ( resi  85 and name HN   ) 0 0 4.0              
assi ( resi  85 and name HG2* ) ( resi  85 and name HN   ) 0 0 3.0              
assi ( resi  85 and name HB   ) ( resi  86 and name HN   ) 0 0 4.0              
assi ( resi  85 and name HG2* ) ( resi  86 and name HN   ) 0 0 4.0              
assi ( resi  85 and name HN   ) ( resi  86 and name HN   ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  96 and name HA   ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  97 and name HA   ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  97 and name HB*  ) 0 0 4.0              
assi ( resi  85 and name HN   ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  98 and name HA   ) 0 0 4.0              
assi ( resi  85 and name HN   ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  98 and name HD*  ) 0 0 4.0              
assi ( resi  85 and name HN   ) ( resi  98 and name HG   ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  85 and name HN   ) ( resi  99 and name HN   ) 0 0 5.0              
assi ( resi  86 and name HA   ) ( resi  86 and name HN   ) 0 0 5.0              
assi ( resi  86 and name HB   ) ( resi  86 and name HN   ) 0 0 3.0              
assi ( resi  86 and name HG*  ) ( resi  86 and name HN   ) 0 0 5.0              
assi ( resi  86 and name HA   ) ( resi  87 and name HN   ) 0 0 2.5              
assi ( resi  86 and name HB   ) ( resi  87 and name HN   ) 0 0 5.0              
assi ( resi  86 and name HN   ) ( resi  87 and name HN   ) 0 0 5.0              
assi ( resi  86 and name HN   ) ( resi  96 and name HA   ) 0 0 5.0              
assi ( resi  86 and name HN   ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HB   ) ( resi  87 and name HN   ) 0 0 4.0              
assi ( resi  87 and name HG1* ) ( resi  87 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HG2* ) ( resi  87 and name HN   ) 0 0 5.0              
assi ( resi  87 and (name HD* or name HG2*)) ( resi  88 and name HN   ) 0 0 5.0 
assi ( resi  87 and name HB   ) ( resi  88 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HG1* ) ( resi  88 and name HN   ) 0 0 4.0              
assi ( resi  87 and name HN   ) ( resi  88 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HG1* ) ( resi  89 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HG1* ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HN   ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  87 and name HN   ) ( resi  96 and name HA   ) 0 0 4.0              
assi ( resi  87 and name HN   ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  88 and name HA   ) ( resi  88 and name HN   ) 0 0 3.0              
assi ( resi  88 and name HB*  ) ( resi  88 and name HN   ) 0 0 2.5              
assi ( resi  88 and name HG*  ) ( resi  88 and name HN   ) 0 0 4.0              
assi ( resi  88 and name HA   ) ( resi  89 and name HN   ) 0 0 2.5              
assi ( resi  88 and name HB*  ) ( resi  89 and name HN   ) 0 0 4.0              
assi ( resi  88 and name HG*  ) ( resi  89 and name HN   ) 0 0 4.0              
assi ( resi  88 and name HN   ) ( resi  89 and name HN   ) 0 0 5.0              
assi ( resi  88 and name HA   ) ( resi  94 and name HN   ) 0 0 5.0              
assi ( resi  88 and name HA   ) ( resi  95 and name HN   ) 0 0 4.0              
assi ( resi  88 and name HN   ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HB*  ) ( resi  89 and name HN   ) 0 0 3.0              
assi ( resi  89 and name HD2  ) ( resi  89 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HN   ) ( resi  90 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HB*  ) ( resi  91 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  91 and name HN   ) 0 0 4.0              
assi ( resi  89 and name HB*  ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HN   ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HB*  ) ( resi  93 and name HN   ) 0 0 4.0              
assi ( resi  89 and name HN   ) ( resi  93 and name HN   ) 0 0 4.0              
assi ( resi  89 and name HN   ) ( resi  94 and name HA   ) 0 0 4.0              
assi ( resi  89 and name HB*  ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  89 and name HN   ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  90 and name HA   ) ( resi  91 and name HN   ) 0 0 4.0              
assi ( resi  90 and name HB*  ) ( resi  91 and name HN   ) 0 0 4.0              
assi ( resi  90 and name HD*  ) ( resi  91 and name HN   ) 0 0 5.0              
assi ( resi  90 and name HG*  ) ( resi  91 and name HN   ) 0 0 4.0              
assi ( resi  90 and name HB*  ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  91 and name HA   ) ( resi  91 and name HN   ) 0 0 4.0              
assi ( resi  91 and name HB*  ) ( resi  91 and name HN   ) 0 0 3.0              
assi ( resi  91 and name HG*  ) ( resi  91 and name HN   ) 0 0 4.0              
assi ( resi  91 and name HA   ) ( resi  92 and name HN   ) 0 0 4.0              
assi ( resi  91 and name HB*  ) ( resi  92 and name HN   ) 0 0 3.0              
assi ( resi  91 and name HG*  ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  91 and name HN   ) ( resi  92 and name HB*  ) 0 0 5.0              
assi ( resi  91 and name HN   ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  91 and name HN   ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  91 and name HN   ) ( resi  92 and name HN   ) 0 0 2.5              
assi ( resi  91 and name HB*  ) ( resi  93 and name HN   ) 0 0 5.0              
assi ( resi  91 and name HN   ) ( resi  93 and name HN   ) 0 0 4.0              
assi ( resi  92 and name HB*  ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  92 and name HD*  ) ( resi  92 and name HN   ) 0 0 4.0              
assi ( resi  92 and name HE*  ) ( resi  92 and name HN   ) 0 0 5.0              
assi ( resi  92 and name HB*  ) ( resi  93 and name HN   ) 0 0 5.0              
assi ( resi  92 and name HD*  ) ( resi  93 and name HN   ) 0 0 5.0              
assi ( resi  92 and name HN   ) ( resi  93 and name HA*  ) 0 0 5.0              
assi ( resi  92 and name HN   ) ( resi  95 and name HG*  ) 0 0 4.0              
assi ( resi  93 and name HA*  ) ( resi  93 and name HN   ) 0 0 3.0              
assi ( resi  93 and name HA*  ) ( resi  94 and name HN   ) 0 0 3.0              
assi ( resi  93 and name HN   ) ( resi  94 and name HN   ) 0 0 4.0              
assi ( resi  93 and name HN   ) ( resi  95 and name HG*  ) 0 0 4.0              
assi ( resi  94 and name HA   ) ( resi  94 and name HN   ) 0 0 3.0              
assi ( resi  94 and name HB*  ) ( resi  94 and name HN   ) 0 0 5.0              
assi ( resi  94 and name HG*  ) ( resi  94 and name HN   ) 0 0 5.0              
assi ( resi  94 and name HA   ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  94 and name HB*  ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  94 and name HG*  ) ( resi  95 and name HN   ) 0 0 4.0              
assi ( resi  94 and name HN   ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  94 and name HN   ) ( resi  95 and name HN   ) 0 0 4.0              
assi ( resi  95 and name HA   ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  95 and name HB   ) ( resi  95 and name HN   ) 0 0 5.0              
assi ( resi  95 and name HG*  ) ( resi  95 and name HN   ) 0 0 2.5              
assi ( resi  95 and name HA   ) ( resi  96 and name HN   ) 0 0 2.5              
assi ( resi  95 and name HB   ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  95 and name HG*  ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  95 and name HN   ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  96 and name HA   ) ( resi  96 and name HN   ) 0 0 4.0              
assi ( resi  96 and name HB   ) ( resi  96 and name HN   ) 0 0 3.0              
assi ( resi  96 and name HD*  ) ( resi  96 and name HN   ) 0 0 5.0              
assi ( resi  96 and name HG1* ) ( resi  96 and name HN   ) 0 0 4.0              
assi ( resi  96 and name HG2* ) ( resi  96 and name HN   ) 0 0 4.0              
assi ( resi  96 and name HA   ) ( resi  97 and name HN   ) 0 0 2.5              
assi ( resi  96 and name HB   ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  96 and name HD*  ) ( resi  97 and name HN   ) 0 0 3.0              
assi ( resi  96 and name HG2* ) ( resi  97 and name HN   ) 0 0 3.0              
assi ( resi  96 and name HN   ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  97 and name HA   ) ( resi  97 and name HE21 ) 0 0 5.0              
assi ( resi  97 and name HA   ) ( resi  97 and name HN   ) 0 0 4.0              
assi ( resi  97 and name HB*  ) ( resi  97 and name HE21 ) 0 0 5.0              
assi ( resi  97 and name HB*  ) ( resi  97 and name HE22 ) 0 0 5.0              
assi ( resi  97 and name HB*  ) ( resi  97 and name HN   ) 0 0 3.0              
assi ( resi  97 and name HE21 ) ( resi  97 and name HE22 ) 0 0 2.5              
assi ( resi  97 and name HE21 ) ( resi  97 and name HG*  ) 0 0 5.0              
assi ( resi  97 and name HE22 ) ( resi  97 and name HG*  ) 0 0 5.0              
assi ( resi  97 and name HG*  ) ( resi  97 and name HN   ) 0 0 5.0              
assi ( resi  97 and name HA   ) ( resi  98 and name HN   ) 0 0 2.5              
assi ( resi  97 and name HB*  ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  97 and name HG*  ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  97 and name HN   ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HA   ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HB*  ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HG   ) ( resi  98 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HA   ) ( resi  99 and name HN   ) 0 0 2.5              
assi ( resi  98 and name HB*  ) ( resi  99 and name HN   ) 0 0 2.5              
assi ( resi  98 and name HD*  ) ( resi  99 and name HN   ) 0 0 4.0              
assi ( resi  98 and name HG   ) ( resi  99 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HN   ) ( resi  99 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi  99 and name HA   ) ( resi  99 and name HE21 ) 0 0 5.0              
assi ( resi  99 and name HA   ) ( resi  99 and name HN   ) 0 0 3.0              
assi ( resi  99 and name HB*  ) ( resi  99 and name HE21 ) 0 0 5.0              
assi ( resi  99 and name HB*  ) ( resi  99 and name HN   ) 0 0 3.0              
assi ( resi  99 and name HE21 ) ( resi  99 and name HE22 ) 0 0 2.5              
assi ( resi  99 and name HE21 ) ( resi  99 and name HG*  ) 0 0 4.0              
assi ( resi  99 and name HE22 ) ( resi  99 and name HG*  ) 0 0 5.0              
assi ( resi  99 and name HG*  ) ( resi  99 and name HN   ) 0 0 4.0              
assi ( resi  99 and name HA   ) ( resi 100 and name HN   ) 0 0 2.5              
assi ( resi  99 and name HB*  ) ( resi 100 and name HN   ) 0 0 4.0              
assi ( resi  99 and name HG*  ) ( resi 100 and name HN   ) 0 0 5.0              
assi ( resi  99 and name HN   ) ( resi 100 and name HN   ) 0 0 5.0              
assi ( resi 100 and name HA*  ) ( resi 100 and name HN   ) 0 0 3.0              
assi ( resi 100 and name HA*  ) ( resi 101 and name HN   ) 0 0 3.0              
assi ( resi 100 and name HN   ) ( resi 101 and name HN   ) 0 0 5.0              
assi ( resi 100 and name HA*  ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi 100 and name HA*  ) ( resi 102 and name HE22 ) 0 0 5.0              
assi ( resi 101 and name HA   ) ( resi 101 and name HN   ) 0 0 4.0              
assi ( resi 101 and name HB*  ) ( resi 101 and name HN   ) 0 0 3.0              
assi ( resi 101 and name HA   ) ( resi 102 and name HN   ) 0 0 3.0              
assi ( resi 101 and name HB*  ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi 101 and name HN   ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi 101 and name HN   ) ( resi 102 and name HE22 ) 0 0 5.0              
assi ( resi 101 and name HA   ) ( resi 103 and name HN   ) 0 0 4.0              
assi ( resi 102 and name HA   ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 102 and name HE22 ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 102 and name HN   ) 0 0 4.0              
assi ( resi 102 and name HB*  ) ( resi 102 and name HE21 ) 0 0 5.0              
assi ( resi 102 and name HB*  ) ( resi 102 and name HE22 ) 0 0 5.0              
assi ( resi 102 and name HB*  ) ( resi 102 and name HN   ) 0 0 5.0              
assi ( resi 102 and name HE21 ) ( resi 102 and name HE22 ) 0 0 2.5              
assi ( resi 102 and name HE21 ) ( resi 102 and name HG*  ) 0 0 4.0              
assi ( resi 102 and name HE22 ) ( resi 102 and name HG*  ) 0 0 4.0              
assi ( resi 102 and name HG*  ) ( resi 102 and name HN   ) 0 0 4.0              
assi ( resi 102 and name HA   ) ( resi 103 and name HN   ) 0 0 4.0              
assi ( resi 102 and name HB*  ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi 102 and name HG*  ) ( resi 103 and name HN   ) 0 0 5.0              
assi ( resi 102 and name HN   ) ( resi 103 and name HN   ) 0 0 4.0              
assi ( resi 102 and name HA   ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 105 and name HD21 ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 105 and name HD22 ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 105 and name HN   ) 0 0 4.0              
assi ( resi 102 and name HE21 ) ( resi 105 and name HD21 ) 0 0 5.0              
assi ( resi 102 and name HE22 ) ( resi 105 and name HD21 ) 0 0 5.0              
assi ( resi 102 and name HN   ) ( resi 105 and name HN   ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 102 and name HB*  ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 103 and name HA   ) ( resi 103 and name HN   ) 0 0 4.0              
assi ( resi 103 and name HA   ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 103 and name HN   ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 103 and name HA   ) ( resi 105 and name HN   ) 0 0 5.0              
assi ( resi 103 and name HA   ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 103 and name HA   ) ( resi 107 and name HN   ) 0 0 5.0              
assi ( resi 103 and name HE   ) ( resi 126 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HA   ) ( resi 104 and name HN   ) 0 0 4.0              
assi ( resi 104 and name HB*  ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HD*  ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HE*  ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HG*  ) ( resi 104 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HA   ) ( resi 105 and name HN   ) 0 0 4.0              
assi ( resi 104 and name HB*  ) ( resi 105 and name HN   ) 0 0 3.0              
assi ( resi 104 and name HD*  ) ( resi 105 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HG*  ) ( resi 105 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HN   ) ( resi 105 and name HN   ) 0 0 3.0              
assi ( resi 104 and name HA   ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HB*  ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 104 and name HN   ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 105 and name HA   ) ( resi 105 and name HD21 ) 0 0 4.0              
assi ( resi 105 and name HA   ) ( resi 105 and name HD22 ) 0 0 5.0              
assi ( resi 105 and name HA   ) ( resi 105 and name HN   ) 0 0 3.0              
assi ( resi 105 and name HB*  ) ( resi 105 and name HD21 ) 0 0 4.0              
assi ( resi 105 and name HB*  ) ( resi 105 and name HD22 ) 0 0 4.0              
assi ( resi 105 and name HB*  ) ( resi 105 and name HN   ) 0 0 3.0              
assi ( resi 105 and name HD21 ) ( resi 105 and name HD22 ) 0 0 2.5              
assi ( resi 105 and name HB*  ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 105 and name HN   ) ( resi 106 and name HN   ) 0 0 4.0              
assi ( resi 105 and name HN   ) ( resi 107 and name HN   ) 0 0 5.0              
assi ( resi 105 and name HA   ) ( resi 108 and name HN   ) 0 0 5.0              
assi ( resi 105 and name HB*  ) ( resi 108 and name HN   ) 0 0 5.0              
assi ( resi 105 and name HN   ) ( resi 108 and name HN   ) 0 0 5.0              
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 106 and name HN   ) 0 0 3.0
assi ( resi 106 and name HA   ) ( resi 106 and name HN   ) 0 0 4.0              
assi ( resi 106 and name HB   ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 106 and name HD*  ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 106 and name HG1* ) ( resi 106 and name HN   ) 0 0 5.0              
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 107 and name HN   ) 0 0 3.0
assi ( resi 106 and name HA   ) ( resi 107 and name HN   ) 0 0 4.0              
assi ( resi 106 and name HB   ) ( resi 107 and name HN   ) 0 0 4.0              
assi ( resi 106 and name HD*  ) ( resi 107 and name HN   ) 0 0 5.0              
assi ( resi 106 and name HG1* ) ( resi 107 and name HN   ) 0 0 5.0              
assi ( resi 106 and name HN   ) ( resi 107 and name HN   ) 0 0 4.0              
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 108 and name HN   ) 0 0 4.0
assi ( resi 106 and name HA   ) ( resi 108 and name HN   ) 0 0 5.0              
assi ( resi 106 and name HN   ) ( resi 108 and name HN   ) 0 0 5.0              
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 109 and name HN   ) 0 0 5.0
assi ( resi 106 and name HA   ) ( resi 109 and name HN   ) 0 0 4.0              
assi ( resi 106 and name HD*  ) ( resi 109 and name HN   ) 0 0 5.0              
assi ( resi 106 and name HN   ) ( resi 109 and name HN   ) 0 0 5.0              
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 110 and name HN   ) 0 0 5.0
assi ( resi 106 and name HA   ) ( resi 110 and name HN   ) 0 0 5.0              
assi ( resi 107 and name HA   ) ( resi 107 and name HN   ) 0 0 3.0              
assi ( resi 107 and name HB*  ) ( resi 107 and name HN   ) 0 0 3.0              
assi ( resi 107 and name HB*  ) ( resi 108 and name HN   ) 0 0 4.0              
assi ( resi 107 and name HN   ) ( resi 108 and name HB*  ) 0 0 5.0              
assi ( resi 107 and name HN   ) ( resi 108 and name HN   ) 0 0 4.0              
assi ( resi 107 and name HN   ) ( resi 109 and name HN   ) 0 0 5.0              
assi ( resi 107 and name HA   ) ( resi 110 and name HN   ) 0 0 4.0              
assi ( resi 108 and name HA   ) ( resi 108 and name HE21 ) 0 0 5.0              
assi ( resi 108 and name HA   ) ( resi 108 and name HN   ) 0 0 3.0              
assi ( resi 108 and name HB*  ) ( resi 108 and name HE21 ) 0 0 5.0              
assi ( resi 108 and name HB*  ) ( resi 108 and name HE22 ) 0 0 4.0              
assi ( resi 108 and name HB*  ) ( resi 108 and name HN   ) 0 0 2.5              
assi ( resi 108 and name HE21 ) ( resi 108 and name HE22 ) 0 0 2.5              
assi ( resi 108 and name HE21 ) ( resi 108 and name HG*  ) 0 0 4.0              
assi ( resi 108 and name HE22 ) ( resi 108 and name HG*  ) 0 0 4.0              
assi ( resi 108 and name HG*  ) ( resi 108 and name HN   ) 0 0 4.0              
assi ( resi 108 and name HA   ) ( resi 109 and name HN   ) 0 0 4.0              
assi ( resi 108 and name HB*  ) ( resi 109 and name HN   ) 0 0 3.0              
assi ( resi 108 and name HE21 ) ( resi 109 and name HA   ) 0 0 5.0              
assi ( resi 108 and name HG*  ) ( resi 109 and name HN   ) 0 0 5.0              
assi ( resi 108 and name HN   ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi 108 and name HN   ) ( resi 109 and name HN   ) 0 0 4.0              
assi ( resi 108 and name HN   ) ( resi 110 and name HN   ) 0 0 5.0              
assi ( resi 108 and name HA   ) ( resi 111 and name HN   ) 0 0 5.0              
assi ( resi 108 and name HE21 ) ( resi 111 and name HG*  ) 0 0 5.0              
assi ( resi 108 and name HE22 ) ( resi 111 and name HG*  ) 0 0 5.0              
assi ( resi 108 and name HE21 ) ( resi 112 and name HB*  ) 0 0 5.0              
assi ( resi 108 and name HE21 ) ( resi 112 and name HN   ) 0 0 5.0              
assi ( resi 108 and name HE22 ) ( resi 112 and name HB*  ) 0 0 5.0              
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 109 and name HN   
assi ( resi 109 and name HA   ) ( resi 109 and name HN   ) 0 0 3.0              
assi ( resi 109 and name HB*  ) ( resi 109 and name HN   ) 0 0 3.0              
assi ( resi 109 and name HA   ) ( resi 110 and name HN   ) 0 0 5.0              
assi ( resi 109 and name HB*  ) ( resi 110 and name HN   ) 0 0 4.0              
assi ( resi 109 and name HD*  ) ( resi 110 and name HN   ) 0 0 4.0              
assi ( resi 109 and name HN   ) ( resi 110 and name HD*  ) 0 0 5.0              
assi ( resi 109 and name HA   ) ( resi 111 and name HN   ) 0 0 4.0              
assi ( resi 109 and name HA   ) ( resi 112 and name HN   ) 0 0 4.0              
assi ( resi 109 and name HA   ) ( resi 113 and name HN   ) 0 0 5.0              
assi ( resi 109 and name HD*  ) ( resi 113 and name HN   ) 0 0 5.0              
assi ( resi 109 and name HN   ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi 110 and name HA   ) ( resi 110 and name HN   ) 0 0 5.0              
assi ( resi 110 and name HB*  ) ( resi 110 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HD*  ) ( resi 110 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HG   ) ( resi 110 and name HN   ) 0 0 5.0              
assi ( resi 110 and name HA   ) ( resi 111 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HB*  ) ( resi 111 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HD*  ) ( resi 111 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HN   ) ( resi 111 and name HB   ) 0 0 5.0              
assi ( resi 110 and name HN   ) ( resi 111 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HA   ) ( resi 113 and name HN   ) 0 0 4.0              
assi ( resi 110 and name HD*  ) ( resi 113 and name HN   ) 0 0 5.0              
assi ( resi 110 and name HD*  ) ( resi 115 and name HN   ) 0 0 5.0              
assi ( resi 110 and name HN   ) ( resi 115 and name HB*  ) 0 0 5.0              
assi ( resi 110 and name HN   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi 110 and name HN   ) ( resi 116 and name HB*  ) 0 0 5.0              
assi ( resi 111 and name HA   ) ( resi 111 and name HN   ) 0 0 3.0              
assi ( resi 111 and name HB   ) ( resi 111 and name HN   ) 0 0 3.0              
assi ( resi 111 and name HG*  ) ( resi 111 and name HN   ) 0 0 5.0              
assi ( resi 111 and name HA   ) ( resi 112 and name HN   ) 0 0 4.0              
assi ( resi 111 and name HB   ) ( resi 112 and name HN   ) 0 0 3.0              
assi ( resi 111 and name HG*  ) ( resi 112 and name HN   ) 0 0 5.0              
assi ( resi 111 and name HN   ) ( resi 112 and name HN   ) 0 0 3.0              
assi ( resi 111 and name HN   ) ( resi 113 and name HN   ) 0 0 5.0              
assi ( resi 111 and name HA   ) ( resi 115 and name HN   ) 0 0 4.0              
assi ( resi 111 and name HG*  ) ( resi 118 and name HN   ) 0 0 5.0              
assi ( resi 112 and name HA   ) ( resi 112 and name HN   ) 0 0 3.0              
assi ( resi 112 and name HB*  ) ( resi 112 and name HN   ) 0 0 3.0              
assi ( resi 112 and name HG*  ) ( resi 112 and name HN   ) 0 0 4.0              
assi ( resi 112 and name HA   ) ( resi 113 and name HN   ) 0 0 4.0              
assi ( resi 112 and name HB*  ) ( resi 113 and name HN   ) 0 0 4.0              
assi ( resi 112 and name HG*  ) ( resi 113 and name HN   ) 0 0 5.0              
assi ( resi 112 and name HN   ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi 112 and name HN   ) ( resi 113 and name HG1* ) 0 0 5.0              
assi ( resi 112 and name HN   ) ( resi 113 and name HN   ) 0 0 4.0              
assi ( resi 112 and name HB*  ) ( resi 114 and name HN   ) 0 0 5.0              
assi ( resi 112 and name HN   ) ( resi 114 and name HN   ) 0 0 5.0              
assi ( resi 113 and (name HD* or name HG2*)) ( resi 113 and name HN   ) 0 0 3.0 
assi ( resi 113 and name HA   ) ( resi 113 and name HN   ) 0 0 4.0              
assi ( resi 113 and name HB   ) ( resi 113 and name HN   ) 0 0 4.0              
assi ( resi 113 and name HG1* ) ( resi 113 and name HN   ) 0 0 3.0              
assi ( resi 113 and (name HD* or name HG2*)) ( resi 114 and name HN   ) 0 0 5.0 
assi ( resi 113 and name HA   ) ( resi 114 and name HN   ) 0 0 5.0              
assi ( resi 113 and name HB   ) ( resi 114 and name HN   ) 0 0 5.0              
assi ( resi 113 and name HG1* ) ( resi 114 and name HN   ) 0 0 5.0              
assi ( resi 113 and name HN   ) ( resi 114 and name HN   ) 0 0 4.0              
assi ( resi 113 and name HB   ) ( resi 115 and name HN   ) 0 0 5.0              
assi ( resi 113 and name HG1* ) ( resi 115 and name HN   ) 0 0 5.0              
assi ( resi 113 and name HN   ) ( resi 115 and name HB*  ) 0 0 5.0              
assi ( resi 113 and name HN   ) ( resi 115 and name HN   ) 0 0 5.0              
assi ( resi 114 and name HA*  ) ( resi 114 and name HN   ) 0 0 4.0              
assi ( resi 114 and name HA*  ) ( resi 115 and name HN   ) 0 0 4.0              
assi ( resi 114 and name HN   ) ( resi 115 and name HB*  ) 0 0 5.0              
assi ( resi 114 and name HN   ) ( resi 115 and name HN   ) 0 0 4.0              
assi ( resi 115 and name HA   ) ( resi 115 and name HN   ) 0 0 3.0              
assi ( resi 115 and name HB*  ) ( resi 115 and name HN   ) 0 0 3.0              
assi ( resi 115 and name HD*  ) ( resi 115 and name HN   ) 0 0 4.0              
assi ( resi 115 and name HG   ) ( resi 115 and name HN   ) 0 0 5.0              
assi ( resi 115 and name HA   ) ( resi 116 and name HN   ) 0 0 5.0              
assi ( resi 115 and name HB*  ) ( resi 116 and name HN   ) 0 0 4.0              
assi ( resi 115 and name HD*  ) ( resi 116 and name HN   ) 0 0 4.0              
assi ( resi 115 and name HG   ) ( resi 116 and name HN   ) 0 0 5.0              
assi ( resi 115 and name HN   ) ( resi 116 and name HN   ) 0 0 3.0              
assi ( resi 116 and name HA   ) ( resi 116 and name HN   ) 0 0 5.0              
assi ( resi 116 and name HB*  ) ( resi 116 and name HN   ) 0 0 5.0              
assi ( resi 116 and name HA   ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 116 and name HB*  ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 116 and name HN   ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 116 and name HB*  ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HB*  ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HE*  ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HG*  ) ( resi 117 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 118 and name HN   ) 0 0 2.5              
assi ( resi 117 and name HB*  ) ( resi 118 and name HN   ) 0 0 3.0              
assi ( resi 117 and name HG*  ) ( resi 118 and name HN   ) 0 0 4.0              
assi ( resi 117 and name HN   ) ( resi 118 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 119 and name HN   ) 0 0 4.0              
assi ( resi 117 and name HB*  ) ( resi 119 and name HN   ) 0 0 4.0              
assi ( resi 117 and name HE*  ) ( resi 119 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HG*  ) ( resi 119 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HB*  ) ( resi 120 and name HN   ) 0 0 4.0              
assi ( resi 117 and name HG*  ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HN   ) ( resi 120 and (name HB* or name HG*)) 0 0 4.0  
assi ( resi 117 and name HN   ) ( resi 120 and name HA   ) 0 0 5.0              
assi ( resi 117 and name HN   ) ( resi 120 and name HB*  ) 0 0 4.0              
assi ( resi 117 and name HN   ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi 117 and name HN   ) ( resi 120 and name HE22 ) 0 0 5.0              
assi ( resi 117 and name HN   ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi 117 and name HN   ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi 117 and name HN   ) ( resi 121 and name HD*  ) 0 0 5.0              
assi ( resi 118 and name HA   ) ( resi 118 and name HN   ) 0 0 3.0              
assi ( resi 118 and name HB*  ) ( resi 118 and name HN   ) 0 0 3.0              
assi ( resi 118 and name HA   ) ( resi 119 and name HN   ) 0 0 4.0              
assi ( resi 118 and name HB*  ) ( resi 119 and name HN   ) 0 0 5.0              
assi ( resi 118 and name HN   ) ( resi 119 and name HN   ) 0 0 4.0              
assi ( resi 118 and name HA   ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi 118 and name HN   ) ( resi 120 and (name HB* or name HG*)) 0 0 5.0  
assi ( resi 118 and name HN   ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi 118 and name HA   ) ( resi 121 and name HN   ) 0 0 4.0              
assi ( resi 118 and name HN   ) ( resi 121 and name HN   ) 0 0 5.0              
assi ( resi 119 and name HA   ) ( resi 119 and name HN   ) 0 0 3.0              
assi ( resi 119 and name HB*  ) ( resi 119 and name HN   ) 0 0 5.0              
assi ( resi 119 and name HA   ) ( resi 120 and name HN   ) 0 0 4.0              
assi ( resi 119 and name HB*  ) ( resi 120 and name HN   ) 0 0 5.0              
assi ( resi 119 and name HN   ) ( resi 120 and (name HB* or name HG*)) 0 0 5.0  
assi ( resi 119 and name HN   ) ( resi 120 and name HA   ) 0 0 5.0              
assi ( resi 119 and name HN   ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi 119 and name HN   ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi 119 and name HN   ) ( resi 120 and name HN   ) 0 0 3.0              
assi ( resi 119 and name HA   ) ( resi 121 and name HN   ) 0 0 5.0              
assi ( resi 119 and name HN   ) ( resi 121 and name HD*  ) 0 0 5.0              
assi ( resi 119 and name HN   ) ( resi 121 and name HN   ) 0 0 5.0              
assi ( resi 120 and (name HB* or name HG*)) ( resi 120 and name HE21 ) 0 0 4.0  
assi ( resi 120 and (name HB* or name HG*)) ( resi 120 and name HE22 ) 0 0 4.0  
assi ( resi 120 and (name HB* or name HG*)) ( resi 120 and name HN   ) 0 0 3.0  
assi ( resi 120 and name HA   ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi 120 and name HA   ) ( resi 120 and name HN   ) 0 0 4.0              
assi ( resi 120 and name HB*  ) ( resi 120 and name HE21 ) 0 0 5.0              
assi ( resi 120 and name HB*  ) ( resi 120 and name HN   ) 0 0 3.0              
assi ( resi 120 and name HE21 ) ( resi 120 and name HE22 ) 0 0 2.5              
assi ( resi 120 and name HE21 ) ( resi 120 and name HG*  ) 0 0 4.0              
assi ( resi 120 and name HE22 ) ( resi 120 and name HG*  ) 0 0 4.0              
assi ( resi 120 and name HG*  ) ( resi 120 and name HN   ) 0 0 4.0              
assi ( resi 120 and (name HB* or name HG*)) ( resi 121 and name HN   ) 0 0 4.0  
assi ( resi 120 and name HA   ) ( resi 121 and name HN   ) 0 0 4.0              
assi ( resi 120 and name HB*  ) ( resi 121 and name HN   ) 0 0 4.0              
assi ( resi 120 and name HG*  ) ( resi 121 and name HN   ) 0 0 5.0              
assi ( resi 120 and name HN   ) ( resi 121 and name HA   ) 0 0 5.0              
assi ( resi 120 and name HN   ) ( resi 121 and name HD*  ) 0 0 5.0              
assi ( resi 120 and name HN   ) ( resi 121 and name HG   ) 0 0 4.0              
assi ( resi 120 and name HN   ) ( resi 121 and name HN   ) 0 0 3.0              
assi ( resi 121 and name HA   ) ( resi 121 and name HN   ) 0 0 4.0              
assi ( resi 121 and name HB*  ) ( resi 121 and name HN   ) 0 0 3.0              
assi ( resi 121 and name HD*  ) ( resi 121 and name HN   ) 0 0 4.0              
assi ( resi 121 and name HG   ) ( resi 121 and name HN   ) 0 0 3.0              
assi ( resi 121 and name HA   ) ( resi 122 and name HN   ) 0 0 2.5              
assi ( resi 121 and name HB*  ) ( resi 122 and name HN   ) 0 0 4.0              
assi ( resi 121 and name HD*  ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi 121 and name HG   ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi 121 and name HN   ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi 121 and name HN   ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi 121 and name HA   ) ( resi 123 and name HN   ) 0 0 5.0              
assi ( resi 122 and name HA   ) ( resi 122 and name HN   ) 0 0 4.0              
assi ( resi 122 and name HB*  ) ( resi 122 and name HN   ) 0 0 3.0              
assi ( resi 122 and name HD*  ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi 122 and name HG*  ) ( resi 122 and name HN   ) 0 0 5.0              
assi ( resi 122 and name HA   ) ( resi 123 and name HN   ) 0 0 5.0              
assi ( resi 122 and name HB*  ) ( resi 123 and name HN   ) 0 0 4.0              
assi ( resi 122 and name HD*  ) ( resi 123 and name HN   ) 0 0 4.0              
assi ( resi 122 and name HE*  ) ( resi 123 and name HN   ) 0 0 5.0              
assi ( resi 122 and name HN   ) ( resi 123 and name HN   ) 0 0 5.0              
assi ( resi 123 and name HA   ) ( resi 123 and name HN   ) 0 0 5.0              
assi ( resi 123 and name HB   ) ( resi 123 and name HN   ) 0 0 3.0              
assi ( resi 123 and name HG*  ) ( resi 123 and name HN   ) 0 0 2.5              
assi ( resi 123 and name HA   ) ( resi 124 and name HN   ) 0 0 2.5              
assi ( resi 123 and name HG*  ) ( resi 124 and name HN   ) 0 0 3.0              
assi ( resi 123 and name HN   ) ( resi 124 and name HN   ) 0 0 5.0              
assi ( resi 124 and name HB*  ) ( resi 124 and name HN   ) 0 0 4.0              
assi ( resi 124 and name HD2  ) ( resi 124 and name HN   ) 0 0 4.0              
assi ( resi 124 and name HB*  ) ( resi 125 and name HN   ) 0 0 5.0              
assi ( resi 124 and name HN   ) ( resi 125 and name HN   ) 0 0 5.0              
assi ( resi 124 and name HB*  ) ( resi 126 and name HN   ) 0 0 5.0              
assi ( resi 125 and name HA*  ) ( resi 125 and name HN   ) 0 0 4.0              
assi ( resi 125 and name HA*  ) ( resi 126 and name HN   ) 0 0 3.0              
assi ( resi 125 and name HN   ) ( resi 126 and name HN   ) 0 0 5.0              
assi ( resi 126 and (name HD* or name HE* or name HZ)) ( resi 126 and name HN   
assi ( resi 126 and name HA   ) ( resi 126 and name HN   ) 0 0 4.0              
assi ( resi 126 and name HB*  ) ( resi 126 and name HN   ) 0 0 4.0              
                                                                                
! Upper Limit Distance Restraints from 2D NOESY and 13C NOESY-HSQC              
                                                                                
assi ( resi   1 and name HA   ) ( resi   1 and name HB*  ) 0 0 3.0              
assi ( resi   1 and name HA   ) ( resi   1 and name HG*  ) 0 0 5.0              
assi ( resi   1 and name HB*  ) ( resi   1 and name HG*  ) 0 0 5.0              
assi ( resi   2 and name HA   ) ( resi   2 and name HB*  ) 0 0 5.0              
assi ( resi   2 and name HA   ) ( resi   2 and name HD*  ) 0 0 5.0              
assi ( resi   2 and name HA   ) ( resi   2 and name HG*  ) 0 0 5.0              
assi ( resi   2 and name HB*  ) ( resi   2 and name HD*  ) 0 0 5.0              
assi ( resi   2 and name HB*  ) ( resi   2 and name HG*  ) 0 0 5.0              
assi ( resi   2 and name HD*  ) ( resi   2 and name HG*  ) 0 0 5.0              
assi ( resi   4 and name HA   ) ( resi   4 and name HB*  ) 0 0 5.0              
assi ( resi   7 and name HA   ) ( resi   7 and name HB*  ) 0 0 5.0              
assi ( resi  10 and name HA   ) ( resi  10 and name HB*  ) 0 0 5.0              
assi ( resi  11 and name HA   ) ( resi  11 and name HB   ) 0 0 5.0              
assi ( resi  11 and name HA   ) ( resi  11 and name HG2* ) 0 0 2.5              
assi ( resi  11 and name HB   ) ( resi  11 and name HG2* ) 0 0 2.5              
assi ( resi  12 and name HA   ) ( resi  12 and name HB*  ) 0 0 2.5              
assi ( resi  12 and name HA   ) ( resi  13 and name HD*  ) 0 0 2.5              
assi ( resi  12 and name HA   ) ( resi  13 and name HG*  ) 0 0 5.0              
assi ( resi  12 and name HB*  ) ( resi  13 and name HD*  ) 0 0 5.0              
assi ( resi  13 and name HA   ) ( resi  13 and name HB*  ) 0 0 2.5              
assi ( resi  13 and name HA   ) ( resi  13 and name HD*  ) 0 0 5.0              
assi ( resi  13 and name HA   ) ( resi  13 and name HG*  ) 0 0 5.0              
assi ( resi  13 and name HB*  ) ( resi  13 and name HD*  ) 0 0 5.0              
assi ( resi  13 and name HB*  ) ( resi  13 and name HG*  ) 0 0 5.0              
assi ( resi  13 and name HD*  ) ( resi  13 and name HG*  ) 0 0 5.0              
assi ( resi  13 and name HA   ) ( resi  16 and name HB*  ) 0 0 5.0              
assi ( resi  14 and name HA   ) ( resi  14 and name HB*  ) 0 0 2.5              
assi ( resi  14 and name HA   ) ( resi  14 and name HG*  ) 0 0 3.0              
assi ( resi  14 and name HB*  ) ( resi  14 and name HG*  ) 0 0 5.0              
assi ( resi  14 and name HA   ) ( resi  17 and (name HD* or name HG2*)) 0 0 3.0 
assi ( resi  14 and name HA   ) ( resi  17 and name HB   ) 0 0 5.0              
assi ( resi  14 and name HA   ) ( resi  17 and name HD*  ) 0 0 5.0              
assi ( resi  14 and name HA   ) ( resi  17 and name HG1* ) 0 0 5.0              
assi ( resi  14 and name HA   ) ( resi  17 and name HG2* ) 0 0 5.0              
assi ( resi  14 and name HB*  ) ( resi  17 and name HD*  ) 0 0 3.0              
assi ( resi  15 and name HA   ) ( resi  15 and name HB*  ) 0 0 5.0              
assi ( resi  16 and name HA   ) ( resi  16 and name HB*  ) 0 0 5.0              
assi ( resi  17 and (name HD* or name HG2*)) ( resi  17 and name HA   ) 0 0 2.5 
assi ( resi  17 and name HA   ) ( resi  17 and name HB   ) 0 0 3.0              
assi ( resi  17 and name HA   ) ( resi  17 and name HD*  ) 0 0 5.0              
assi ( resi  17 and name HA   ) ( resi  17 and name HG1* ) 0 0 3.0              
assi ( resi  17 and name HA   ) ( resi  17 and name HG2* ) 0 0 2.5              
assi ( resi  17 and name HB   ) ( resi  17 and name HD*  ) 0 0 2.5              
assi ( resi  17 and name HB   ) ( resi  17 and name HG1* ) 0 0 2.5              
assi ( resi  17 and name HB   ) ( resi  17 and name HG2* ) 0 0 5.0              
assi ( resi  17 and name HD*  ) ( resi  17 and name HG1* ) 0 0 2.5              
assi ( resi  17 and name HG1* ) ( resi  17 and name HG2* ) 0 0 3.0              
assi ( resi  18 and name HA   ) ( resi  18 and name HB*  ) 0 0 2.5              
assi ( resi  18 and name HA   ) ( resi  18 and name HG*  ) 0 0 5.0              
assi ( resi  18 and name HB*  ) ( resi  18 and name HG*  ) 0 0 5.0              
assi ( resi  19 and name HA   ) ( resi  19 and name HB*  ) 0 0 2.5              
assi ( resi  20 and name HA   ) ( resi  20 and name HB*  ) 0 0 5.0              
assi ( resi  20 and name HA   ) ( resi  20 and name HD*  ) 0 0 2.5              
assi ( resi  20 and name HA   ) ( resi  20 and name HG   ) 0 0 5.0              
assi ( resi  20 and name HB*  ) ( resi  20 and name HD*  ) 0 0 5.0              
assi ( resi  20 and name HD*  ) ( resi  20 and name HG   ) 0 0 2.5              
assi ( resi  21 and name HA   ) ( resi  21 and name HB*  ) 0 0 5.0              
assi ( resi  21 and name HA   ) ( resi  21 and name HD2  ) 0 0 5.0              
assi ( resi  21 and name HB*  ) ( resi  21 and name HD2  ) 0 0 5.0              
assi ( resi  22 and name HA   ) ( resi  22 and name HB*  ) 0 0 5.0              
assi ( resi  23 and (name HD* or name HE* or name HZ)) ( resi  23 and name HA   
assi ( resi  23 and (name HD* or name HE* or name HZ)) ( resi  23 and name HB*  
assi ( resi  23 and name HA   ) ( resi  23 and name HB*  ) 0 0 2.5              
assi ( resi  23 and (name HD* or name HE* or name HZ)) ( resi  24 and name HA   
assi ( resi  23 and (name HD* or name HE* or name HZ)) ( resi  25 and name HD*  
assi ( resi  24 and name HA   ) ( resi  24 and name HB*  ) 0 0 2.5              
assi ( resi  24 and name HA   ) ( resi  25 and name HA   ) 0 0 5.0              
assi ( resi  24 and name HA   ) ( resi  25 and name HB*  ) 0 0 5.0              
assi ( resi  24 and name HA   ) ( resi  25 and name HD*  ) 0 0 2.5              
assi ( resi  24 and name HA   ) ( resi  25 and name HG*  ) 0 0 5.0              
assi ( resi  24 and name HB*  ) ( resi  25 and name HD*  ) 0 0 5.0              
assi ( resi  25 and name HA   ) ( resi  25 and name HB*  ) 0 0 2.5              
assi ( resi  25 and name HA   ) ( resi  25 and name HD*  ) 0 0 5.0              
assi ( resi  25 and name HA   ) ( resi  25 and name HG*  ) 0 0 3.0              
assi ( resi  25 and name HB*  ) ( resi  25 and name HD*  ) 0 0 3.0              
assi ( resi  25 and name HB*  ) ( resi  25 and name HG*  ) 0 0 3.0              
assi ( resi  25 and name HD*  ) ( resi  25 and name HG*  ) 0 0 2.5              
assi ( resi  25 and name HA   ) ( resi  26 and (name HD* or name HE* or name HZ)
assi ( resi  25 and name HB*  ) ( resi  26 and (name HD* or name HE* or name HZ)
assi ( resi  25 and name HB*  ) ( resi  26 and name HA   ) 0 0 5.0              
assi ( resi  25 and name HB*  ) ( resi  26 and name HB*  ) 0 0 5.0              
assi ( resi  25 and name HD*  ) ( resi  26 and (name HD* or name HE* or name HZ)
assi ( resi  25 and name HG*  ) ( resi  26 and (name HD* or name HE* or name HZ)
assi ( resi  26 and (name HD* or name HE* or name HZ)) ( resi  26 and name HA   
assi ( resi  26 and (name HD* or name HE* or name HZ)) ( resi  26 and name HB*  
assi ( resi  26 and name HA   ) ( resi  26 and name HB*  ) 0 0 3.0              
assi ( resi  26 and (name HD* or name HE* or name HZ)) ( resi  27 and name HB*  
assi ( resi  27 and name HA   ) ( resi  27 and name HB*  ) 0 0 5.0              
assi ( resi  28 and name HA   ) ( resi  28 and name HB*  ) 0 0 5.0              
assi ( resi  29 and name HA   ) ( resi  29 and name HB*  ) 0 0 5.0              
assi ( resi  30 and name HA   ) ( resi  30 and name HB*  ) 0 0 5.0              
assi ( resi  31 and name HA   ) ( resi  31 and name HB*  ) 0 0 5.0              
assi ( resi  31 and name HA   ) ( resi  31 and name HD*  ) 0 0 5.0              
assi ( resi  31 and name HA   ) ( resi  31 and name HE*  ) 0 0 5.0              
assi ( resi  31 and name HA   ) ( resi  31 and name HG*  ) 0 0 5.0              
assi ( resi  31 and name HB*  ) ( resi  31 and name HD*  ) 0 0 5.0              
assi ( resi  31 and name HB*  ) ( resi  31 and name HE*  ) 0 0 5.0              
assi ( resi  31 and name HB*  ) ( resi  31 and name HG*  ) 0 0 5.0              
assi ( resi  31 and name HD*  ) ( resi  31 and name HE*  ) 0 0 5.0              
assi ( resi  31 and name HD*  ) ( resi  31 and name HG*  ) 0 0 5.0              
assi ( resi  31 and name HE*  ) ( resi  31 and name HG*  ) 0 0 5.0              
assi ( resi  33 and name HA   ) ( resi  33 and name HB*  ) 0 0 2.5              
assi ( resi  34 and name HA   ) ( resi  34 and name HB*  ) 0 0 5.0              
assi ( resi  35 and name HA   ) ( resi  35 and name HB*  ) 0 0 5.0              
assi ( resi  35 and name HA   ) ( resi  35 and name HD*  ) 0 0 2.5              
assi ( resi  35 and name HA   ) ( resi  35 and name HG   ) 0 0 5.0              
assi ( resi  36 and name HA   ) ( resi  36 and name HB*  ) 0 0 2.5              
assi ( resi  36 and name HA   ) ( resi  36 and name HD*  ) 0 0 2.5              
assi ( resi  36 and name HA   ) ( resi  36 and name HG   ) 0 0 5.0              
assi ( resi  36 and name HB*  ) ( resi  36 and name HD*  ) 0 0 2.5              
assi ( resi  36 and name HB*  ) ( resi  36 and name HG   ) 0 0 5.0              
assi ( resi  36 and name HD*  ) ( resi  36 and name HG   ) 0 0 5.0              
assi ( resi  36 and name HA   ) ( resi  37 and name HD*  ) 0 0 2.5              
assi ( resi  36 and name HA   ) ( resi  37 and name HG*  ) 0 0 5.0              
assi ( resi  36 and name HB*  ) ( resi  37 and name HD*  ) 0 0 3.0              
assi ( resi  36 and name HD*  ) ( resi  37 and name HD*  ) 0 0 5.0              
assi ( resi  37 and name HA   ) ( resi  37 and name HB*  ) 0 0 2.5              
assi ( resi  37 and name HA   ) ( resi  37 and name HD*  ) 0 0 5.0              
assi ( resi  37 and name HA   ) ( resi  37 and name HG*  ) 0 0 5.0              
assi ( resi  37 and name HB*  ) ( resi  37 and name HD*  ) 0 0 5.0              
assi ( resi  37 and name HB*  ) ( resi  37 and name HG*  ) 0 0 5.0              
assi ( resi  37 and name HD*  ) ( resi  37 and name HG*  ) 0 0 5.0              
assi ( resi  38 and name HA   ) ( resi  38 and name HB*  ) 0 0 5.0              
assi ( resi  40 and name HA   ) ( resi  40 and name HG2* ) 0 0 5.0              
assi ( resi  40 and name HB   ) ( resi  40 and name HG2* ) 0 0 2.5              
assi ( resi  40 and name HA   ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  40 and name HA   ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  40 and name HB   ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  40 and name HG2* ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  40 and name HG2* ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  41 and name HA   ) ( resi  41 and name HB*  ) 0 0 2.5              
assi ( resi  41 and name HA   ) ( resi  41 and name HG*  ) 0 0 2.5              
assi ( resi  41 and name HB*  ) ( resi  41 and name HG*  ) 0 0 2.5              
assi ( resi  41 and name HA   ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  41 and name HA   ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  41 and name HB*  ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  41 and name HB*  ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  41 and name HG*  ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  41 and name HG*  ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  42 and name HA   ) ( resi  42 and name HB*  ) 0 0 5.0              
assi ( resi  42 and name HA   ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  42 and name HB*  ) ( resi  43 and name HD*  ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi  43 and name HB*  ) 0 0 2.5              
assi ( resi  43 and name HA   ) ( resi  43 and name HD*  ) 0 0 2.5              
assi ( resi  43 and name HA   ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  43 and name HB*  ) ( resi  43 and name HD*  ) 0 0 3.0              
assi ( resi  43 and name HB*  ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi  43 and name HE*  ) 0 0 5.0              
assi ( resi  43 and name HB*  ) ( resi  45 and name HE1  ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi  45 and name HE1  ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi 120 and name HA   ) 0 0 2.5              
assi ( resi  43 and name HA   ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi 120 and name HA   ) 0 0 2.5              
assi ( resi  43 and name HD*  ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi  43 and name HE*  ) ( resi 120 and name HA   ) 0 0 5.0              
assi ( resi  43 and name HE*  ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi  43 and name HA   ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi  43 and name HB*  ) ( resi 122 and name HB*  ) 0 0 3.0              
assi ( resi  43 and name HB*  ) ( resi 122 and name HD*  ) 0 0 5.0              
assi ( resi  43 and name HB*  ) ( resi 122 and name HG*  ) 0 0 2.5              
assi ( resi  43 and name HD*  ) ( resi 122 and name HB*  ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi 122 and name HD*  ) 0 0 5.0              
assi ( resi  43 and name HD*  ) ( resi 122 and name HE*  ) 0 0 3.0              
assi ( resi  43 and name HD*  ) ( resi 122 and name HG*  ) 0 0 3.0              
assi ( resi  43 and name HE*  ) ( resi 122 and name HE*  ) 0 0 3.0              
assi ( resi  43 and name HE*  ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi  44 and name HA   ) ( resi  44 and name HB   ) 0 0 3.0              
assi ( resi  44 and name HA   ) ( resi  44 and name HD*  ) 0 0 5.0              
assi ( resi  44 and name HA   ) ( resi  44 and name HG2* ) 0 0 2.5              
assi ( resi  44 and name HB   ) ( resi  44 and name HD*  ) 0 0 5.0              
assi ( resi  44 and name HB   ) ( resi  44 and name HG2* ) 0 0 2.5              
assi ( resi  44 and name HD*  ) ( resi  44 and name HG2* ) 0 0 5.0              
assi ( resi  44 and name HG2* ) ( resi  45 and name HA   ) 0 0 5.0              
assi ( resi  44 and name HG2* ) ( resi  46 and name HA   ) 0 0 5.0              
assi ( resi  44 and name HA   ) ( resi  62 and name HA*  ) 0 0 5.0              
assi ( resi  44 and name HD*  ) ( resi  62 and name HA*  ) 0 0 2.5              
assi ( resi  44 and name HG2* ) ( resi  62 and name HA*  ) 0 0 3.0              
assi ( resi  44 and name HA   ) ( resi  63 and name HD*  ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi  45 and name HB*  ) 0 0 2.5              
assi ( resi  45 and name HA   ) ( resi  45 and name HD2  ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi  45 and name HE1  ) 0 0 5.0              
assi ( resi  45 and name HB*  ) ( resi  45 and name HD2  ) 0 0 5.0              
assi ( resi  45 and name HD2  ) ( resi  45 and name HE1  ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi  61 and name HB*  ) 0 0 5.0              
assi ( resi  45 and name HB*  ) ( resi  61 and name HB*  ) 0 0 3.0              
assi ( resi  45 and name HA   ) ( resi 122 and name HA   ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi 122 and name HB*  ) 0 0 2.5              
assi ( resi  45 and name HA   ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi  45 and name HD2  ) ( resi 122 and name HB*  ) 0 0 5.0              
assi ( resi  45 and name HE1  ) ( resi 122 and name HB*  ) 0 0 5.0              
assi ( resi  45 and name HE1  ) ( resi 122 and name HD*  ) 0 0 5.0              
assi ( resi  45 and name HE1  ) ( resi 122 and name HE*  ) 0 0 5.0              
assi ( resi  45 and name HE1  ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi  45 and name HA   ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi  45 and name HB*  ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi  45 and name HE1  ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi  45 and name HE1  ) ( resi 124 and name HE1  ) 0 0 5.0              
assi ( resi  46 and (name HD* or name HG2*)) ( resi  46 and name HA   ) 0 0 5.0 
assi ( resi  46 and (name HD* or name HG2*)) ( resi  46 and name HB   ) 0 0 2.5 
assi ( resi  46 and name HA   ) ( resi  46 and name HB   ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi  46 and name HD*  ) 0 0 3.0              
assi ( resi  46 and name HA   ) ( resi  46 and name HG1* ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi  46 and name HG2* ) 0 0 2.5              
assi ( resi  46 and name HB   ) ( resi  46 and name HD*  ) 0 0 5.0              
assi ( resi  46 and name HB   ) ( resi  46 and name HG1* ) 0 0 3.0              
assi ( resi  46 and name HB   ) ( resi  46 and name HG2* ) 0 0 5.0              
assi ( resi  46 and name HD*  ) ( resi  46 and name HG1* ) 0 0 5.0              
assi ( resi  46 and name HG1* ) ( resi  46 and name HG2* ) 0 0 3.0              
assi ( resi  46 and name HA   ) ( resi  60 and name HA   ) 0 0 3.0              
assi ( resi  46 and name HA   ) ( resi  60 and name HG*  ) 0 0 3.0              
assi ( resi  46 and name HD*  ) ( resi  60 and name HA   ) 0 0 3.0              
assi ( resi  46 and name HG1* ) ( resi  60 and name HA   ) 0 0 5.0              
assi ( resi  46 and name HG2* ) ( resi  60 and name HA   ) 0 0 5.0              
assi ( resi  46 and name HD*  ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  46 and name HG2* ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  46 and name HG2* ) ( resi 103 and name HA   ) 0 0 3.0              
assi ( resi  46 and name HD*  ) ( resi 107 and name HA   ) 0 0 5.0              
assi ( resi  46 and name HD*  ) ( resi 107 and name HB*  ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi 123 and name HA   ) 0 0 5.0              
assi ( resi  46 and name HA   ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi  47 and name HA   ) ( resi  47 and name HB*  ) 0 0 5.0              
assi ( resi  47 and name HA   ) ( resi  47 and name HD*  ) 0 0 5.0              
assi ( resi  47 and name HB*  ) ( resi  47 and name HD*  ) 0 0 5.0              
assi ( resi  47 and name HB*  ) ( resi  59 and name HB   ) 0 0 5.0              
assi ( resi  47 and name HA   ) ( resi 124 and name HB*  ) 0 0 3.0              
assi ( resi  47 and name HA   ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi  47 and name HB*  ) ( resi 124 and name HB*  ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  48 and name HA   ) 0 0 3.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi  48 and name HB   ) 0 0 2.5 
assi ( resi  48 and (name HD* or name HG2*)) ( resi  48 and name HG1* ) 0 0 5.0 
assi ( resi  48 and name HA   ) ( resi  48 and name HB   ) 0 0 3.0              
assi ( resi  48 and name HA   ) ( resi  48 and name HD*  ) 0 0 5.0              
assi ( resi  48 and name HA   ) ( resi  48 and name HG1* ) 0 0 2.5              
assi ( resi  48 and name HA   ) ( resi  48 and name HG2* ) 0 0 5.0              
assi ( resi  48 and name HB   ) ( resi  48 and name HD*  ) 0 0 2.5              
assi ( resi  48 and name HB   ) ( resi  48 and name HG1* ) 0 0 2.5              
assi ( resi  48 and name HB   ) ( resi  48 and name HG2* ) 0 0 2.5              
assi ( resi  48 and name HD*  ) ( resi  48 and name HG1* ) 0 0 2.5              
assi ( resi  48 and name HG1* ) ( resi  48 and name HG2* ) 0 0 2.5              
assi ( resi  48 and name HA   ) ( resi  49 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi  49 and name HA   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  50 and name HB*  ) 0 0 3.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi  50 and name HG*  ) 0 0 5.0 
assi ( resi  48 and name HD*  ) ( resi  50 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi  50 and name HG*  ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi  50 and name HB*  ) 0 0 3.0              
assi ( resi  48 and name HG2* ) ( resi  50 and name HG*  ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  56 and name HB   ) 0 0 5.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi  56 and name HG2* ) 0 0 5.0 
assi ( resi  48 and name HA   ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  48 and name HB   ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi  56 and name HG2* ) 0 0 2.5              
assi ( resi  48 and name HG2* ) ( resi  56 and name HG2* ) 0 0 2.5              
assi ( resi  48 and (name HD* or name HG2*)) ( resi  58 and name HA   ) 0 0 5.0 
assi ( resi  48 and name HA   ) ( resi  58 and name HB   ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi  58 and name HA   ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi  58 and name HA   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi 101 and name HA   ) 0 0 2.5 
assi ( resi  48 and (name HD* or name HG2*)) ( resi 101 and name HB*  ) 0 0 3.0 
assi ( resi  48 and name HB   ) ( resi 101 and name HA   ) 0 0 5.0              
assi ( resi  48 and name HB   ) ( resi 101 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi 101 and name HA   ) 0 0 2.5              
assi ( resi  48 and name HD*  ) ( resi 101 and name HB*  ) 0 0 3.0              
assi ( resi  48 and name HG1* ) ( resi 101 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi 101 and name HA   ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi 101 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi 102 and name HA   ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi 125 and name HA*  ) 0 0 3.0 
assi ( resi  48 and name HB   ) ( resi 125 and name HA*  ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi 125 and name HA*  ) 0 0 3.0              
assi ( resi  48 and name HG1* ) ( resi 125 and name HA*  ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi 125 and name HA*  ) 0 0 5.0              
assi ( resi  48 and (name HD* or name HG2*)) ( resi 126 and name HA   ) 0 0 5.0 
assi ( resi  48 and (name HD* or name HG2*)) ( resi 126 and name HB*  ) 0 0 5.0 
assi ( resi  48 and name HB   ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  48 and name HB   ) ( resi 126 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HD*  ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  48 and name HD*  ) ( resi 126 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HG1* ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  48 and name HG1* ) ( resi 126 and name HB*  ) 0 0 5.0              
assi ( resi  48 and name HG2* ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  48 and name HG2* ) ( resi 126 and name HB*  ) 0 0 3.0              
assi ( resi  49 and name HA   ) ( resi  49 and name HB*  ) 0 0 5.0              
assi ( resi  49 and name HA   ) ( resi  49 and name HG*  ) 0 0 5.0              
assi ( resi  49 and name HB*  ) ( resi  49 and name HG*  ) 0 0 5.0              
assi ( resi  49 and name HA   ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  49 and name HA   ) ( resi  57 and name HB*  ) 0 0 5.0              
assi ( resi  49 and name HG*  ) ( resi  57 and name HA   ) 0 0 5.0              
assi ( resi  49 and name HG*  ) ( resi  57 and name HB*  ) 0 0 2.5              
assi ( resi  49 and name HG*  ) ( resi  57 and name HD*  ) 0 0 3.0              
assi ( resi  49 and name HG*  ) ( resi  59 and name HG2* ) 0 0 5.0              
assi ( resi  49 and name HA   ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  49 and name HA   ) ( resi 126 and name HB*  ) 0 0 5.0              
assi ( resi  49 and name HB*  ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  50 and name HA   ) ( resi  50 and name HB*  ) 0 0 5.0              
assi ( resi  50 and name HA   ) ( resi  50 and name HG*  ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  50 and name HG*  ) 0 0 5.0              
assi ( resi  50 and name HA   ) ( resi  51 and name HB*  ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  53 and name HA*  ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  54 and name HA   ) 0 0 5.0              
assi ( resi  50 and name HG*  ) ( resi  54 and name HA   ) 0 0 3.0              
assi ( resi  50 and name HA   ) ( resi  56 and name HA   ) 0 0 5.0              
assi ( resi  50 and name HA   ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  56 and name HA   ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  56 and name HB   ) 0 0 5.0              
assi ( resi  50 and name HB*  ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  50 and name HG*  ) ( resi  56 and name HA   ) 0 0 3.0              
assi ( resi  50 and name HG*  ) ( resi  56 and name HG2* ) 0 0 3.0              
assi ( resi  50 and name HB*  ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  50 and name HG*  ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  51 and name HA   ) ( resi  51 and name HB*  ) 0 0 2.5              
assi ( resi  51 and name HB*  ) ( resi  51 and name HD*  ) 0 0 5.0              
assi ( resi  51 and name HD*  ) ( resi  57 and name HB*  ) 0 0 5.0              
assi ( resi  51 and name HD*  ) ( resi  57 and name HD*  ) 0 0 5.0              
assi ( resi  52 and name HA   ) ( resi  52 and name HB*  ) 0 0 2.5              
assi ( resi  52 and name HA   ) ( resi  53 and name HA*  ) 0 0 5.0              
assi ( resi  52 and name HB*  ) ( resi  53 and name HA*  ) 0 0 5.0              
assi ( resi  52 and name HB*  ) ( resi  54 and name HG*  ) 0 0 3.0              
assi ( resi  53 and name HA*  ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  54 and name HA   ) ( resi  54 and name HB*  ) 0 0 2.5              
assi ( resi  54 and name HA   ) ( resi  54 and name HD*  ) 0 0 5.0              
assi ( resi  54 and name HA   ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  54 and name HB*  ) ( resi  54 and name HD*  ) 0 0 3.0              
assi ( resi  54 and name HB*  ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  54 and name HD*  ) ( resi  54 and name HG*  ) 0 0 5.0              
assi ( resi  54 and name HA   ) ( resi  56 and name HG2* ) 0 0 5.0              
assi ( resi  55 and name HA   ) ( resi  55 and name HB*  ) 0 0 5.0              
assi ( resi  55 and name HA   ) ( resi  55 and name HD*  ) 0 0 2.5              
assi ( resi  55 and name HA   ) ( resi  55 and name HE*  ) 0 0 5.0              
assi ( resi  55 and name HA   ) ( resi  55 and name HG*  ) 0 0 5.0              
assi ( resi  55 and name HB*  ) ( resi  55 and name HD*  ) 0 0 5.0              
assi ( resi  55 and name HB*  ) ( resi  55 and name HG*  ) 0 0 5.0              
assi ( resi  55 and name HD*  ) ( resi  55 and name HE*  ) 0 0 2.5              
assi ( resi  55 and name HA   ) ( resi  56 and name HA   ) 0 0 5.0              
assi ( resi  56 and name HA   ) ( resi  56 and name HB   ) 0 0 3.0              
assi ( resi  56 and name HA   ) ( resi  56 and name HG2* ) 0 0 2.5              
assi ( resi  56 and name HB   ) ( resi  56 and name HG2* ) 0 0 2.5              
assi ( resi  56 and name HA   ) ( resi  57 and (name HB* or name HG)) 0 0 5.0   
assi ( resi  56 and name HA   ) ( resi  57 and name HA   ) 0 0 5.0              
assi ( resi  56 and name HA   ) ( resi  57 and name HD*  ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi  57 and (name HB* or name HG)) 0 0 5.0   
assi ( resi  56 and name HG2* ) ( resi  57 and name HA   ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi  57 and name HB*  ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi  58 and name HA   ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi 100 and name HA*  ) 0 0 2.5              
assi ( resi  56 and name HG2* ) ( resi 100 and name HA*  ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi 101 and name HA   ) 0 0 5.0              
assi ( resi  56 and name HB   ) ( resi 101 and name HB*  ) 0 0 5.0              
assi ( resi  56 and name HG2* ) ( resi 101 and name HA   ) 0 0 3.0              
assi ( resi  56 and name HG2* ) ( resi 101 and name HB*  ) 0 0 3.0              
assi ( resi  56 and name HG2* ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi  57 and (name HB* or name HG)) ( resi  57 and name HA   ) 0 0 2.5   
assi ( resi  57 and (name HB* or name HG)) ( resi  57 and name HD*  ) 0 0 2.5   
assi ( resi  57 and name HA   ) ( resi  57 and name HB*  ) 0 0 2.5              
assi ( resi  57 and name HA   ) ( resi  57 and name HD*  ) 0 0 2.5              
assi ( resi  57 and name HA   ) ( resi  57 and name HG   ) 0 0 3.0              
assi ( resi  57 and name HB*  ) ( resi  57 and name HD*  ) 0 0 2.5              
assi ( resi  57 and name HB*  ) ( resi  97 and name HG*  ) 0 0 2.5              
assi ( resi  57 and name HD*  ) ( resi  97 and name HB*  ) 0 0 2.5              
assi ( resi  57 and name HD*  ) ( resi  97 and name HG*  ) 0 0 5.0              
assi ( resi  57 and name HA   ) ( resi  99 and name HA   ) 0 0 2.5              
assi ( resi  57 and name HB*  ) ( resi  99 and name HA   ) 0 0 5.0              
assi ( resi  57 and name HD*  ) ( resi  99 and name HA   ) 0 0 2.5              
assi ( resi  57 and name HD*  ) ( resi  99 and name HB*  ) 0 0 5.0              
assi ( resi  57 and name HD*  ) ( resi  99 and name HG*  ) 0 0 2.5              
assi ( resi  57 and name HG   ) ( resi  99 and name HA   ) 0 0 5.0              
assi ( resi  57 and name HG   ) ( resi  99 and name HG*  ) 0 0 5.0              
assi ( resi  58 and name HA   ) ( resi  58 and name HB   ) 0 0 3.0              
assi ( resi  58 and name HA   ) ( resi  58 and name HG2* ) 0 0 2.5              
assi ( resi  58 and name HB   ) ( resi  58 and name HG2* ) 0 0 2.5              
assi ( resi  58 and name HA   ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  58 and name HA   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi  98 and name HA   ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi  98 and name HD*  ) 0 0 3.0              
assi ( resi  58 and name HB   ) ( resi  98 and name HG   ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi 102 and name HB*  ) 0 0 5.0              
assi ( resi  58 and name HB   ) ( resi 102 and name HG*  ) 0 0 5.0              
assi ( resi  58 and name HG2* ) ( resi 102 and name HB*  ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  59 and name HB   ) 0 0 3.0              
assi ( resi  59 and name HA   ) ( resi  59 and name HG2* ) 0 0 2.5              
assi ( resi  59 and name HB   ) ( resi  59 and name HG2* ) 0 0 2.5              
assi ( resi  59 and name HA   ) ( resi  60 and name HG*  ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  60 and name HG*  ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  61 and name HG*  ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  89 and name HD2  ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  95 and name HB   ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  95 and name HB   ) 0 0 3.0              
assi ( resi  59 and name HB   ) ( resi  95 and name HG*  ) 0 0 3.0              
assi ( resi  59 and name HG2* ) ( resi  95 and name HA   ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  95 and name HB   ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  97 and name HA   ) 0 0 2.5              
assi ( resi  59 and name HA   ) ( resi  97 and name HB*  ) 0 0 5.0              
assi ( resi  59 and name HA   ) ( resi  97 and name HG*  ) 0 0 5.0              
assi ( resi  59 and name HB   ) ( resi  97 and name HA   ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  97 and name HA   ) 0 0 2.5              
assi ( resi  59 and name HG2* ) ( resi  97 and name HB*  ) 0 0 5.0              
assi ( resi  59 and name HG2* ) ( resi  97 and name HG*  ) 0 0 2.5              
assi ( resi  59 and name HA   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  60 and name HA   ) ( resi  60 and name HB   ) 0 0 3.0              
assi ( resi  60 and name HA   ) ( resi  60 and name HG*  ) 0 0 2.5              
assi ( resi  60 and name HB   ) ( resi  60 and name HG*  ) 0 0 5.0              
assi ( resi  60 and name HB   ) ( resi  63 and name HG2* ) 0 0 5.0              
assi ( resi  60 and name HG*  ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  60 and name HB   ) ( resi  96 and name HB   ) 0 0 5.0              
assi ( resi  60 and name HG*  ) ( resi  96 and name HB   ) 0 0 5.0              
assi ( resi  60 and name HG*  ) ( resi  97 and name HA   ) 0 0 5.0              
assi ( resi  60 and name HG*  ) ( resi 110 and name HG   ) 0 0 5.0              
assi ( resi  61 and name HA   ) ( resi  61 and name HB*  ) 0 0 2.5              
assi ( resi  61 and name HA   ) ( resi  61 and name HG*  ) 0 0 5.0              
assi ( resi  61 and name HB*  ) ( resi  61 and name HG*  ) 0 0 5.0              
assi ( resi  61 and name HG*  ) ( resi  62 and name HA*  ) 0 0 5.0              
assi ( resi  61 and name HG*  ) ( resi  92 and name HB*  ) 0 0 5.0              
assi ( resi  61 and name HG*  ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  61 and name HA   ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  61 and name HB*  ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  61 and name HG*  ) ( resi  95 and name HG*  ) 0 0 3.0              
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  63 and name HA   ) 0 0 5.0
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  63 and name HB   ) 0 0 2.5
assi ( resi  63 and name HA   ) ( resi  63 and name HB   ) 0 0 3.0              
assi ( resi  63 and name HA   ) ( resi  63 and name HD*  ) 0 0 2.5              
assi ( resi  63 and name HA   ) ( resi  63 and name HG1* ) 0 0 3.0              
assi ( resi  63 and name HA   ) ( resi  63 and name HG2* ) 0 0 3.0              
assi ( resi  63 and name HB   ) ( resi  63 and name HD*  ) 0 0 5.0              
assi ( resi  63 and name HB   ) ( resi  63 and name HG1* ) 0 0 3.0              
assi ( resi  63 and name HB   ) ( resi  63 and name HG2* ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi  63 and name HG1* ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi  63 and name HG2* ) 0 0 5.0              
assi ( resi  63 and name HG1* ) ( resi  63 and name HG2* ) 0 0 5.0              
assi ( resi  63 and name HA   ) ( resi  64 and name HB*  ) 0 0 5.0              
assi ( resi  63 and name HG2* ) ( resi  64 and name HA   ) 0 0 5.0              
assi ( resi  63 and name HG2* ) ( resi  64 and name HB*  ) 0 0 5.0              
assi ( resi  63 and name HG2* ) ( resi  65 and name HA   ) 0 0 5.0              
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  67 and name HA   ) 0 0 5.0
assi ( resi  63 and (name HG1* or name HG2*)) ( resi  67 and name HB*  ) 0 0 3.0
assi ( resi  63 and name HD*  ) ( resi  67 and name HB*  ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi  67 and name HD*  ) 0 0 5.0              
assi ( resi  63 and name HG1* ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  63 and name HG2* ) ( resi  67 and name HB*  ) 0 0 5.0              
assi ( resi  63 and name HG2* ) ( resi  67 and name HD*  ) 0 0 2.5              
assi ( resi  63 and name HG2* ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  63 and name HG2* ) ( resi 110 and name HG   ) 0 0 5.0              
assi ( resi  63 and name HA   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  63 and name HB   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi 115 and name HG   ) 0 0 5.0              
assi ( resi  63 and name HG1* ) ( resi 115 and name HD*  ) 0 0 3.0              
assi ( resi  63 and name HG2* ) ( resi 115 and name HD*  ) 0 0 2.5              
assi ( resi  63 and name HD*  ) ( resi 116 and name HA   ) 0 0 5.0              
assi ( resi  63 and name HD*  ) ( resi 116 and name HB*  ) 0 0 3.0              
assi ( resi  63 and name HG1* ) ( resi 116 and name HA   ) 0 0 5.0              
assi ( resi  63 and name HG1* ) ( resi 116 and name HB*  ) 0 0 5.0              
assi ( resi  64 and name HA   ) ( resi  64 and name HB*  ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  65 and name HA   ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  66 and name HB*  ) 0 0 5.0              
assi ( resi  64 and name HA   ) ( resi  67 and name HD*  ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  67 and name HA   ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  67 and name HB*  ) 0 0 5.0              
assi ( resi  64 and name HB*  ) ( resi  67 and name HD*  ) 0 0 3.0              
assi ( resi  64 and name HB*  ) ( resi  67 and name HE*  ) 0 0 3.0              
assi ( resi  64 and name HB*  ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  65 and name HA   ) ( resi  65 and name HB*  ) 0 0 2.5              
assi ( resi  65 and name HB*  ) ( resi  66 and name HB*  ) 0 0 5.0              
assi ( resi  66 and name HA   ) ( resi  66 and name HB*  ) 0 0 5.0              
assi ( resi  66 and name HB*  ) ( resi  67 and name HD*  ) 0 0 5.0              
assi ( resi  66 and name HB*  ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  67 and name HA   ) ( resi  67 and name HB*  ) 0 0 2.5              
assi ( resi  67 and name HA   ) ( resi  67 and name HD*  ) 0 0 3.0              
assi ( resi  67 and name HA   ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  67 and name HB*  ) ( resi  67 and name HD*  ) 0 0 2.5              
assi ( resi  67 and name HB*  ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  67 and name HD*  ) ( resi  67 and name HE*  ) 0 0 5.0              
assi ( resi  67 and name HA   ) ( resi  72 and name HD*  ) 0 0 5.0              
assi ( resi  67 and name HB*  ) ( resi  72 and name HD*  ) 0 0 3.0              
assi ( resi  67 and name HD*  ) ( resi  72 and name HB*  ) 0 0 5.0              
assi ( resi  67 and name HD*  ) ( resi  72 and name HD*  ) 0 0 5.0              
assi ( resi  67 and name HD*  ) ( resi  72 and name HG   ) 0 0 5.0              
assi ( resi  67 and name HE*  ) ( resi  72 and name HD*  ) 0 0 5.0              
assi ( resi  67 and name HE*  ) ( resi  72 and name HG   ) 0 0 5.0              
assi ( resi  67 and name HD*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi  67 and name HE*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi  67 and name HA   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  67 and name HB*  ) ( resi 115 and name HD*  ) 0 0 3.0              
assi ( resi  67 and name HD*  ) ( resi 115 and name HA   ) 0 0 5.0              
assi ( resi  67 and name HD*  ) ( resi 115 and name HD*  ) 0 0 3.0              
assi ( resi  67 and name HD*  ) ( resi 115 and name HG   ) 0 0 5.0              
assi ( resi  67 and name HE*  ) ( resi 115 and name HA   ) 0 0 5.0              
assi ( resi  67 and name HE*  ) ( resi 115 and name HB*  ) 0 0 5.0              
assi ( resi  67 and name HE*  ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  67 and name HE*  ) ( resi 115 and name HG   ) 0 0 5.0              
assi ( resi  68 and name HA   ) ( resi  68 and name HB*  ) 0 0 3.0              
assi ( resi  68 and name HA   ) ( resi  71 and name HB*  ) 0 0 5.0              
assi ( resi  68 and name HB*  ) ( resi  71 and name HB*  ) 0 0 5.0              
assi ( resi  69 and name HA   ) ( resi  69 and name HB*  ) 0 0 3.0              
assi ( resi  69 and name HA   ) ( resi  69 and name HG*  ) 0 0 3.0              
assi ( resi  69 and name HA   ) ( resi  72 and name HB*  ) 0 0 3.0              
assi ( resi  69 and name HA   ) ( resi  72 and name HD*  ) 0 0 5.0              
assi ( resi  69 and name HA   ) ( resi  72 and name HG   ) 0 0 5.0              
assi ( resi  69 and name HA   ) ( resi  73 and name HG*  ) 0 0 5.0              
assi ( resi  70 and name HA   ) ( resi  70 and name HB*  ) 0 0 2.5              
assi ( resi  70 and name HA   ) ( resi  73 and name HG*  ) 0 0 5.0              
assi ( resi  70 and name HB*  ) ( resi  73 and name HG*  ) 0 0 5.0              
assi ( resi  71 and name HA   ) ( resi  71 and name HB*  ) 0 0 5.0              
assi ( resi  72 and name HA   ) ( resi  72 and name HB*  ) 0 0 2.5              
assi ( resi  72 and name HA   ) ( resi  72 and name HD*  ) 0 0 2.5              
assi ( resi  72 and name HA   ) ( resi  72 and name HG   ) 0 0 5.0              
assi ( resi  72 and name HB*  ) ( resi  72 and name HD*  ) 0 0 2.5              
assi ( resi  72 and name HB*  ) ( resi  72 and name HG   ) 0 0 5.0              
assi ( resi  72 and name HD*  ) ( resi  72 and name HG   ) 0 0 2.5              
assi ( resi  72 and name HD*  ) ( resi  75 and name HB*  ) 0 0 5.0              
assi ( resi  72 and name HA   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  72 and name HB*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  72 and name HD*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  72 and name HG   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  72 and name HA   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  72 and name HB*  ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  72 and name HD*  ) ( resi 115 and name HD*  ) 0 0 2.5              
assi ( resi  72 and name HG   ) ( resi 115 and name HD*  ) 0 0 3.0              
assi ( resi  72 and name HG*  ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  73 and name HB   ) 0 0 3.0              
assi ( resi  73 and name HA   ) ( resi  73 and name HG*  ) 0 0 2.5              
assi ( resi  73 and name HB   ) ( resi  73 and name HG*  ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  76 and name HA   ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  76 and name HB*  ) 0 0 2.5              
assi ( resi  73 and name HA   ) ( resi  76 and name HD*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  76 and name HB*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  76 and name HD*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  84 and name HA*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  85 and name HA   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  85 and name HB   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  85 and name HG2* ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  96 and name HA   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  96 and name HB   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  96 and name HD*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  73 and name HA   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  98 and name HA   ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  73 and name HG*  ) ( resi  98 and name HD*  ) 0 0 2.5              
assi ( resi  74 and name HA   ) ( resi  74 and name HB*  ) 0 0 5.0              
assi ( resi  75 and name HA   ) ( resi  75 and name HB*  ) 0 0 2.5              
assi ( resi  75 and name HB*  ) ( resi  76 and name HA   ) 0 0 5.0              
assi ( resi  75 and name HB*  ) ( resi  76 and name HB*  ) 0 0 5.0              
assi ( resi  75 and name HB*  ) ( resi  76 and name HD*  ) 0 0 5.0              
assi ( resi  75 and name HA   ) ( resi  78 and name HB*  ) 0 0 5.0              
assi ( resi  75 and name HA   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  75 and name HB*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  75 and name HB*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  75 and name HB*  ) ( resi 109 and name HE*  ) 0 0 3.0              
assi ( resi  75 and name HB*  ) ( resi 109 and name HZ   ) 0 0 2.5              
assi ( resi  75 and name HB*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 3.0 
assi ( resi  75 and name HB*  ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi  75 and name HB*  ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi  76 and name HB*  ) 0 0 2.5              
assi ( resi  76 and name HA   ) ( resi  76 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi  76 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi  76 and name HD*  ) 0 0 2.5              
assi ( resi  76 and name HB*  ) ( resi  76 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  76 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  76 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  76 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  77 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  77 and name HG*  ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi  79 and name HB*  ) 0 0 3.0              
assi ( resi  76 and name HA   ) ( resi  79 and name HG*  ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi  80 and name HD*  ) 0 0 3.0              
assi ( resi  76 and name HA   ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  80 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  80 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  82 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  82 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  82 and name HB*  ) 0 0 3.0              
assi ( resi  76 and name HD*  ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  98 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  76 and (name HD* or name HE* or name HZ)) ( resi 102 and name HA   
assi ( resi  76 and (name HD* or name HE* or name HZ)) ( resi 102 and name HB*  
assi ( resi  76 and name HE*  ) ( resi 102 and name HG*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 102 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 102 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 102 and name HG*  ) 0 0 5.0              
assi ( resi  76 and (name HD* or name HE* or name HZ)) ( resi 105 and name HB*  
assi ( resi  76 and name HD*  ) ( resi 105 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 105 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 105 and name HB*  ) 0 0 5.0              
assi ( resi  76 and (name HD* or name HE* or name HZ)) ( resi 106 and name HB   
assi ( resi  76 and name HD*  ) ( resi 106 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 106 and name HD*  ) 0 0 3.0              
assi ( resi  76 and name HE*  ) ( resi 106 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 106 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 106 and name HG2* ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 106 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 106 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 106 and name HG2* ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  76 and name HA   ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HA   ) ( resi 109 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  76 and name HB*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HB*  ) ( resi 109 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 109 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 109 and name HZ   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 109 and name HA   ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  76 and name HE*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  76 and name HZ   ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi  76 and name HD*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi  77 and name HA   ) ( resi  77 and name HB*  ) 0 0 5.0              
assi ( resi  77 and name HA   ) ( resi  77 and name HE*  ) 0 0 5.0              
assi ( resi  77 and name HA   ) ( resi  77 and name HG*  ) 0 0 5.0              
assi ( resi  77 and name HB*  ) ( resi  77 and name HG*  ) 0 0 5.0              
assi ( resi  77 and name HE*  ) ( resi  77 and name HG*  ) 0 0 5.0              
assi ( resi  77 and name HA   ) ( resi  82 and name HB*  ) 0 0 5.0              
assi ( resi  77 and name HG*  ) ( resi  83 and name HA   ) 0 0 3.0              
assi ( resi  78 and name HA   ) ( resi  78 and name HB*  ) 0 0 5.0              
assi ( resi  78 and name HA   ) ( resi  78 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HA   ) ( resi  79 and name HB*  ) 0 0 2.5              
assi ( resi  79 and name HA   ) ( resi  79 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HA   ) ( resi  79 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HA   ) ( resi  79 and name HG*  ) 0 0 2.5              
assi ( resi  79 and name HB*  ) ( resi  79 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HB*  ) ( resi  79 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HB*  ) ( resi  79 and name HG*  ) 0 0 2.5              
assi ( resi  79 and name HD*  ) ( resi  79 and name HE*  ) 0 0 2.5              
assi ( resi  79 and name HD*  ) ( resi  79 and name HG*  ) 0 0 2.5              
assi ( resi  79 and name HE*  ) ( resi  79 and name HG*  ) 0 0 2.5              
assi ( resi  79 and name HA   ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HB*  ) ( resi  80 and name HD*  ) 0 0 3.0              
assi ( resi  79 and name HB*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HB*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  79 and name HD*  ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HD*  ) ( resi  80 and name HE*  ) 0 0 3.0              
assi ( resi  79 and name HD*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  79 and name HE*  ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HE*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HE*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  79 and name HG*  ) ( resi  80 and name HA   ) 0 0 5.0              
assi ( resi  79 and name HG*  ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  79 and name HG*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  79 and name HG*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  79 and name HB*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  79 and name HD*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  79 and name HE*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  79 and name HG*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi  80 and name HA   ) ( resi  80 and name HB*  ) 0 0 2.5              
assi ( resi  80 and name HA   ) ( resi  80 and name HD*  ) 0 0 5.0              
assi ( resi  80 and name HA   ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  80 and name HB*  ) ( resi  80 and name HD*  ) 0 0 2.5              
assi ( resi  80 and name HB*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi  80 and name HE*  ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi  80 and name HZ   ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi  80 and name HZ   ) 0 0 2.5              
assi ( resi  80 and name HB*  ) ( resi  82 and name HB*  ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 108 and name HB*  ) 0 0 5.0              
assi ( resi  80 and name HZ   ) ( resi 108 and name HB*  ) 0 0 5.0              
assi ( resi  80 and name HZ   ) ( resi 108 and name HG*  ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  80 and name HD*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 109 and name HA   ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 109 and name HD*  ) 0 0 3.0              
assi ( resi  80 and name HE*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 109 and name HZ   ) 0 0 5.0              
assi ( resi  80 and name HZ   ) ( resi 109 and name HB*  ) 0 0 5.0              
assi ( resi  80 and name HE*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi  81 and name HA   ) ( resi  81 and name HB*  ) 0 0 2.5              
assi ( resi  81 and name HB*  ) ( resi  82 and name HA   ) 0 0 5.0              
assi ( resi  81 and name HB*  ) ( resi  82 and name HB*  ) 0 0 5.0              
assi ( resi  82 and name HA   ) ( resi  82 and name HB*  ) 0 0 2.5              
assi ( resi  82 and name HB*  ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  82 and name HB*  ) ( resi  99 and name HB*  ) 0 0 5.0              
assi ( resi  83 and name HA   ) ( resi  83 and name HB*  ) 0 0 2.5              
assi ( resi  83 and name HA   ) ( resi  99 and name HB*  ) 0 0 5.0              
assi ( resi  83 and name HA   ) ( resi  99 and name HG*  ) 0 0 5.0              
assi ( resi  83 and name HB*  ) ( resi  99 and name HA   ) 0 0 5.0              
assi ( resi  83 and name HB*  ) ( resi  99 and name HB*  ) 0 0 2.5              
assi ( resi  83 and name HB*  ) ( resi  99 and name HG*  ) 0 0 5.0              
assi ( resi  84 and name HA*  ) ( resi  98 and name HA   ) 0 0 2.5              
assi ( resi  84 and name HA*  ) ( resi  98 and name HB*  ) 0 0 5.0              
assi ( resi  84 and name HA*  ) ( resi  98 and name HD*  ) 0 0 2.5              
assi ( resi  85 and name HA   ) ( resi  85 and name HB   ) 0 0 2.5              
assi ( resi  85 and name HA   ) ( resi  85 and name HG2* ) 0 0 3.0              
assi ( resi  85 and name HB   ) ( resi  85 and name HG2* ) 0 0 2.5              
assi ( resi  85 and name HB   ) ( resi  87 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi  85 and name HB   ) ( resi  87 and name HG2* ) 0 0 5.0              
assi ( resi  85 and name HG2* ) ( resi  87 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi  85 and name HG2* ) ( resi  87 and name HG2* ) 0 0 5.0              
assi ( resi  86 and name HA   ) ( resi  86 and name HB   ) 0 0 2.5              
assi ( resi  86 and name HA   ) ( resi  86 and name HG*  ) 0 0 5.0              
assi ( resi  86 and name HB   ) ( resi  86 and name HG*  ) 0 0 5.0              
assi ( resi  86 and name HA   ) ( resi  96 and name HA   ) 0 0 2.5              
assi ( resi  86 and name HA   ) ( resi  96 and name HB   ) 0 0 5.0              
assi ( resi  86 and name HA   ) ( resi  96 and name HD*  ) 0 0 3.0              
assi ( resi  86 and name HA   ) ( resi  96 and name HG1* ) 0 0 3.0              
assi ( resi  86 and name HA   ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  86 and name HB   ) ( resi  96 and name HA   ) 0 0 5.0              
assi ( resi  86 and name HG*  ) ( resi  96 and name HA   ) 0 0 5.0              
assi ( resi  87 and (name HD* or name HG2*)) ( resi  87 and name HA   ) 0 0 5.0 
assi ( resi  87 and name HA   ) ( resi  87 and name HB   ) 0 0 2.5              
assi ( resi  87 and name HA   ) ( resi  87 and name HD*  ) 0 0 5.0              
assi ( resi  87 and name HA   ) ( resi  87 and name HG1* ) 0 0 5.0              
assi ( resi  87 and name HA   ) ( resi  87 and name HG2* ) 0 0 2.5              
assi ( resi  87 and name HB   ) ( resi  87 and name HD*  ) 0 0 5.0              
assi ( resi  87 and name HB   ) ( resi  87 and name HG1* ) 0 0 5.0              
assi ( resi  87 and name HB   ) ( resi  87 and name HG2* ) 0 0 5.0              
assi ( resi  87 and name HD*  ) ( resi  87 and name HG1* ) 0 0 5.0              
assi ( resi  87 and name HD*  ) ( resi  87 and name HG2* ) 0 0 5.0              
assi ( resi  87 and name HG1* ) ( resi  87 and name HG2* ) 0 0 5.0              
assi ( resi  87 and name HD*  ) ( resi  89 and name HB*  ) 0 0 5.0              
assi ( resi  87 and name HD*  ) ( resi  89 and name HD2  ) 0 0 5.0              
assi ( resi  87 and name HG2* ) ( resi  89 and name HD2  ) 0 0 5.0              
assi ( resi  88 and name HA   ) ( resi  88 and name HB*  ) 0 0 2.5              
assi ( resi  88 and name HA   ) ( resi  88 and name HG*  ) 0 0 5.0              
assi ( resi  88 and name HB*  ) ( resi  88 and name HG*  ) 0 0 2.5              
assi ( resi  88 and name HG*  ) ( resi  89 and name HB*  ) 0 0 5.0              
assi ( resi  88 and name HG*  ) ( resi  93 and name HA*  ) 0 0 3.0              
assi ( resi  88 and name HA   ) ( resi  94 and name HA   ) 0 0 2.5              
assi ( resi  88 and name HA   ) ( resi  94 and name HB*  ) 0 0 5.0              
assi ( resi  88 and name HA   ) ( resi  94 and name HG*  ) 0 0 5.0              
assi ( resi  88 and name HB*  ) ( resi  94 and name HA   ) 0 0 5.0              
assi ( resi  88 and name HG*  ) ( resi  94 and name HA   ) 0 0 2.5              
assi ( resi  89 and name HA   ) ( resi  89 and name HB*  ) 0 0 3.0              
assi ( resi  89 and name HA   ) ( resi  89 and name HD2  ) 0 0 3.0              
assi ( resi  89 and name HB*  ) ( resi  89 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HB*  ) ( resi  89 and name HD2  ) 0 0 5.0              
assi ( resi  89 and name HD2  ) ( resi  89 and name HE1  ) 0 0 5.0              
assi ( resi  89 and name HA   ) ( resi  90 and name HD*  ) 0 0 2.5              
assi ( resi  89 and name HA   ) ( resi  90 and name HG*  ) 0 0 5.0              
assi ( resi  89 and name HD2  ) ( resi  90 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  90 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  90 and name HG*  ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  91 and name HA   ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  91 and name HB*  ) 0 0 2.5              
assi ( resi  89 and name HE1  ) ( resi  91 and name HG*  ) 0 0 3.0              
assi ( resi  89 and name HB*  ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HB*  ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  89 and name HD2  ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HD2  ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  89 and name HE1  ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  89 and name HB*  ) ( resi  95 and name HG*  ) 0 0 2.5              
assi ( resi  89 and name HD2  ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  90 and name HA   ) ( resi  90 and name HB*  ) 0 0 2.5              
assi ( resi  90 and name HA   ) ( resi  90 and name HD*  ) 0 0 5.0              
assi ( resi  90 and name HA   ) ( resi  90 and name HG*  ) 0 0 5.0              
assi ( resi  90 and name HB*  ) ( resi  90 and name HD*  ) 0 0 3.0              
assi ( resi  90 and name HD*  ) ( resi  90 and name HG*  ) 0 0 5.0              
assi ( resi  91 and name HA   ) ( resi  91 and name HB*  ) 0 0 2.5              
assi ( resi  91 and name HA   ) ( resi  91 and name HG*  ) 0 0 2.5              
assi ( resi  91 and name HB*  ) ( resi  91 and name HG*  ) 0 0 2.5              
assi ( resi  91 and name HA   ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  91 and name HA   ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  91 and name HB*  ) ( resi  92 and name HD*  ) 0 0 3.0              
assi ( resi  91 and name HB*  ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  91 and name HG*  ) ( resi  92 and name HD*  ) 0 0 5.0              
assi ( resi  91 and name HG*  ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  92 and name HA   ) ( resi  92 and name HB*  ) 0 0 5.0              
assi ( resi  92 and name HA   ) ( resi  92 and name HD*  ) 0 0 2.5              
assi ( resi  92 and name HA   ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  92 and name HB*  ) ( resi  92 and name HD*  ) 0 0 3.0              
assi ( resi  92 and name HB*  ) ( resi  92 and name HE*  ) 0 0 5.0              
assi ( resi  92 and name HD*  ) ( resi  92 and name HE*  ) 0 0 2.5              
assi ( resi  92 and name HD*  ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  94 and name HA   ) ( resi  94 and name HB*  ) 0 0 2.5              
assi ( resi  94 and name HA   ) ( resi  94 and name HG*  ) 0 0 2.5              
assi ( resi  94 and name HB*  ) ( resi  94 and name HG*  ) 0 0 5.0              
assi ( resi  95 and name HA   ) ( resi  95 and name HB   ) 0 0 2.5              
assi ( resi  95 and name HA   ) ( resi  95 and name HG*  ) 0 0 3.0              
assi ( resi  95 and name HB   ) ( resi  95 and name HG*  ) 0 0 5.0              
assi ( resi  95 and name HG*  ) ( resi  97 and name HA   ) 0 0 5.0              
assi ( resi  96 and name HA   ) ( resi  96 and name HB   ) 0 0 5.0              
assi ( resi  96 and name HA   ) ( resi  96 and name HD*  ) 0 0 3.0              
assi ( resi  96 and name HA   ) ( resi  96 and name HG1* ) 0 0 3.0              
assi ( resi  96 and name HA   ) ( resi  96 and name HG2* ) 0 0 3.0              
assi ( resi  96 and name HB   ) ( resi  96 and name HD*  ) 0 0 5.0              
assi ( resi  96 and name HB   ) ( resi  96 and name HG1* ) 0 0 2.5              
assi ( resi  96 and name HB   ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  96 and name HD*  ) ( resi  96 and name HG1* ) 0 0 5.0              
assi ( resi  96 and name HD*  ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  96 and name HG1* ) ( resi  96 and name HG2* ) 0 0 5.0              
assi ( resi  96 and name HG2* ) ( resi  97 and name HA   ) 0 0 5.0              
assi ( resi  96 and name HG2* ) ( resi  98 and name HA   ) 0 0 5.0              
assi ( resi  97 and name HA   ) ( resi  97 and name HB*  ) 0 0 3.0              
assi ( resi  97 and name HA   ) ( resi  97 and name HG*  ) 0 0 2.5              
assi ( resi  97 and name HB*  ) ( resi  97 and name HG*  ) 0 0 5.0              
assi ( resi  97 and name HA   ) ( resi  98 and name HD*  ) 0 0 5.0              
assi ( resi  98 and name HA   ) ( resi  98 and name HB*  ) 0 0 3.0              
assi ( resi  98 and name HA   ) ( resi  98 and name HD*  ) 0 0 2.5              
assi ( resi  98 and name HA   ) ( resi  98 and name HG   ) 0 0 3.0              
assi ( resi  98 and name HB*  ) ( resi  98 and name HD*  ) 0 0 2.5              
assi ( resi  98 and name HB*  ) ( resi  98 and name HG   ) 0 0 3.0              
assi ( resi  98 and name HD*  ) ( resi  98 and name HG   ) 0 0 2.5              
assi ( resi  98 and name HD*  ) ( resi  98 and name HG*  ) 0 0 2.5              
assi ( resi  98 and name HA   ) ( resi 102 and name HG*  ) 0 0 5.0              
assi ( resi  98 and name HB*  ) ( resi 102 and name HG*  ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 102 and name HA   ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 102 and name HB*  ) 0 0 3.0              
assi ( resi  98 and name HD*  ) ( resi 102 and name HG*  ) 0 0 3.0              
assi ( resi  98 and name HD*  ) ( resi 103 and name HA   ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 106 and name HA   ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi  98 and name HD*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi  99 and name HA   ) ( resi  99 and name HB*  ) 0 0 2.5              
assi ( resi  99 and name HA   ) ( resi  99 and name HG*  ) 0 0 2.5              
assi ( resi 101 and name HA   ) ( resi 101 and name HB*  ) 0 0 2.5              
assi ( resi 102 and name HA   ) ( resi 102 and name HB*  ) 0 0 3.0              
assi ( resi 102 and name HA   ) ( resi 102 and name HG*  ) 0 0 3.0              
assi ( resi 102 and name HB*  ) ( resi 102 and name HG*  ) 0 0 5.0              
assi ( resi 102 and name HA   ) ( resi 105 and name HB*  ) 0 0 5.0              
assi ( resi 102 and name HB*  ) ( resi 106 and name HB   ) 0 0 5.0              
assi ( resi 103 and name HA   ) ( resi 106 and name HG2* ) 0 0 2.5              
assi ( resi 104 and name HA   ) ( resi 104 and name HB*  ) 0 0 2.5              
assi ( resi 104 and name HA   ) ( resi 104 and name HD*  ) 0 0 5.0              
assi ( resi 104 and name HA   ) ( resi 104 and name HE*  ) 0 0 5.0              
assi ( resi 104 and name HA   ) ( resi 104 and name HG*  ) 0 0 3.0              
assi ( resi 104 and name HB*  ) ( resi 104 and name HE*  ) 0 0 3.0              
assi ( resi 104 and name HB*  ) ( resi 104 and name HG*  ) 0 0 5.0              
assi ( resi 104 and name HE*  ) ( resi 104 and name HG*  ) 0 0 5.0              
assi ( resi 105 and name HA   ) ( resi 105 and name HB*  ) 0 0 2.5              
assi ( resi 105 and name HA   ) ( resi 108 and name HB*  ) 0 0 2.5              
assi ( resi 105 and name HA   ) ( resi 108 and name HG*  ) 0 0 3.0              
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 106 and name HA   ) 0 0 5.0
assi ( resi 106 and (name HG1* or name HG2*)) ( resi 106 and name HB   ) 0 0 2.5
assi ( resi 106 and name HA   ) ( resi 106 and name HB   ) 0 0 3.0              
assi ( resi 106 and name HA   ) ( resi 106 and name HB*  ) 0 0 5.0              
assi ( resi 106 and name HA   ) ( resi 106 and name HD*  ) 0 0 2.5              
assi ( resi 106 and name HA   ) ( resi 106 and name HG1* ) 0 0 5.0              
assi ( resi 106 and name HA   ) ( resi 106 and name HG2* ) 0 0 5.0              
assi ( resi 106 and name HB   ) ( resi 106 and name HD*  ) 0 0 2.5              
assi ( resi 106 and name HB   ) ( resi 106 and name HG1* ) 0 0 3.0              
assi ( resi 106 and name HB   ) ( resi 106 and name HG2* ) 0 0 2.5              
assi ( resi 106 and name HD*  ) ( resi 106 and name HG1* ) 0 0 2.5              
assi ( resi 106 and name HD*  ) ( resi 106 and name HG2* ) 0 0 5.0              
assi ( resi 106 and name HG1* ) ( resi 106 and name HG2* ) 0 0 2.5              
assi ( resi 106 and name HA   ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi 106 and name HA   ) ( resi 109 and name HB*  ) 0 0 2.5              
assi ( resi 106 and name HD*  ) ( resi 109 and (name HD* or name HE* or name HZ)
assi ( resi 106 and name HD*  ) ( resi 109 and name HA   ) 0 0 5.0              
assi ( resi 106 and name HD*  ) ( resi 109 and name HB*  ) 0 0 3.0              
assi ( resi 106 and name HA   ) ( resi 110 and name HD*  ) 0 0 5.0              
assi ( resi 106 and name HD*  ) ( resi 110 and name HG   ) 0 0 5.0              
assi ( resi 106 and name HG1* ) ( resi 110 and name HD*  ) 0 0 2.5              
assi ( resi 106 and name HG1* ) ( resi 110 and name HG   ) 0 0 5.0              
assi ( resi 106 and name HG2* ) ( resi 110 and name HD*  ) 0 0 5.0              
assi ( resi 107 and name HA   ) ( resi 107 and name HB*  ) 0 0 2.5              
assi ( resi 107 and name HA   ) ( resi 110 and name HB*  ) 0 0 5.0              
assi ( resi 107 and name HA   ) ( resi 110 and name HD*  ) 0 0 3.0              
assi ( resi 107 and name HA   ) ( resi 121 and name HD*  ) 0 0 2.5              
assi ( resi 107 and name HB*  ) ( resi 121 and name HD*  ) 0 0 3.0              
assi ( resi 108 and name HA   ) ( resi 108 and name HB*  ) 0 0 2.5              
assi ( resi 108 and name HA   ) ( resi 108 and name HG*  ) 0 0 3.0              
assi ( resi 108 and name HB*  ) ( resi 108 and name HG*  ) 0 0 5.0              
assi ( resi 108 and name HA   ) ( resi 111 and name HB   ) 0 0 5.0              
assi ( resi 108 and name HA   ) ( resi 111 and name HG*  ) 0 0 5.0              
assi ( resi 108 and name HB*  ) ( resi 111 and name HB   ) 0 0 5.0              
assi ( resi 108 and name HB*  ) ( resi 111 and name HG*  ) 0 0 5.0              
assi ( resi 108 and name HG*  ) ( resi 111 and name HG*  ) 0 0 5.0              
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 109 and name HA   
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 109 and name HB*  
assi ( resi 109 and name HA   ) ( resi 109 and name HB*  ) 0 0 2.5              
assi ( resi 109 and name HA   ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi 109 and name HA   ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi 109 and name HB*  ) ( resi 109 and name HD*  ) 0 0 5.0              
assi ( resi 109 and name HB*  ) ( resi 109 and name HE*  ) 0 0 5.0              
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 110 and name HA   
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 110 and name HD*  
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 110 and name HG   
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 112 and name HB*  
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 112 and name HG*  
assi ( resi 109 and name HA   ) ( resi 112 and name HA   ) 0 0 5.0              
assi ( resi 109 and name HA   ) ( resi 112 and name HB*  ) 0 0 2.5              
assi ( resi 109 and name HA   ) ( resi 112 and name HG*  ) 0 0 3.0              
assi ( resi 109 and name HD*  ) ( resi 112 and name HB*  ) 0 0 5.0              
assi ( resi 109 and name HE*  ) ( resi 112 and name HB*  ) 0 0 5.0              
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 113 and name HB   
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 113 and name HD*  
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 113 and name HG1* 
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 113 and name HG2* 
assi ( resi 109 and name HA   ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi 109 and name HA   ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi 109 and name HA   ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi 109 and name HD*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 3.0 
assi ( resi 109 and name HE*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 3.0 
assi ( resi 109 and name HZ   ) ( resi 113 and (name HD* or name HG2*)) 0 0 3.0 
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 115 and name HD*  
assi ( resi 109 and (name HD* or name HE* or name HZ)) ( resi 115 and name HG   
assi ( resi 110 and name HA   ) ( resi 110 and name HB*  ) 0 0 2.5              
assi ( resi 110 and name HA   ) ( resi 110 and name HD*  ) 0 0 2.5              
assi ( resi 110 and name HA   ) ( resi 110 and name HG   ) 0 0 5.0              
assi ( resi 110 and name HB*  ) ( resi 110 and name HD*  ) 0 0 2.5              
assi ( resi 110 and name HB*  ) ( resi 110 and name HG   ) 0 0 5.0              
assi ( resi 110 and name HD*  ) ( resi 110 and name HG   ) 0 0 3.0              
assi ( resi 110 and name HA   ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi 110 and name HA   ) ( resi 113 and name HG1* ) 0 0 5.0              
assi ( resi 110 and name HA   ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi 110 and name HD*  ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi 110 and name HD*  ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi 110 and name HA   ) ( resi 115 and name HA   ) 0 0 5.0              
assi ( resi 110 and name HA   ) ( resi 115 and name HB*  ) 0 0 5.0              
assi ( resi 110 and name HA   ) ( resi 115 and name HD*  ) 0 0 3.0              
assi ( resi 110 and name HD*  ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi 110 and name HG   ) ( resi 115 and name HD*  ) 0 0 5.0              
assi ( resi 111 and name HA   ) ( resi 111 and name HB   ) 0 0 5.0              
assi ( resi 111 and name HA   ) ( resi 111 and name HB*  ) 0 0 5.0              
assi ( resi 111 and name HA   ) ( resi 111 and name HG*  ) 0 0 2.5              
assi ( resi 111 and name HB   ) ( resi 111 and name HG*  ) 0 0 2.5              
assi ( resi 111 and name HG*  ) ( resi 112 and name HB*  ) 0 0 5.0              
assi ( resi 111 and name HG*  ) ( resi 112 and name HG*  ) 0 0 5.0              
assi ( resi 111 and name HG*  ) ( resi 117 and name HA   ) 0 0 5.0              
assi ( resi 112 and name HA   ) ( resi 112 and name HB*  ) 0 0 2.5              
assi ( resi 112 and name HA   ) ( resi 112 and name HG*  ) 0 0 2.5              
assi ( resi 112 and name HB*  ) ( resi 112 and name HG*  ) 0 0 2.5              
assi ( resi 112 and name HB*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 3.0 
assi ( resi 112 and name HB*  ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi 112 and name HB*  ) ( resi 113 and name HG2* ) 0 0 3.0              
assi ( resi 112 and name HG*  ) ( resi 113 and (name HD* or name HG2*)) 0 0 5.0 
assi ( resi 112 and name HG*  ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi 113 and (name HD* or name HG2*)) ( resi 113 and name HA   ) 0 0 2.5 
assi ( resi 113 and (name HD* or name HG2*)) ( resi 113 and name HB   ) 0 0 3.0 
assi ( resi 113 and (name HD* or name HG2*)) ( resi 113 and name HG1* ) 0 0 2.5 
assi ( resi 113 and name HA   ) ( resi 113 and name HB   ) 0 0 2.5              
assi ( resi 113 and name HA   ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi 113 and name HA   ) ( resi 113 and name HG1* ) 0 0 5.0              
assi ( resi 113 and name HA   ) ( resi 113 and name HG2* ) 0 0 2.5              
assi ( resi 113 and name HB   ) ( resi 113 and name HD*  ) 0 0 5.0              
assi ( resi 113 and name HB   ) ( resi 113 and name HG1* ) 0 0 3.0              
assi ( resi 113 and name HB   ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi 113 and name HD*  ) ( resi 113 and name HG1* ) 0 0 5.0              
assi ( resi 113 and name HG1* ) ( resi 113 and name HG2* ) 0 0 5.0              
assi ( resi 115 and name HA   ) ( resi 115 and name HB*  ) 0 0 2.5              
assi ( resi 115 and name HA   ) ( resi 115 and name HD*  ) 0 0 2.5              
assi ( resi 115 and name HA   ) ( resi 115 and name HG   ) 0 0 3.0              
assi ( resi 115 and name HB*  ) ( resi 115 and name HD*  ) 0 0 3.0              
assi ( resi 115 and name HB*  ) ( resi 115 and name HG   ) 0 0 5.0              
assi ( resi 115 and name HD*  ) ( resi 115 and name HG   ) 0 0 5.0              
assi ( resi 115 and name HD*  ) ( resi 116 and name HA   ) 0 0 5.0              
assi ( resi 115 and name HD*  ) ( resi 116 and name HB*  ) 0 0 5.0              
assi ( resi 116 and name HA   ) ( resi 116 and name HB*  ) 0 0 2.5              
assi ( resi 116 and name HA   ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi 116 and name HB*  ) ( resi 120 and name HB*  ) 0 0 3.0              
assi ( resi 116 and name HB*  ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 117 and name HB*  ) 0 0 2.5              
assi ( resi 117 and name HA   ) ( resi 117 and name HD*  ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 117 and name HE*  ) 0 0 2.5              
assi ( resi 117 and name HA   ) ( resi 117 and name HG*  ) 0 0 2.5              
assi ( resi 117 and name HB*  ) ( resi 117 and name HD*  ) 0 0 5.0              
assi ( resi 117 and name HB*  ) ( resi 117 and name HE*  ) 0 0 5.0              
assi ( resi 117 and name HB*  ) ( resi 117 and name HG*  ) 0 0 2.5              
assi ( resi 117 and name HD*  ) ( resi 117 and name HE*  ) 0 0 5.0              
assi ( resi 117 and name HD*  ) ( resi 117 and name HG*  ) 0 0 5.0              
assi ( resi 117 and name HE*  ) ( resi 117 and name HG*  ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi 117 and name HA   ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi 117 and name HB*  ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi 117 and name HB*  ) ( resi 120 and name HG*  ) 0 0 3.0              
assi ( resi 117 and name HG*  ) ( resi 120 and name HB*  ) 0 0 5.0              
assi ( resi 117 and name HG*  ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi 118 and name HA   ) ( resi 118 and name HB*  ) 0 0 3.0              
assi ( resi 118 and name HA   ) ( resi 121 and name HD*  ) 0 0 2.5              
assi ( resi 118 and name HA   ) ( resi 121 and name HG   ) 0 0 5.0              
assi ( resi 118 and name HB*  ) ( resi 121 and name HD*  ) 0 0 2.5              
assi ( resi 119 and name HA   ) ( resi 119 and name HB*  ) 0 0 5.0              
assi ( resi 120 and name HA   ) ( resi 120 and name HB*  ) 0 0 3.0              
assi ( resi 120 and name HA   ) ( resi 120 and name HG*  ) 0 0 2.5              
assi ( resi 120 and name HB*  ) ( resi 120 and name HG*  ) 0 0 5.0              
assi ( resi 121 and name HA   ) ( resi 121 and name HB*  ) 0 0 3.0              
assi ( resi 121 and name HA   ) ( resi 121 and name HD*  ) 0 0 2.5              
assi ( resi 121 and name HA   ) ( resi 121 and name HG   ) 0 0 5.0              
assi ( resi 121 and name HB*  ) ( resi 121 and name HD*  ) 0 0 2.5              
assi ( resi 121 and name HB*  ) ( resi 121 and name HG   ) 0 0 2.5              
assi ( resi 121 and name HD*  ) ( resi 121 and name HG   ) 0 0 2.5              
assi ( resi 121 and name HD*  ) ( resi 121 and name HG*  ) 0 0 2.5              
assi ( resi 122 and name HA   ) ( resi 122 and name HB*  ) 0 0 2.5              
assi ( resi 122 and name HA   ) ( resi 122 and name HD*  ) 0 0 2.5              
assi ( resi 122 and name HA   ) ( resi 122 and name HE*  ) 0 0 3.0              
assi ( resi 122 and name HA   ) ( resi 122 and name HG*  ) 0 0 2.5              
assi ( resi 122 and name HB*  ) ( resi 122 and name HD*  ) 0 0 5.0              
assi ( resi 122 and name HB*  ) ( resi 122 and name HE*  ) 0 0 5.0              
assi ( resi 122 and name HB*  ) ( resi 122 and name HG*  ) 0 0 2.5              
assi ( resi 122 and name HD*  ) ( resi 122 and name HE*  ) 0 0 5.0              
assi ( resi 122 and name HD*  ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi 122 and name HE*  ) ( resi 122 and name HG*  ) 0 0 5.0              
assi ( resi 122 and name HA   ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi 122 and name HB*  ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi 122 and name HB*  ) ( resi 124 and name HE1  ) 0 0 5.0              
assi ( resi 122 and name HD*  ) ( resi 124 and name HE1  ) 0 0 5.0              
assi ( resi 122 and name HG*  ) ( resi 124 and name HE1  ) 0 0 5.0              
assi ( resi 123 and name HA   ) ( resi 123 and name HB   ) 0 0 2.5              
assi ( resi 123 and name HA   ) ( resi 123 and name HG*  ) 0 0 2.5              
assi ( resi 123 and name HB   ) ( resi 123 and name HG*  ) 0 0 2.5              
assi ( resi 123 and name HA   ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi 123 and name HG*  ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi 124 and name HA   ) ( resi 124 and name HB*  ) 0 0 3.0              
assi ( resi 124 and name HA   ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi 124 and name HB*  ) ( resi 124 and name HD2  ) 0 0 5.0              
assi ( resi 124 and name HD2  ) ( resi 124 and name HE1  ) 0 0 5.0              
assi ( resi 125 and name HA*  ) ( resi 126 and (name HD* or name HE* or name HZ)
assi ( resi 126 and (name HD* or name HE* or name HZ)) ( resi 126 and name HA   
assi ( resi 126 and (name HD* or name HE* or name HZ)) ( resi 126 and name HB*  
assi ( resi 126 and name HA   ) ( resi 126 and name HB*  ) 0 0 2.5              
                                                                                
! Lower Limit Distance Restraints                                               
                                                                                
assi ( resi  44 and name HN   ) ( resi  45 and name HN   ) 3.5 0.0 3.5          
assi ( resi  45 and name HN   ) ( resi  46 and name HN   ) 3.5 0.0 3.5          
assi ( resi  46 and name HN   ) ( resi  47 and name HN   ) 3.5 0.0 3.5          
assi ( resi  47 and name HN   ) ( resi  48 and name HN   ) 3.5 0.0 3.5          
assi ( resi  55 and name HN   ) ( resi  56 and name HN   ) 3.5 0.0 3.5          
assi ( resi  61 and name HN   ) ( resi  62 and name HN   ) 3.5 0.0 3.5          
assi ( resi  83 and name HN   ) ( resi  84 and name HN   ) 3.5 0.0 3.5          
assi ( resi  84 and name HN   ) ( resi  85 and name HN   ) 3.5 0.0 3.5          
assi ( resi  85 and name HN   ) ( resi  86 and name HN   ) 3.5 0.0 3.5          
assi ( resi  86 and name HN   ) ( resi  87 and name HN   ) 3.5 0.0 3.5          
assi ( resi  87 and name HN   ) ( resi  88 and name HN   ) 3.5 0.0 3.5          
assi ( resi  88 and name HN   ) ( resi  89 and name HN   ) 3.5 0.0 3.5          
assi ( resi  95 and name HN   ) ( resi  96 and name HN   ) 3.5 0.0 3.5          
assi ( resi  96 and name HN   ) ( resi  97 and name HN   ) 3.5 0.0 3.5          
assi ( resi  97 and name HN   ) ( resi  98 and name HN   ) 3.5 0.0 3.5          
assi ( resi  98 and name HN   ) ( resi  99 and name HN   ) 3.5 0.0 3.5          
assi ( resi  99 and name HN   ) ( resi 100 and name HN   ) 3.5 0.0 3.5          
assi ( resi 116 and name HN   ) ( resi 117 and name HN   ) 3.5 0.0 3.5          
assi ( resi 121 and name HN   ) ( resi 122 and name HN   ) 3.5 0.0 3.5          
assi ( resi 122 and name HN   ) ( resi 123 and name HN   ) 3.5 0.0 3.5          
assi ( resi 123 and name HN   ) ( resi 124 and name HN   ) 3.5 0.0 3.5          
                                                                                
! Distance Restraints from Hydrogen Bonds                                       
                                                                                
assi ( resi  57 and name HN   ) ( resi  49 and name O   ) 0.0 0.0 2.5           
assi ( resi  57 and name N    ) ( resi  49 and name O   ) 2.5 0.0 0.8           
assi ( resi  73 and name HN   ) ( resi  69 and name O   ) 0.0 0.0 2.5           
assi ( resi  73 and name N    ) ( resi  69 and name O   ) 2.5 0.0 0.8           
assi ( resi  74 and name HN   ) ( resi  70 and name O   ) 0.0 0.0 2.5           
assi ( resi  74 and name N    ) ( resi  70 and name O   ) 2.5 0.0 0.8           
assi ( resi  95 and name HN   ) ( resi  87 and name O   ) 0.0 0.0 2.5           
assi ( resi  95 and name N    ) ( resi  87 and name O   ) 2.5 0.0 0.8           
assi ( resi  96 and name HN   ) ( resi  60 and name O   ) 0.0 0.0 2.5           
assi ( resi  96 and name N    ) ( resi  60 and name O   ) 2.5 0.0 0.8           
assi ( resi  97 and name HN   ) ( resi  85 and name O   ) 0.0 0.0 2.5           
assi ( resi  97 and name N    ) ( resi  85 and name O   ) 2.5 0.0 0.8           
assi ( resi 110 and name HN   ) ( resi 106 and name O   ) 0.0 0.0 2.5           
assi ( resi 110 and name N    ) ( resi 106 and name O   ) 2.5 0.0 0.8           
assi ( resi 111 and name HN   ) ( resi 107 and name O   ) 0.0 0.0 2.5           
assi ( resi 111 and name N    ) ( resi 107 and name O   ) 2.5 0.0 0.8           
assi ( resi 112 and name HN   ) ( resi 108 and name O   ) 0.0 0.0 2.5           
assi ( resi 112 and name N    ) ( resi 108 and name O   ) 2.5 0.0 0.8           
assi ( resi 113 and name HN   ) ( resi 109 and name O   ) 0.0 0.0 2.5           
assi ( resi 113 and name N    ) ( resi 109 and name O   ) 2.5 0.0 0.8           
assi ( resi 115 and name HN   ) ( resi 110 and name O   ) 0.0 0.0 2.5           
assi ( resi 115 and name N    ) ( resi 110 and name O   ) 2.5 0.0 0.8           

  Entry H atom name         Submitted Coord H atom name

  Start of MODEL    1
    1   1H    MET   1          3H        MET   1 -33.503 -37.069 -37.069
    2   2H    MET   1          2H        MET   1 -33.658 -35.411 -35.411
    3   3H    MET   1          1H        MET   1 -32.786 -36.477 -36.477
    4    HA   MET   1           HA       MET   1 -31.197 -35.284 -35.284
    5   1HB   MET   1          2HB       MET   1 -33.066 -35.715 -35.715
    6   2HB   MET   1          1HB       MET   1 -31.368 -35.381 -35.381
    7   1HG   MET   1          2HG       MET   1 -31.864 -33.230 -33.230
    8   2HG   MET   1          1HG       MET   1 -32.119 -33.457 -33.457
    9   1HE   MET   1          3HE       MET   1 -33.505 -32.253 -32.253
   10   2HE   MET   1          2HE       MET   1 -35.226 -32.636 -32.636
   11   3HE   MET   1          1HE       MET   1 -34.039 -33.908 -33.908
   12    H    ARG   2           H        ARG   2 -32.322 -37.760 -37.760
   13    HA   ARG   2           HA       ARG   2 -31.387 -39.701 -39.701
   14   1HB   ARG   2          2HB       ARG   2 -31.769 -40.152 -40.152
   15   2HB   ARG   2          1HB       ARG   2 -30.028 -39.955 -39.955
   16   1HG   ARG   2          2HG       ARG   2 -29.568 -41.873 -41.873
   17   2HG   ARG   2          1HG       ARG   2 -31.123 -41.853 -41.853
   18   1HD   ARG   2          2HD       ARG   2 -31.504 -42.071 -42.071
   19   2HD   ARG   2          1HD       ARG   2 -30.416 -43.333 -43.333
   20    HE   ARG   2           HE       ARG   2 -32.488 -43.374 -43.374
   21   1HH1  ARG   2          2HH1      ARG   2 -32.228 -43.637 -43.637
   22   2HH1  ARG   2          1HH1      ARG   2 -33.619 -44.658 -44.658
   23   1HH2  ARG   2          1HH2      ARG   2 -34.318 -44.716 -44.716
   24   2HH2  ARG   2          2HH2      ARG   2 -34.806 -45.270 -45.270
   25    H    GLY   3           H        GLY   3 -29.921 -37.192 -37.192
   26   1HA   GLY   3          2HA       GLY   3 -27.120 -37.982 -37.982
   27   2HA   GLY   3          1HA       GLY   3 -27.718 -36.407 -36.407
   28    H    SER   4           H        SER   4 -27.104 -35.982 -35.982
   29    HA   SER   4           HA       SER   4 -26.452 -38.044 -38.044
   30   1HB   SER   4          2HB       SER   4 -26.713 -35.053 -35.053
   31   2HB   SER   4          1HB       SER   4 -25.996 -36.181 -36.181
   32    HG   SER   4           HG       SER   4 -25.060 -35.899 -35.899
   33    H    HIS   5           H        HIS   5 -27.707 -38.975 -38.975
   34    HA   HIS   5           HA       HIS   5 -30.202 -37.651 -37.651
   35   1HB   HIS   5          2HB       HIS   5 -31.430 -39.770 -39.770
   36   2HB   HIS   5          1HB       HIS   5 -30.785 -39.271 -39.271
   37    HD1  HIS   5           HD1      HIS   5 -31.275 -42.218 -42.218
   38    HD2  HIS   5           HD2      HIS   5 -27.973 -40.628 -40.628
   39    HE1  HIS   5           HE1      HIS   5 -29.776 -44.177 -44.177
   40    HE2  HIS   5           HE2      HIS   5 -27.824 -43.202 -43.202
   41    H    HIS   6           H        HIS   6 -28.617 -37.221 -37.221
   42    HA   HIS   6           HA       HIS   6 -29.003 -39.262 -39.262
   43   1HB   HIS   6          2HB       HIS   6 -26.312 -38.097 -38.097
   44   2HB   HIS   6          1HB       HIS   6 -26.627 -38.970 -38.970
   45    HD1  HIS   6           HD1      HIS   6 -27.500 -41.530 -41.530
   46    HD2  HIS   6           HD2      HIS   6 -25.572 -39.681 -39.681
   47    HE1  HIS   6           HE1      HIS   6 -26.801 -43.393 -43.393
   48    HE2  HIS   6           HE2      HIS   6 -25.713 -42.244 -42.244
   49    H    HIS   7           H        HIS   7 -30.161 -36.644 -36.644
   50    HA   HIS   7           HA       HIS   7 -29.347 -35.273 -35.273
   51   1HB   HIS   7          2HB       HIS   7 -29.750 -34.203 -34.203
   52   2HB   HIS   7          1HB       HIS   7 -30.398 -33.233 -33.233
   53    HD1  HIS   7           HD1      HIS   7 -27.714 -32.921 -32.921
   54    HD2  HIS   7           HD2      HIS   7 -27.948 -33.534 -33.534
   55    HE1  HIS   7           HE1      HIS   7 -25.532 -32.084 -32.084
   56    HE2  HIS   7           HE2      HIS   7 -25.734 -32.382 -32.382
   57    H    HIS   8           H        HIS   8 -31.120 -33.780 -33.780
   58    HA   HIS   8           HA       HIS   8 -33.577 -35.315 -35.315
   59   1HB   HIS   8          2HB       HIS   8 -32.305 -33.189 -33.189
   60   2HB   HIS   8          1HB       HIS   8 -34.065 -33.175 -33.175
   61    HD1  HIS   8           HD1      HIS   8 -34.869 -36.001 -36.001
   62    HD2  HIS   8           HD2      HIS   8 -31.568 -34.491 -34.491
   63    HE1  HIS   8           HE1      HIS   8 -34.494 -37.562 -37.562
   64    HE2  HIS   8           HE2      HIS   8 -32.433 -36.683 -36.683
   65    H    HIS   9           H        HIS   9 -32.456 -32.197 -32.197
   66    HA   HIS   9           HA       HIS   9 -34.454 -31.975 -31.975
   67   1HB   HIS   9          2HB       HIS   9 -35.593 -29.904 -29.904
   68   2HB   HIS   9          1HB       HIS   9 -36.108 -31.504 -31.504
   69    HD1  HIS   9           HD1      HIS   9 -36.948 -30.393 -30.393
   70    HD2  HIS   9           HD2      HIS   9 -32.843 -30.199 -30.199
   71    HE1  HIS   9           HE1      HIS   9 -35.959 -29.768 -29.768
   72    HE2  HIS   9           HE2      HIS   9 -33.469 -29.753 -29.753
   73    H    HIS  10           H        HIS  10 -32.397 -31.550 -31.550
   74    HA   HIS  10           HA       HIS  10 -31.846 -28.708 -28.708
   75   1HB   HIS  10          2HB       HIS  10 -30.127 -30.520 -30.520
   76   2HB   HIS  10          1HB       HIS  10 -29.267 -29.851 -29.851
   77    HD1  HIS  10           HD1      HIS  10 -29.995 -29.141 -29.141
   78    HD2  HIS  10           HD2      HIS  10 -29.535 -26.853 -26.853
   79    HE1  HIS  10           HE1      HIS  10 -29.539 -26.803 -26.803
   80    HE2  HIS  10           HE2      HIS  10 -29.181 -25.454 -25.454
   81    H    THR  11           H        THR  11 -29.858 -31.461 -31.461
   82    HA   THR  11           HA       THR  11 -29.067 -32.054 -32.054
   83    HB   THR  11           HB       THR  11 -30.772 -32.433 -32.433
   84    HG1  THR  11           HG1      THR  11 -32.914 -31.723 -31.723
   85   1HG2  THR  11          2HG2      THR  11 -31.148 -33.287 -33.287
   86   2HG2  THR  11          1HG2      THR  11 -32.613 -33.353 -33.353
   87   3HG2  THR  11          3HG2      THR  11 -31.168 -34.221 -34.221
   88    H    ASP  12           H        ASP  12 -27.602 -30.361 -30.361
   89    HA   ASP  12           HA       ASP  12 -28.460 -28.407 -28.407
   90   1HB   ASP  12          2HB       ASP  12 -27.085 -27.898 -27.898
   91   2HB   ASP  12          1HB       ASP  12 -26.656 -26.899 -26.899
   92    HA   PRO  13           HA       PRO  13 -24.887 -30.951 -30.951
   93   1HB   PRO  13          2HB       PRO  13 -26.104 -29.871 -29.871
   94   2HB   PRO  13          1HB       PRO  13 -25.530 -31.503 -31.503
   95   1HG   PRO  13          2HG       PRO  13 -28.136 -30.966 -30.966
   96   2HG   PRO  13          1HG       PRO  13 -27.462 -32.075 -32.075
   97   1HD   PRO  13          2HD       PRO  13 -28.368 -29.248 -29.248
   98   2HD   PRO  13          1HD       PRO  13 -28.500 -30.610 -30.610
   99    H    MET  14           H        MET  14 -25.953 -27.666 -27.666
  100    HA   MET  14           HA       MET  14 -23.817 -26.679 -26.679
  101   1HB   MET  14          2HB       MET  14 -25.842 -25.387 -25.387
  102   2HB   MET  14          1HB       MET  14 -25.518 -25.286 -25.286
  103   1HG   MET  14          2HG       MET  14 -23.488 -23.988 -23.988
  104   2HG   MET  14          1HG       MET  14 -23.874 -24.052 -24.052
  105   1HE   MET  14          3HE       MET  14 -23.123 -21.816 -21.816
  106   2HE   MET  14          2HE       MET  14 -24.043 -20.594 -20.594
  107   3HE   MET  14          1HE       MET  14 -24.354 -20.870 -20.870
  108    H    SER  15           H        SER  15 -24.026 -27.528 -27.528
  109    HA   SER  15           HA       SER  15 -21.860 -26.012 -26.012
  110   1HB   SER  15          2HB       SER  15 -23.198 -28.542 -28.542
  111   2HB   SER  15          1HB       SER  15 -21.803 -27.873 -27.873
  112    HG   SER  15           HG       SER  15 -24.148 -26.387 -26.387
  113    H    ALA  16           H        ALA  16 -21.942 -28.716 -28.716
  114    HA   ALA  16           HA       ALA  16 -19.122 -29.332 -29.332
  115   1HB   ALA  16          3HB       ALA  16 -20.784 -31.195 -31.195
  116   2HB   ALA  16          2HB       ALA  16 -21.054 -31.015 -31.015
  117   3HB   ALA  16          1HB       ALA  16 -19.462 -31.479 -31.479
  118    H    ILE  17           H        ILE  17 -19.587 -27.009 -27.009
  119    HA   ILE  17           HA       ILE  17 -18.734 -27.754 -27.754
  120    HB   ILE  17           HB       ILE  17 -20.242 -25.248 -25.248
  121   1HG1  ILE  17          2HG1      ILE  17 -21.199 -27.762 -27.762
  122   2HG1  ILE  17          1HG1      ILE  17 -21.699 -27.194 -27.194
  123   1HG2  ILE  17          2HG2      ILE  17 -18.578 -25.629 -25.629
  124   2HG2  ILE  17          1HG2      ILE  17 -20.128 -26.122 -26.122
  125   3HG2  ILE  17          3HG2      ILE  17 -19.944 -24.513 -24.513
  126   1HD1  ILE  17          2HD1      ILE  17 -22.132 -25.556 -25.556
  127   2HD1  ILE  17          1HD1      ILE  17 -23.280 -26.787 -26.787
  128   3HD1  ILE  17          3HD1      ILE  17 -22.919 -25.414 -25.414
  129    H    GLN  18           H        GLN  18 -16.542 -27.703 -27.703
  130    HA   GLN  18           HA       GLN  18 -15.510 -25.006 -25.006
  131   1HB   GLN  18          2HB       GLN  18 -13.471 -26.316 -26.316
  132   2HB   GLN  18          1HB       GLN  18 -14.919 -26.290 -26.290
  133   1HG   GLN  18          2HG       GLN  18 -14.806 -28.520 -28.520
  134   2HG   GLN  18          1HG       GLN  18 -13.518 -28.518 -28.518
  135   1HE2  GLN  18          2HE2      GLN  18 -16.463 -30.378 -30.378
  136   2HE2  GLN  18          1HE2      GLN  18 -15.473 -30.485 -30.485
  137    H    ASN  19           H        ASN  19 -16.109 -26.138 -26.138
  138    HA   ASN  19           HA       ASN  19 -15.207 -26.234 -26.234
  139   1HB   ASN  19          2HB       ASN  19 -12.789 -24.922 -24.922
  140   2HB   ASN  19          1HB       ASN  19 -13.233 -24.907 -24.907
  141   1HD2  ASN  19          2HD2      ASN  19 -14.280 -21.670 -21.670
  142   2HD2  ASN  19          1HD2      ASN  19 -12.843 -22.537 -22.537
  143    H    LEU  20           H        LEU  20 -15.157 -28.615 -28.615
  144    HA   LEU  20           HA       LEU  20 -12.522 -29.733 -29.733
  145   1HB   LEU  20          2HB       LEU  20 -15.239 -30.599 -30.599
  146   2HB   LEU  20          1HB       LEU  20 -14.374 -31.774 -31.774
  147    HG   LEU  20           HG       LEU  20 -14.362 -32.247 -32.247
  148   1HD1  LEU  20          3HD1      LEU  20 -11.698 -31.769 -31.769
  149   2HD1  LEU  20          2HD1      LEU  20 -11.955 -32.764 -32.764
  150   3HD1  LEU  20          1HD1      LEU  20 -12.684 -33.229 -33.229
  151   1HD2  LEU  20          1HD2      LEU  20 -13.863 -29.594 -29.594
  152   2HD2  LEU  20          3HD2      LEU  20 -13.570 -30.814 -30.814
  153   3HD2  LEU  20          2HD2      LEU  20 -12.249 -30.275 -30.275
  154    H    HIS  21           H        HIS  21 -11.547 -31.268 -31.268
  155    HA   HIS  21           HA       HIS  21 -10.616 -31.689 -31.689
  156   1HB   HIS  21          2HB       HIS  21 -12.743 -32.367 -32.367
  157   2HB   HIS  21          1HB       HIS  21 -11.916 -33.450 -33.450
  158    HD1  HIS  21           HD1      HIS  21 -15.016 -31.316 -31.316
  159    HD2  HIS  21           HD2      HIS  21 -13.431 -34.335 -34.335
  160    HE1  HIS  21           HE1      HIS  21 -16.892 -32.037 -32.037
  161    HE2  HIS  21           HE2      HIS  21 -15.936 -33.929 -33.929
  162    H    SER  22           H        SER  22  -9.836 -29.684 -29.684
  163    HA   SER  22           HA       SER  22 -11.400 -28.390 -28.390
  164   1HB   SER  22          2HB       SER  22 -11.566 -27.055 -27.055
  165   2HB   SER  22          1HB       SER  22  -9.812 -26.875 -26.875
  166    HG   SER  22           HG       SER  22 -11.731 -25.822 -25.822
  167    H    PHE  23           H        PHE  23  -9.230 -30.314 -30.314
  168    HA   PHE  23           HA       PHE  23  -7.639 -29.101 -29.101
  169   1HB   PHE  23          2HB       PHE  23  -6.663 -28.144 -28.144
  170   2HB   PHE  23          1HB       PHE  23  -6.051 -29.768 -29.768
  171    HD1  PHE  23           HD1      PHE  23  -4.732 -30.812 -30.812
  172    HD2  PHE  23           HD2      PHE  23  -5.303 -26.647 -26.647
  173    HE1  PHE  23           HE1      PHE  23  -2.765 -30.323 -30.323
  174    HE2  PHE  23           HE2      PHE  23  -3.337 -26.151 -26.151
  175    HZ   PHE  23           HZ       PHE  23  -2.067 -27.990 -27.990
  176    H    ASP  24           H        ASP  24  -7.432 -30.741 -30.741
  177    HA   ASP  24           HA       ASP  24  -6.035 -33.097 -33.097
  178   1HB   ASP  24          2HB       ASP  24  -8.922 -33.181 -33.181
  179   2HB   ASP  24          1HB       ASP  24  -8.345 -34.474 -34.474
  180    HA   PRO  25           HA       PRO  25  -6.016 -32.080 -32.080
  181   1HB   PRO  25          2HB       PRO  25  -4.106 -34.369 -34.369
  182   2HB   PRO  25          1HB       PRO  25  -3.943 -32.827 -32.827
  183   1HG   PRO  25          2HG       PRO  25  -2.654 -33.251 -33.251
  184   2HG   PRO  25          1HG       PRO  25  -3.378 -31.672 -31.672
  185   1HD   PRO  25          2HD       PRO  25  -4.320 -33.820 -33.820
  186   2HD   PRO  25          1HD       PRO  25  -4.448 -32.057 -32.057
  187    H    PHE  26           H        PHE  26  -6.483 -35.155 -35.155
  188    HA   PHE  26           HA       PHE  26  -7.811 -36.212 -36.212
  189   1HB   PHE  26          2HB       PHE  26  -6.852 -37.731 -37.731
  190   2HB   PHE  26          1HB       PHE  26  -7.509 -38.430 -38.430
  191    HD1  PHE  26           HD1      PHE  26  -4.757 -36.171 -36.171
  192    HD2  PHE  26           HD2      PHE  26  -6.043 -39.199 -39.199
  193    HE1  PHE  26           HE1      PHE  26  -2.491 -36.280 -36.280
  194    HE2  PHE  26           HE2      PHE  26  -3.778 -39.314 -39.314
  195    HZ   PHE  26           HZ       PHE  26  -1.998 -37.854 -37.854
  196    H    ALA  27           H        ALA  27  -8.976 -34.291 -34.291
  197    HA   ALA  27           HA       ALA  27 -11.543 -35.407 -35.407
  198   1HB   ALA  27          3HB       ALA  27 -10.180 -36.567 -36.567
  199   2HB   ALA  27          2HB       ALA  27 -10.364 -35.027 -35.027
  200   3HB   ALA  27          1HB       ALA  27 -11.791 -35.942 -35.942
  201    H    ASP  28           H        ASP  28 -12.523 -33.584 -33.584
  202    HA   ASP  28           HA       ASP  28 -13.293 -31.446 -31.446
  203   1HB   ASP  28          2HB       ASP  28 -13.469 -32.247 -32.247
  204   2HB   ASP  28          1HB       ASP  28 -12.367 -30.889 -30.889
  205    H    ALA  29           H        ALA  29 -11.124 -31.434 -31.434
  206    HA   ALA  29           HA       ALA  29  -9.983 -28.887 -28.887
  207   1HB   ALA  29          3HB       ALA  29  -8.838 -30.593 -30.593
  208   2HB   ALA  29          2HB       ALA  29  -7.771 -30.788 -30.788
  209   3HB   ALA  29          1HB       ALA  29  -8.025 -29.190 -29.190
  210    H    SER  30           H        SER  30  -8.307 -28.423 -28.423
  211    HA   SER  30           HA       SER  30  -7.545 -30.296 -30.296
  212   1HB   SER  30          2HB       SER  30 -10.168 -29.675 -29.675
  213   2HB   SER  30          1HB       SER  30  -9.420 -28.416 -28.416
  214    HG   SER  30           HG       SER  30  -8.763 -29.875 -29.875
  215    H    LYS  31           H        LYS  31  -5.690 -29.516 -29.516
  216    HA   LYS  31           HA       LYS  31  -5.470 -26.701 -26.701
  217   1HB   LYS  31          2HB       LYS  31  -4.728 -27.093 -27.093
  218   2HB   LYS  31          1HB       LYS  31  -3.344 -27.926 -27.926
  219   1HG   LYS  31          2HG       LYS  31  -3.211 -25.663 -25.663
  220   2HG   LYS  31          1HG       LYS  31  -4.001 -25.045 -25.045
  221   1HD   LYS  31          2HD       LYS  31  -1.837 -26.799 -26.799
  222   2HD   LYS  31          1HD       LYS  31  -1.265 -25.546 -25.546
  223   1HE   LYS  31          2HE       LYS  31  -2.811 -25.078 -25.078
  224   2HE   LYS  31          1HE       LYS  31  -1.072 -24.863 -24.863
  225   1HZ   LYS  31          1HZ       LYS  31  -2.699 -23.434 -23.434
  226   2HZ   LYS  31          3HZ       LYS  31  -2.886 -22.916 -22.916
  227   3HZ   LYS  31          2HZ       LYS  31  -1.354 -22.911 -22.911
  228    H    GLY  32           H        GLY  32  -4.279 -26.407 -26.407
  229   1HA   GLY  32          2HA       GLY  32  -2.992 -28.773 -28.773
  230   2HA   GLY  32          1HA       GLY  32  -3.448 -27.318 -27.318
  231    H    ASP  33           H        ASP  33  -0.867 -29.028 -29.028
  232    HA   ASP  33           HA       ASP  33   0.924 -27.225 -27.225
  233   1HB   ASP  33          2HB       ASP  33   1.162 -29.724 -29.724
  234   2HB   ASP  33          1HB       ASP  33   2.599 -28.712 -28.712
  235    H    ASP  34           H        ASP  34  -0.184 -27.570 -27.570
  236    HA   ASP  34           HA       ASP  34   1.749 -25.559 -25.559
  237   1HB   ASP  34          2HB       ASP  34  -0.126 -27.320 -27.320
  238   2HB   ASP  34          1HB       ASP  34   1.036 -26.188 -26.188
  239    H    LEU  35           H        LEU  35  -1.722 -26.227 -26.227
  240    HA   LEU  35           HA       LEU  35  -2.396 -23.639 -23.639
  241   1HB   LEU  35          2HB       LEU  35  -3.693 -26.090 -26.090
  242   2HB   LEU  35          1HB       LEU  35  -4.570 -25.058 -25.058
  243    HG   LEU  35           HG       LEU  35  -4.032 -24.272 -24.272
  244   1HD1  LEU  35          2HD1      LEU  35  -6.075 -26.082 -26.082
  245   2HD1  LEU  35          1HD1      LEU  35  -6.626 -24.889 -24.889
  246   3HD1  LEU  35          3HD1      LEU  35  -5.364 -26.041 -26.041
  247   1HD2  LEU  35          3HD2      LEU  35  -6.017 -23.309 -23.309
  248   2HD2  LEU  35          2HD2      LEU  35  -4.578 -22.446 -22.446
  249   3HD2  LEU  35          1HD2      LEU  35  -5.906 -22.741 -22.741
  250    H    LEU  36           H        LEU  36  -1.933 -21.957 -21.957
  251    HA   LEU  36           HA       LEU  36  -2.625 -22.119 -22.119
  252   1HB   LEU  36          2HB       LEU  36  -0.821 -20.279 -20.279
  253   2HB   LEU  36          1HB       LEU  36  -1.295 -19.945 -19.945
  254    HG   LEU  36           HG       LEU  36   0.874 -20.954 -20.954
  255   1HD1  LEU  36          1HD1      LEU  36  -1.173 -21.805 -21.805
  256   2HD1  LEU  36          3HD1      LEU  36  -0.695 -23.331 -23.331
  257   3HD1  LEU  36          2HD1      LEU  36   0.479 -22.395 -22.395
  258   1HD2  LEU  36          2HD2      LEU  36   0.632 -22.042 -22.042
  259   2HD2  LEU  36          1HD2      LEU  36   1.410 -23.038 -23.038
  260   3HD2  LEU  36          3HD2      LEU  36  -0.274 -23.329 -23.329
  261    HA   PRO  37           HA       PRO  37  -6.114 -19.450 -19.450
  262   1HB   PRO  37          2HB       PRO  37  -4.627 -17.589 -17.589
  263   2HB   PRO  37          1HB       PRO  37  -6.234 -18.298 -18.298
  264   1HG   PRO  37          2HG       PRO  37  -4.166 -19.222 -19.222
  265   2HG   PRO  37          1HG       PRO  37  -5.393 -20.326 -20.326
  266   1HD   PRO  37          2HD       PRO  37  -2.620 -19.796 -19.796
  267   2HD   PRO  37          1HD       PRO  37  -3.548 -21.310 -21.310
  268    H    ALA  38           H        ALA  38  -3.249 -17.332 -17.332
  269    HA   ALA  38           HA       ALA  38  -3.430 -16.285 -16.285
  270   1HB   ALA  38          2HB       ALA  38  -5.417 -15.273 -15.273
  271   2HB   ALA  38          1HB       ALA  38  -4.176 -14.021 -14.021
  272   3HB   ALA  38          3HB       ALA  38  -4.854 -14.576 -14.576
  273    H    GLY  39           H        GLY  39  -1.806 -14.745 -14.745
  274   1HA   GLY  39          2HA       GLY  39   0.454 -14.905 -14.905
  275   2HA   GLY  39          1HA       GLY  39   0.374 -14.025 -14.025
  276    H    THR  40           H        THR  40  -0.462 -13.880 -13.880
  277    HA   THR  40           HA       THR  40  -0.542 -10.944 -10.944
  278    HB   THR  40           HB       THR  40  -1.681 -11.217 -11.217
  279    HG1  THR  40           HG1      THR  40  -2.000 -13.194 -13.194
  280   1HG2  THR  40          1HG2      THR  40  -2.710 -10.811 -10.811
  281   2HG2  THR  40          3HG2      THR  40  -3.563 -12.272 -12.272
  282   3HG2  THR  40          2HG2      THR  40  -3.647 -10.819 -10.819
  283    H    GLU  41           H        GLU  41   1.177 -13.603 -13.603
  284    HA   GLU  41           HA       GLU  41   3.001 -13.780 -13.780
  285   1HB   GLU  41          2HB       GLU  41   3.250 -11.259 -11.259
  286   2HB   GLU  41          1HB       GLU  41   4.004 -11.176 -11.176
  287   1HG   GLU  41          2HG       GLU  41   4.707 -13.630 -13.630
  288   2HG   GLU  41          1HG       GLU  41   5.069 -12.249 -12.249
  289    H    ASP  42           H        ASP  42   0.316 -12.786 -12.786
  290    HA   ASP  42           HA       ASP  42  -0.599 -12.079 -12.079
  291   1HB   ASP  42          2HB       ASP  42   1.200 -14.081 -14.081
  292   2HB   ASP  42          1HB       ASP  42   1.731 -12.827 -12.827
  293    H    TYR  43           H        TYR  43   0.026  -9.872  -9.872
  294    HA   TYR  43           HA       TYR  43   2.110  -8.369  -8.369
  295   1HB   TYR  43          2HB       TYR  43  -0.382  -7.388  -7.388
  296   2HB   TYR  43          1HB       TYR  43   1.040  -6.420  -6.420
  297    HD1  TYR  43           HD2      TYR  43   2.968  -8.836  -8.836
  298    HD2  TYR  43           HD1      TYR  43  -0.239  -6.864  -6.864
  299    HE1  TYR  43           HE2      TYR  43   3.940  -9.445  -9.445
  300    HE2  TYR  43           HE1      TYR  43   0.726  -7.476  -7.476
  301    HH   TYR  43           HH       TYR  43   3.881  -8.677  -8.677
  302    H    ILE  44           H        ILE  44   1.506  -6.208  -6.208
  303    HA   ILE  44           HA       ILE  44  -0.425  -6.837  -6.837
  304    HB   ILE  44           HB       ILE  44   2.035  -5.093  -5.093
  305   1HG1  ILE  44          2HG1      ILE  44   2.765  -7.343  -7.343
  306   2HG1  ILE  44          1HG1      ILE  44   2.709  -6.864  -6.864
  307   1HG2  ILE  44          1HG2      ILE  44  -0.094  -5.763  -5.763
  308   2HG2  ILE  44          3HG2      ILE  44   1.480  -5.096  -5.096
  309   3HG2  ILE  44          2HG2      ILE  44   0.383  -4.168  -4.168
  310   1HD1  ILE  44          1HD1      ILE  44   0.347  -7.908  -7.908
  311   2HD1  ILE  44          3HD1      ILE  44   0.916  -8.719  -8.719
  312   3HD1  ILE  44          2HD1      ILE  44   1.761  -8.960  -8.960
  313    H    HIS  45           H        HIS  45  -2.230  -5.885  -5.885
  314    HA   HIS  45           HA       HIS  45  -2.326  -3.382  -3.382
  315   1HB   HIS  45          2HB       HIS  45  -4.131  -5.473  -5.473
  316   2HB   HIS  45          1HB       HIS  45  -4.830  -3.963  -3.963
  317    HD1  HIS  45           HD1      HIS  45  -3.628  -5.634  -5.634
  318    HD2  HIS  45           HD2      HIS  45  -5.870  -2.346  -2.346
  319    HE1  HIS  45           HE1      HIS  45  -4.676  -4.736  -4.736
  320    HE2  HIS  45           HE2      HIS  45  -6.106  -2.807  -2.807
  321    H    ILE  46           H        ILE  46  -2.285  -1.395  -1.395
  322    HA   ILE  46           HA       ILE  46  -2.286  -0.947  -0.947
  323    HB   ILE  46           HB       ILE  46  -1.882   0.990   0.990
  324   1HG1  ILE  46          2HG1      ILE  46  -0.144  -0.793  -0.793
  325   2HG1  ILE  46          1HG1      ILE  46   0.458   0.853   0.853
  326   1HG2  ILE  46          1HG2      ILE  46  -2.246   1.413   1.413
  327   2HG2  ILE  46          3HG2      ILE  46  -0.776   2.145   2.145
  328   3HG2  ILE  46          2HG2      ILE  46  -2.344   2.558   2.558
  329   1HD1  ILE  46          2HD1      ILE  46   0.005   0.443   0.443
  330   2HD1  ILE  46          1HD1      ILE  46   0.076  -1.255  -1.255
  331   3HD1  ILE  46          3HD1      ILE  46   1.459  -0.201  -0.201
  332    H    ARG  47           H        ARG  47  -3.674   1.529   1.529
  333    HA   ARG  47           HA       ARG  47  -5.833   2.213   2.213
  334   1HB   ARG  47          2HB       ARG  47  -6.339  -0.352  -0.352
  335   2HB   ARG  47          1HB       ARG  47  -7.098   0.502   0.502
  336   1HG   ARG  47          2HG       ARG  47  -8.872   0.511   0.511
  337   2HG   ARG  47          1HG       ARG  47  -8.067   1.925   1.925
  338   1HD   ARG  47          2HD       ARG  47  -7.428   0.819   0.819
  339   2HD   ARG  47          1HD       ARG  47  -7.272  -0.728  -0.728
  340    HE   ARG  47           HE       ARG  47  -9.981  -0.043  -0.043
  341   1HH1  ARG  47          2HH1      ARG  47  -7.418  -0.940  -0.940
  342   2HH1  ARG  47          1HH1      ARG  47  -8.488  -1.660  -1.660
  343   1HH2  ARG  47          1HH2      ARG  47 -11.391  -0.991  -0.991
  344   2HH2  ARG  47          2HH2      ARG  47 -10.743  -1.689  -1.689
  345    H    ILE  48           H        ILE  48  -6.466   4.066   4.066
  346    HA   ILE  48           HA       ILE  48  -6.126   4.618   4.618
  347    HB   ILE  48           HB       ILE  48  -5.797   6.299   6.299
  348   1HG1  ILE  48          2HG1      ILE  48  -4.376   6.202   6.202
  349   2HG1  ILE  48          1HG1      ILE  48  -3.843   5.410   5.410
  350   1HG2  ILE  48          2HG2      ILE  48  -6.680   7.405   7.405
  351   2HG2  ILE  48          1HG2      ILE  48  -5.982   8.369   8.369
  352   3HG2  ILE  48          3HG2      ILE  48  -7.521   7.543   7.543
  353   1HD1  ILE  48          2HD1      ILE  48  -4.159   8.384   8.384
  354   2HD1  ILE  48          1HD1      ILE  48  -2.637   7.503   7.503
  355   3HD1  ILE  48          3HD1      ILE  48  -3.488   7.538   7.538
  356    H    GLN  49           H        GLN  49  -7.745   6.000   6.000
  357    HA   GLN  49           HA       GLN  49 -10.319   6.163   6.163
  358   1HB   GLN  49          2HB       GLN  49 -11.518   5.201   5.201
  359   2HB   GLN  49          1HB       GLN  49 -10.399   4.041   4.041
  360   1HG   GLN  49          2HG       GLN  49  -8.816   5.075   5.075
  361   2HG   GLN  49          1HG       GLN  49 -10.384   5.330   5.330
  362   1HE2  GLN  49          2HE2      GLN  49 -11.042   1.921   1.921
  363   2HE2  GLN  49          1HE2      GLN  49 -11.737   3.493   3.493
  364    H    GLN  50           H        GLN  50 -10.161   8.393   8.393
  365    HA   GLN  50           HA       GLN  50  -9.835   9.807   9.807
  366   1HB   GLN  50          2HB       GLN  50  -8.948  10.366  10.366
  367   2HB   GLN  50          1HB       GLN  50 -10.311  11.458  11.458
  368   1HG   GLN  50          2HG       GLN  50  -9.326  12.516  12.516
  369   2HG   GLN  50          1HG       GLN  50  -8.115  11.250  11.250
  370   1HE2  GLN  50          2HE2      GLN  50  -6.115  13.759  13.759
  371   2HE2  GLN  50          1HE2      GLN  50  -6.684  13.139  13.139
  372    H    ARG  51           H        ARG  51 -11.727   9.640   9.640
  373    HA   ARG  51           HA       ARG  51 -14.301   9.668   9.668
  374   1HB   ARG  51          2HB       ARG  51 -13.115   9.692   9.692
  375   2HB   ARG  51          1HB       ARG  51 -14.365  10.926  10.926
  376   1HG   ARG  51          2HG       ARG  51 -16.006   9.420   9.420
  377   2HG   ARG  51          1HG       ARG  51 -15.216   8.417   8.417
  378   1HD   ARG  51          2HD       ARG  51 -14.417   7.015   7.015
  379   2HD   ARG  51          1HD       ARG  51 -13.832   8.339   8.339
  380    HE   ARG  51           HE       ARG  51 -16.515   8.348   8.348
  381   1HH1  ARG  51          2HH1      ARG  51 -14.042   5.895   5.895
  382   2HH1  ARG  51          1HH1      ARG  51 -14.851   5.022   5.022
  383   1HH2  ARG  51          1HH2      ARG  51 -17.578   7.201   7.201
  384   2HH2  ARG  51          2HH2      ARG  51 -16.859   5.763   5.763
  385    H    ASN  52           H        ASN  52 -12.613  12.361  12.361
  386    HA   ASN  52           HA       ASN  52 -14.396  14.236  14.236
  387   1HB   ASN  52          2HB       ASN  52 -13.776  14.144  14.144
  388   2HB   ASN  52          1HB       ASN  52 -12.499  15.218  15.218
  389   1HD2  ASN  52          2HD2      ASN  52 -14.602  17.931  17.931
  390   2HD2  ASN  52          1HD2      ASN  52 -13.054  17.214  17.214
  391    H    GLY  53           H        GLY  53 -12.445  16.446  16.446
  392   1HA   GLY  53          2HA       GLY  53 -10.883  15.978  15.978
  393   2HA   GLY  53          1HA       GLY  53 -11.124  17.523  17.523
  394    H    ARG  54           H        ARG  54 -10.045  14.548  14.548
  395    HA   ARG  54           HA       ARG  54  -7.312  14.870  14.870
  396   1HB   ARG  54          2HB       ARG  54  -6.861  15.877  15.877
  397   2HB   ARG  54          1HB       ARG  54  -7.433  16.998  16.998
  398   1HG   ARG  54          2HG       ARG  54  -9.779  16.283  16.283
  399   2HG   ARG  54          1HG       ARG  54  -8.715  16.100  16.100
  400   1HD   ARG  54          2HD       ARG  54  -7.918  18.499  18.499
  401   2HD   ARG  54          1HD       ARG  54  -9.668  18.511  18.511
  402    HE   ARG  54           HE       ARG  54  -9.910  18.740  18.740
  403   1HH1  ARG  54          2HH1      ARG  54  -6.638  17.745  17.745
  404   2HH1  ARG  54          1HH1      ARG  54  -6.091  17.975  17.975
  405   1HH2  ARG  54          1HH2      ARG  54  -9.191  19.043  19.043
  406   2HH2  ARG  54          2HH2      ARG  54  -7.538  18.711  18.711
  407    H    LYS  55           H        LYS  55 -10.099  13.838  13.838
  408    HA   LYS  55           HA       LYS  55  -8.790  12.141  12.141
  409   1HB   LYS  55          2HB       LYS  55 -11.269  12.976  12.976
  410   2HB   LYS  55          1HB       LYS  55 -11.523  11.531  11.531
  411   1HG   LYS  55          2HG       LYS  55 -12.065  11.142  11.142
  412   2HG   LYS  55          1HG       LYS  55 -10.706  10.144  10.144
  413   1HD   LYS  55          2HD       LYS  55 -10.396  11.165  11.165
  414   2HD   LYS  55          1HD       LYS  55  -9.143  11.615  11.615
  415   1HE   LYS  55          2HE       LYS  55  -9.941  13.517  13.517
  416   2HE   LYS  55          1HE       LYS  55 -10.175  13.760  13.760
  417   1HZ   LYS  55          1HZ       LYS  55 -12.368  12.605  12.605
  418   2HZ   LYS  55          3HZ       LYS  55 -12.078  14.268  14.268
  419   3HZ   LYS  55          2HZ       LYS  55 -12.430  13.575  13.575
  420    H    THR  56           H        THR  56  -7.216  11.413  11.413
  421    HA   THR  56           HA       THR  56  -8.165   9.312   9.312
  422    HB   THR  56           HB       THR  56  -5.272   9.650   9.650
  423    HG1  THR  56           HG1      THR  56  -5.129  11.716  11.716
  424   1HG2  THR  56          3HG2      THR  56  -7.191   9.153   9.153
  425   2HG2  THR  56          2HG2      THR  56  -6.072  10.437  10.437
  426   3HG2  THR  56          1HG2      THR  56  -5.452   8.858   8.858
  427    H    LEU  57           H        LEU  57  -7.455   7.155   7.155
  428    HA   LEU  57           HA       LEU  57  -6.056   6.259   6.259
  429   1HB   LEU  57          2HB       LEU  57  -8.904   5.892   5.892
  430   2HB   LEU  57          1HB       LEU  57  -8.067   4.376   4.376
  431    HG   LEU  57           HG       LEU  57  -7.817   6.706   6.706
  432   1HD1  LEU  57          1HD1      LEU  57 -10.169   5.278   5.278
  433   2HD1  LEU  57          3HD1      LEU  57  -9.500   4.592   4.592
  434   3HD1  LEU  57          2HD1      LEU  57  -9.817   6.323   6.323
  435   1HD2  LEU  57          1HD2      LEU  57  -6.858   3.928   3.928
  436   2HD2  LEU  57          3HD2      LEU  57  -6.185   5.333   5.333
  437   3HD2  LEU  57          2HD2      LEU  57  -7.518   4.437   4.437
  438    H    THR  58           H        THR  58  -4.406   5.838   5.838
  439    HA   THR  58           HA       THR  58  -4.749   4.148   4.148
  440    HB   THR  58           HB       THR  58  -2.243   4.587   4.587
  441    HG1  THR  58           HG1      THR  58  -3.405   6.480   6.480
  442   1HG2  THR  58          3HG2      THR  58  -2.110   2.723   2.723
  443   2HG2  THR  58          2HG2      THR  58  -2.472   3.883   3.883
  444   3HG2  THR  58          1HG2      THR  58  -0.999   4.054   4.054
  445    H    THR  59           H        THR  59  -5.158   2.029   2.029
  446    HA   THR  59           HA       THR  59  -4.525   0.400   0.400
  447    HB   THR  59           HB       THR  59  -6.190  -1.160  -1.160
  448    HG1  THR  59           HG1      THR  59  -6.585   0.654   0.654
  449   1HG2  THR  59          2HG2      THR  59  -6.623   0.606   0.606
  450   2HG2  THR  59          1HG2      THR  59  -8.036  -0.075  -0.075
  451   3HG2  THR  59          3HG2      THR  59  -6.793  -1.143  -1.143
  452    H    VAL  60           H        VAL  60  -3.947  -1.876  -1.876
  453    HA   VAL  60           HA       VAL  60  -2.446  -2.212  -2.212
  454    HB   VAL  60           HB       VAL  60  -1.490  -3.135  -3.135
  455   1HG1  VAL  60          1HG1      VAL  60  -0.844  -4.419  -4.419
  456   2HG1  VAL  60          3HG1      VAL  60   0.113  -2.997  -2.997
  457   3HG1  VAL  60          2HG1      VAL  60   0.457  -3.897  -3.897
  458   1HG2  VAL  60          2HG2      VAL  60  -0.889  -0.689  -0.689
  459   2HG2  VAL  60          1HG2      VAL  60  -1.199  -0.843  -0.843
  460   3HG2  VAL  60          3HG2      VAL  60   0.340  -1.382  -1.382
  461    H    GLN  61           H        GLN  61  -3.238  -3.866  -3.866
  462    HA   GLN  61           HA       GLN  61  -4.311  -6.167  -6.167
  463   1HB   GLN  61          2HB       GLN  61  -5.174  -6.134  -6.134
  464   2HB   GLN  61          1HB       GLN  61  -6.141  -6.149  -6.149
  465   1HG   GLN  61          2HG       GLN  61  -5.660  -3.623  -3.623
  466   2HG   GLN  61          1HG       GLN  61  -5.184  -3.813  -3.813
  467   1HE2  GLN  61          2HE2      GLN  61  -8.655  -5.115  -5.115
  468   2HE2  GLN  61          1HE2      GLN  61  -7.105  -5.877  -5.877
  469    H    GLY  62           H        GLY  62  -3.700  -8.220  -8.220
  470   1HA   GLY  62          2HA       GLY  62  -2.699  -9.719  -9.719
  471   2HA   GLY  62          1HA       GLY  62  -1.619  -8.400  -8.400
  472    H    ILE  63           H        ILE  63  -1.222  -7.630  -7.630
  473    HA   ILE  63           HA       ILE  63   1.113  -9.041  -9.041
  474    HB   ILE  63           HB       ILE  63  -0.633  -7.381  -7.381
  475   1HG1  ILE  63          2HG1      ILE  63   0.226  -5.954  -5.954
  476   2HG1  ILE  63          1HG1      ILE  63   1.394  -5.798  -5.798
  477   1HG2  ILE  63          2HG2      ILE  63   1.738  -8.968  -8.968
  478   2HG2  ILE  63          1HG2      ILE  63   1.864  -7.279  -7.279
  479   3HG2  ILE  63          3HG2      ILE  63   0.530  -8.274  -8.274
  480   1HD1  ILE  63          1HD1      ILE  63   2.822  -7.454  -7.454
  481   2HD1  ILE  63          3HD1      ILE  63   1.682  -7.402  -7.402
  482   3HD1  ILE  63          2HD1      ILE  63   2.571  -5.949  -5.949
  483    H    ALA  64           H        ALA  64   1.652 -10.643 -10.643
  484    HA   ALA  64           HA       ALA  64  -0.398 -12.601 -12.601
  485   1HB   ALA  64          1HB       ALA  64   2.465 -12.562 -12.562
  486   2HB   ALA  64          3HB       ALA  64   1.952 -13.410 -13.410
  487   3HB   ALA  64          2HB       ALA  64   1.357 -13.928 -13.928
  488    H    ASP  65           H        ASP  65  -1.399 -13.099 -13.099
  489    HA   ASP  65           HA       ASP  65  -1.431 -11.272 -11.272
  490   1HB   ASP  65          2HB       ASP  65  -3.322 -12.773 -12.773
  491   2HB   ASP  65          1HB       ASP  65  -2.400 -14.138 -14.138
  492    H    ASP  66           H        ASP  66   0.675 -13.864 -13.864
  493    HA   ASP  66           HA       ASP  66   1.425 -14.601 -14.601
  494   1HB   ASP  66          2HB       ASP  66   1.905 -15.690 -15.690
  495   2HB   ASP  66          1HB       ASP  66   3.414 -14.803 -14.803
  496    H    TYR  67           H        TYR  67   2.260 -11.958 -11.958
  497    HA   TYR  67           HA       TYR  67   4.743 -11.176 -11.176
  498   1HB   TYR  67          2HB       TYR  67   2.325  -9.527  -9.527
  499   2HB   TYR  67          1HB       TYR  67   3.892  -8.805  -8.805
  500    HD1  TYR  67           HD2      TYR  67   4.057 -12.020 -12.020
  501    HD2  TYR  67           HD1      TYR  67   3.620  -7.844  -7.844
  502    HE1  TYR  67           HE2      TYR  67   4.703 -12.337 -12.337
  503    HE2  TYR  67           HE1      TYR  67   4.259  -8.146  -8.146
  504    HH   TYR  67           HH       TYR  67   5.771 -10.792 -10.792
  505    H    ASP  68           H        ASP  68   5.403  -9.530  -9.530
  506    HA   ASP  68           HA       ASP  68   4.271 -10.002 -10.002
  507   1HB   ASP  68          2HB       ASP  68   6.496  -8.220  -8.220
  508   2HB   ASP  68          1HB       ASP  68   5.996  -8.250  -8.250
  509    H    LYS  69           H        LYS  69   2.123  -9.225  -9.225
  510    HA   LYS  69           HA       LYS  69   1.126  -6.913  -6.913
  511   1HB   LYS  69          2HB       LYS  69   0.159  -8.879  -8.879
  512   2HB   LYS  69          1HB       LYS  69   0.145  -7.510  -7.510
  513   1HG   LYS  69          2HG       LYS  69  -1.195  -6.235  -6.235
  514   2HG   LYS  69          1HG       LYS  69  -1.193  -7.622  -7.622
  515   1HD   LYS  69          2HD       LYS  69  -2.307  -7.630  -7.630
  516   2HD   LYS  69          1HD       LYS  69  -3.267  -7.447  -7.447
  517   1HE   LYS  69          2HE       LYS  69  -2.022  -9.676  -9.676
  518   2HE   LYS  69          1HE       LYS  69  -1.873  -9.844  -9.844
  519   1HZ   LYS  69          2HZ       LYS  69  -4.446  -9.205  -9.205
  520   2HZ   LYS  69          1HZ       LYS  69  -4.228 -10.027 -10.027
  521   3HZ   LYS  69          3HZ       LYS  69  -3.880 -10.799 -10.799
  522    H    LYS  70           H        LYS  70   2.813  -7.250  -7.250
  523    HA   LYS  70           HA       LYS  70   2.403  -4.588  -4.588
  524   1HB   LYS  70          2HB       LYS  70   3.967  -6.903  -6.903
  525   2HB   LYS  70          1HB       LYS  70   4.774  -5.376  -5.376
  526   1HG   LYS  70          2HG       LYS  70   3.583  -5.327  -5.327
  527   2HG   LYS  70          1HG       LYS  70   2.217  -4.885  -4.885
  528   1HD   LYS  70          2HD       LYS  70   1.562  -7.211  -7.211
  529   2HD   LYS  70          1HD       LYS  70   2.978  -7.710  -7.710
  530   1HE   LYS  70          2HE       LYS  70   2.145  -6.805  -6.805
  531   2HE   LYS  70          1HE       LYS  70   0.982  -5.786  -5.786
  532   1HZ   LYS  70          1HZ       LYS  70   0.470  -8.493  -8.493
  533   2HZ   LYS  70          3HZ       LYS  70   0.561  -8.310  -8.310
  534   3HZ   LYS  70          2HZ       LYS  70  -0.528  -7.376  -7.376
  535    H    LYS  71           H        LYS  71   5.473  -6.056  -6.056
  536    HA   LYS  71           HA       LYS  71   6.806  -3.640  -3.640
  537   1HB   LYS  71          2HB       LYS  71   7.345  -6.418  -6.418
  538   2HB   LYS  71          1HB       LYS  71   7.819  -5.593  -5.593
  539   1HG   LYS  71          2HG       LYS  71   9.162  -4.021  -4.021
  540   2HG   LYS  71          1HG       LYS  71   8.763  -4.982  -4.982
  541   1HD   LYS  71          2HD       LYS  71  10.196  -6.634  -6.634
  542   2HD   LYS  71          1HD       LYS  71   9.833  -6.505  -6.505
  543   1HE   LYS  71          2HE       LYS  71  12.095  -5.859  -5.859
  544   2HE   LYS  71          1HE       LYS  71  11.180  -4.375  -4.375
  545   1HZ   LYS  71          3HZ       LYS  71  11.987  -5.392  -5.392
  546   2HZ   LYS  71          2HZ       LYS  71  12.841  -4.218  -4.218
  547   3HZ   LYS  71          1HZ       LYS  71  11.265  -3.900  -3.900
  548    H    LEU  72           H        LEU  72   4.420  -5.220  -5.220
  549    HA   LEU  72           HA       LEU  72   5.101  -4.248  -4.248
  550   1HB   LEU  72          2HB       LEU  72   3.404  -6.071  -6.071
  551   2HB   LEU  72          1HB       LEU  72   2.276  -4.740  -4.740
  552    HG   LEU  72           HG       LEU  72   3.701  -5.529  -5.529
  553   1HD1  LEU  72          1HD1      LEU  72   1.623  -6.817  -6.817
  554   2HD1  LEU  72          3HD1      LEU  72   0.759  -5.543  -5.543
  555   3HD1  LEU  72          2HD1      LEU  72   1.839  -6.627  -6.627
  556   1HD2  LEU  72          1HD2      LEU  72   1.806  -3.281  -3.281
  557   2HD2  LEU  72          3HD2      LEU  72   3.427  -3.176  -3.176
  558   3HD2  LEU  72          2HD2      LEU  72   2.107  -3.853  -3.853
  559    H    VAL  73           H        VAL  73   2.347  -3.154  -3.154
  560    HA   VAL  73           HA       VAL  73   2.322  -0.627  -0.627
  561    HB   VAL  73           HB       VAL  73   0.238  -1.841  -1.841
  562   1HG1  VAL  73          2HG1      VAL  73   1.064  -2.479  -2.479
  563   2HG1  VAL  73          1HG1      VAL  73   0.855  -0.798  -0.798
  564   3HG1  VAL  73          3HG1      VAL  73  -0.543  -1.751  -1.751
  565   1HG2  VAL  73          2HG2      VAL  73   0.690   0.803   0.803
  566   2HG2  VAL  73          1HG2      VAL  73  -0.905   0.097   0.097
  567   3HG2  VAL  73          3HG2      VAL  73  -0.004   0.769   0.769
  568    H    LYS  74           H        LYS  74   2.945  -1.714  -1.714
  569    HA   LYS  74           HA       LYS  74   3.253   0.683   0.683
  570   1HB   LYS  74          2HB       LYS  74   3.537  -1.737  -1.737
  571   2HB   LYS  74          1HB       LYS  74   5.231  -1.529  -1.529
  572   1HG   LYS  74          2HG       LYS  74   4.889   0.703   0.703
  573   2HG   LYS  74          1HG       LYS  74   3.652  -0.299  -0.299
  574   1HD   LYS  74          2HD       LYS  74   5.660  -2.060  -2.060
  575   2HD   LYS  74          1HD       LYS  74   6.603  -0.569  -0.569
  576   1HE   LYS  74          2HE       LYS  74   4.317  -0.772  -0.772
  577   2HE   LYS  74          1HE       LYS  74   5.710  -1.802  -1.802
  578   1HZ   LYS  74          2HZ       LYS  74   6.295   0.977   0.977
  579   2HZ   LYS  74          1HZ       LYS  74   5.509   0.698   0.698
  580   3HZ   LYS  74          3HZ       LYS  74   6.993  -0.049  -0.049
  581    H    ALA  75           H        ALA  75   5.625  -0.974  -0.974
  582    HA   ALA  75           HA       ALA  75   7.759   0.814   0.814
  583   1HB   ALA  75          2HB       ALA  75   7.154  -1.029  -1.029
  584   2HB   ALA  75          1HB       ALA  75   8.655  -0.117  -0.117
  585   3HB   ALA  75          3HB       ALA  75   8.229  -1.328  -1.328
  586    H    PHE  76           H        PHE  76   4.974   0.914   0.914
  587    HA   PHE  76           HA       PHE  76   5.822   2.859   2.859
  588   1HB   PHE  76          2HB       PHE  76   3.646   1.388   1.388
  589   2HB   PHE  76          1HB       PHE  76   2.983   2.775   2.775
  590    HD1  PHE  76           HD1      PHE  76   4.442   1.640   1.640
  591    HD2  PHE  76           HD2      PHE  76   2.424   4.775   4.775
  592    HE1  PHE  76           HE1      PHE  76   4.006   2.750   2.750
  593    HE2  PHE  76           HE2      PHE  76   1.982   5.895   5.895
  594    HZ   PHE  76           HZ       PHE  76   2.774   4.880   4.880
  595    H    LYS  77           H        LYS  77   4.221   3.155   3.155
  596    HA   LYS  77           HA       LYS  77   4.050   5.997   5.997
  597   1HB   LYS  77          2HB       LYS  77   3.986   4.177   4.177
  598   2HB   LYS  77          1HB       LYS  77   3.387   5.828   5.828
  599   1HG   LYS  77          2HG       LYS  77   1.410   5.132   5.132
  600   2HG   LYS  77          1HG       LYS  77   2.151   4.247   4.247
  601   1HD   LYS  77          2HD       LYS  77   1.929   2.277   2.277
  602   2HD   LYS  77          1HD       LYS  77   2.500   2.932   2.932
  603   1HE   LYS  77          2HE       LYS  77   0.399   3.440   3.440
  604   2HE   LYS  77          1HE       LYS  77  -0.206   3.737   3.737
  605   1HZ   LYS  77          3HZ       LYS  77   0.231   1.146   1.146
  606   2HZ   LYS  77          2HZ       LYS  77  -0.052   1.241   1.241
  607   3HZ   LYS  77          1HZ       LYS  77  -1.229   1.777   1.777
  608    H    LYS  78           H        LYS  78   6.668   3.935   3.935
  609    HA   LYS  78           HA       LYS  78   8.142   5.815   5.815
  610   1HB   LYS  78          2HB       LYS  78   8.069   3.179   3.179
  611   2HB   LYS  78          1HB       LYS  78   9.334   3.263   3.263
  612   1HG   LYS  78          2HG       LYS  78  10.692   3.399   3.399
  613   2HG   LYS  78          1HG       LYS  78  10.228   5.101   5.101
  614   1HD   LYS  78          2HD       LYS  78   8.194   3.990   3.990
  615   2HD   LYS  78          1HD       LYS  78   9.556   2.970   2.970
  616   1HE   LYS  78          2HE       LYS  78   9.503   5.984   5.984
  617   2HE   LYS  78          1HE       LYS  78   9.262   4.903   4.903
  618   1HZ   LYS  78          3HZ       LYS  78  11.685   4.481   4.481
  619   2HZ   LYS  78          2HZ       LYS  78  11.621   5.918   5.918
  620   3HZ   LYS  78          1HZ       LYS  78  11.446   4.431   4.431
  621    H    LYS  79           H        LYS  79   7.800   4.811   4.811
  622    HA   LYS  79           HA       LYS  79  10.387   5.933   5.933
  623   1HB   LYS  79          2HB       LYS  79   9.769   3.790   3.790
  624   2HB   LYS  79          1HB       LYS  79   8.299   4.498   4.498
  625   1HG   LYS  79          2HG       LYS  79   9.448   5.720   5.720
  626   2HG   LYS  79          1HG       LYS  79  10.977   5.614   5.614
  627   1HD   LYS  79          2HD       LYS  79  11.088   3.217   3.217
  628   2HD   LYS  79          1HD       LYS  79   9.561   3.328   3.328
  629   1HE   LYS  79          2HE       LYS  79  11.326   3.370   3.370
  630   2HE   LYS  79          1HE       LYS  79  10.646   4.994   4.994
  631   1HZ   LYS  79          2HZ       LYS  79  12.589   5.171   5.171
  632   2HZ   LYS  79          1HZ       LYS  79  13.283   4.045   4.045
  633   3HZ   LYS  79          3HZ       LYS  79  12.801   5.560   5.560
  634    H    PHE  80           H        PHE  80   6.941   6.348   6.348
  635    HA   PHE  80           HA       PHE  80   7.606   8.981   8.981
  636   1HB   PHE  80          2HB       PHE  80   4.937   7.678   7.678
  637   2HB   PHE  80          1HB       PHE  80   5.782   8.811   8.811
  638    HD1  PHE  80           HD1      PHE  80   5.654   5.309   5.309
  639    HD2  PHE  80           HD2      PHE  80   7.250   8.053   8.053
  640    HE1  PHE  80           HE1      PHE  80   6.466   3.426   3.426
  641    HE2  PHE  80           HE2      PHE  80   8.066   6.176   6.176
  642    HZ   PHE  80           HZ       PHE  80   7.674   3.859   3.859
  643    H    ALA  81           H        ALA  81   6.101   7.469   7.469
  644    HA   ALA  81           HA       ALA  81   5.088   8.324   8.324
  645   1HB   ALA  81          3HB       ALA  81   6.711  10.334  10.334
  646   2HB   ALA  81          2HB       ALA  81   5.146  11.135  11.135
  647   3HB   ALA  81          1HB       ALA  81   5.633  10.416  10.416
  648    H    CYS  82           H        CYS  82   3.543   7.441   7.441
  649    HA   CYS  82           HA       CYS  82   1.269   9.311   9.311
  650   1HB   CYS  82          2HB       CYS  82   2.303   7.346   7.346
  651   2HB   CYS  82          1HB       CYS  82   0.556   7.543   7.543
  652    HG   CYS  82           HG       CYS  82   0.727   9.794   9.794
  653    H    ASN  83           H        ASN  83  -0.910   8.205   8.205
  654    HA   ASN  83           HA       ASN  83  -1.021   6.303   6.303
  655   1HB   ASN  83          2HB       ASN  83  -2.979   8.079   8.079
  656   2HB   ASN  83          1HB       ASN  83  -3.599   6.656   6.656
  657   1HD2  ASN  83          2HD2      ASN  83  -2.251   7.847   7.847
  658   2HD2  ASN  83          1HD2      ASN  83  -2.100   6.446   6.446
  659    H    GLY  84           H        GLY  84  -0.753   4.225   4.225
  660   1HA   GLY  84          2HA       GLY  84  -2.086   3.199   3.199
  661   2HA   GLY  84          1HA       GLY  84  -0.567   2.565   2.565
  662    H    THR  85           H        THR  85  -3.361   1.436   1.436
  663    HA   THR  85           HA       THR  85  -3.487  -0.011  -0.011
  664    HB   THR  85           HB       THR  85  -5.423   0.978   0.978
  665    HG1  THR  85           HG1      THR  85  -6.877  -0.381  -0.381
  666   1HG2  THR  85          3HG2      THR  85  -4.908   2.809   2.809
  667   2HG2  THR  85          2HG2      THR  85  -5.879   1.942   1.942
  668   3HG2  THR  85          1HG2      THR  85  -6.624   2.531   2.531
  669    H    VAL  86           H        VAL  86  -4.864  -2.029  -2.029
  670    HA   VAL  86           HA       VAL  86  -4.467  -3.206  -3.206
  671    HB   VAL  86           HB       VAL  86  -2.964  -4.164  -4.164
  672   1HG1  VAL  86          3HG1      VAL  86  -4.679  -3.791  -3.791
  673   2HG1  VAL  86          2HG1      VAL  86  -5.358  -5.339  -5.339
  674   3HG1  VAL  86          1HG1      VAL  86  -3.689  -5.250  -5.250
  675   1HG2  VAL  86          3HG2      VAL  86  -4.382  -5.489  -5.489
  676   2HG2  VAL  86          2HG2      VAL  86  -3.121  -6.227  -6.227
  677   3HG2  VAL  86          1HG2      VAL  86  -4.815  -6.409  -6.409
  678    H    ILE  87           H        ILE  87  -6.362  -3.482  -3.482
  679    HA   ILE  87           HA       ILE  87  -8.682  -4.325  -4.325
  680    HB   ILE  87           HB       ILE  87 -10.124  -3.265  -3.265
  681   1HG1  ILE  87          2HG1      ILE  87  -7.553  -2.069  -2.069
  682   2HG1  ILE  87          1HG1      ILE  87  -8.458  -3.351  -3.351
  683   1HG2  ILE  87          2HG2      ILE  87  -9.278  -2.123  -2.123
  684   2HG2  ILE  87          1HG2      ILE  87  -8.209  -1.210  -1.210
  685   3HG2  ILE  87          3HG2      ILE  87  -9.959  -1.096  -1.096
  686   1HD1  ILE  87          1HD1      ILE  87 -10.382  -1.830  -1.830
  687   2HD1  ILE  87          3HD1      ILE  87  -9.410  -0.548  -0.548
  688   3HD1  ILE  87          2HD1      ILE  87  -8.949  -1.235  -1.235
  689    H    GLU  88           H        GLU  88 -10.020  -5.929  -5.929
  690    HA   GLU  88           HA       GLU  88  -8.854  -7.525  -7.525
  691   1HB   GLU  88          2HB       GLU  88  -9.409  -8.408  -8.408
  692   2HB   GLU  88          1HB       GLU  88 -11.040  -8.539  -8.539
  693   1HG   GLU  88          2HG       GLU  88  -9.952  -9.841  -9.841
  694   2HG   GLU  88          1HG       GLU  88  -8.561  -9.978  -9.978
  695    H    HIS  89           H        HIS  89  -9.792  -5.967  -5.967
  696    HA   HIS  89           HA       HIS  89 -12.503  -5.456  -5.456
  697   1HB   HIS  89          2HB       HIS  89 -10.319  -4.622  -4.622
  698   2HB   HIS  89          1HB       HIS  89 -10.871  -5.816  -5.816
  699    HD1  HIS  89           HD1      HIS  89 -12.675  -5.102  -5.102
  700    HD2  HIS  89           HD2      HIS  89 -12.316  -2.556  -2.556
  701    HE1  HIS  89           HE1      HIS  89 -14.228  -3.182  -3.182
  702    HE2  HIS  89           HE2      HIS  89 -13.947  -1.620  -1.620
  703    HA   PRO  90           HA       PRO  90 -14.041  -9.411  -9.411
  704   1HB   PRO  90          2HB       PRO  90 -16.543  -8.696  -8.696
  705   2HB   PRO  90          1HB       PRO  90 -15.986  -8.704  -8.704
  706   1HG   PRO  90          2HG       PRO  90 -16.299  -6.401  -6.401
  707   2HG   PRO  90          1HG       PRO  90 -16.715  -6.505  -6.505
  708   1HD   PRO  90          2HD       PRO  90 -14.417  -5.343  -5.343
  709   2HD   PRO  90          1HD       PRO  90 -14.582  -6.022  -6.022
  710    H    GLU  91           H        GLU  91 -14.007  -6.586  -6.586
  711    HA   GLU  91           HA       GLU  91 -14.791  -8.000  -8.000
  712   1HB   GLU  91          2HB       GLU  91 -14.372  -5.244  -5.244
  713   2HB   GLU  91          1HB       GLU  91 -13.637  -5.583  -5.583
  714   1HG   GLU  91          2HG       GLU  91 -16.430  -6.473  -6.473
  715   2HG   GLU  91          1HG       GLU  91 -16.111  -4.772  -4.772
  716    H    TYR  92           H        TYR  92 -11.845  -7.218  -7.218
  717    HA   TYR  92           HA       TYR  92 -10.308  -8.274  -8.274
  718   1HB   TYR  92          2HB       TYR  92  -9.023  -6.623  -6.623
  719   2HB   TYR  92          1HB       TYR  92  -8.548  -6.832  -6.832
  720    HD1  TYR  92           HD2      TYR  92 -11.138  -6.218  -6.218
  721    HD2  TYR  92           HD1      TYR  92  -9.169  -4.295  -4.295
  722    HE1  TYR  92           HE2      TYR  92 -12.262  -4.110  -4.110
  723    HE2  TYR  92           HE1      TYR  92 -10.288  -2.181  -2.181
  724    HH   TYR  92           HH       TYR  92 -11.572  -1.466  -1.466
  725    H    GLY  93           H        GLY  93 -10.319  -8.056  -8.056
  726   1HA   GLY  93          2HA       GLY  93 -10.160  -9.981  -9.981
  727   2HA   GLY  93          1HA       GLY  93  -9.363 -10.831 -10.831
  728    H    GLU  94           H        GLU  94  -8.953  -8.994  -8.994
  729    HA   GLU  94           HA       GLU  94  -7.136  -8.348  -8.348
  730   1HB   GLU  94          2HB       GLU  94  -6.628 -10.839 -10.839
  731   2HB   GLU  94          1HB       GLU  94  -5.386 -10.119 -10.119
  732   1HG   GLU  94          2HG       GLU  94  -5.433  -9.126  -9.126
  733   2HG   GLU  94          1HG       GLU  94  -5.054 -10.839 -10.839
  734    H    VAL  95           H        VAL  95  -7.010  -6.223  -6.223
  735    HA   VAL  95           HA       VAL  95  -4.729  -5.656  -5.656
  736    HB   VAL  95           HB       VAL  95  -5.915  -3.940  -3.940
  737   1HG1  VAL  95          2HG1      VAL  95  -5.943  -6.476  -6.476
  738   2HG1  VAL  95          1HG1      VAL  95  -7.669  -6.339  -6.339
  739   3HG1  VAL  95          3HG1      VAL  95  -6.930  -5.337  -5.337
  740   1HG2  VAL  95          1HG2      VAL  95  -8.268  -4.785  -4.785
  741   2HG2  VAL  95          3HG2      VAL  95  -7.572  -3.175  -3.175
  742   3HG2  VAL  95          2HG2      VAL  95  -8.449  -3.909  -3.909
  743    H    ILE  96           H        ILE  96  -3.457  -4.131  -4.131
  744    HA   ILE  96           HA       ILE  96  -4.103  -2.937  -2.937
  745    HB   ILE  96           HB       ILE  96  -1.792  -2.783  -2.783
  746   1HG1  ILE  96          2HG1      ILE  96  -2.288  -4.427  -4.427
  747   2HG1  ILE  96          1HG1      ILE  96  -0.652  -3.866  -3.866
  748   1HG2  ILE  96          2HG2      ILE  96  -2.335  -0.778  -0.778
  749   2HG2  ILE  96          1HG2      ILE  96  -0.711  -1.126  -1.126
  750   3HG2  ILE  96          3HG2      ILE  96  -1.929  -0.480  -0.480
  751   1HD1  ILE  96          1HD1      ILE  96  -0.932  -2.148  -2.148
  752   2HD1  ILE  96          3HD1      ILE  96  -2.536  -2.791  -2.791
  753   3HD1  ILE  96          2HD1      ILE  96  -1.108  -3.788  -3.788
  754    H    GLN  97           H        GLN  97  -4.295  -0.674  -0.674
  755    HA   GLN  97           HA       GLN  97  -5.241   0.938   0.938
  756   1HB   GLN  97          2HB       GLN  97  -6.855  -0.080  -0.080
  757   2HB   GLN  97          1HB       GLN  97  -6.533   1.559   1.559
  758   1HG   GLN  97          2HG       GLN  97  -7.165   2.167   2.167
  759   2HG   GLN  97          1HG       GLN  97  -7.997   0.615   0.615
  760   1HE2  GLN  97          2HE2      GLN  97 -10.458   3.110   3.110
  761   2HE2  GLN  97          1HE2      GLN  97  -9.571   2.658   2.658
  762    H    LEU  98           H        LEU  98  -3.695   2.427   2.427
  763    HA   LEU  98           HA       LEU  98  -2.467   3.667   3.667
  764   1HB   LEU  98          2HB       LEU  98  -1.869   4.021   4.021
  765   2HB   LEU  98          1HB       LEU  98  -0.952   4.721   4.721
  766    HG   LEU  98           HG       LEU  98  -1.261   1.755   1.755
  767   1HD1  LEU  98          3HD1      LEU  98  -0.370   3.093   3.093
  768   2HD1  LEU  98          2HD1      LEU  98   1.124   2.761   2.761
  769   3HD1  LEU  98          1HD1      LEU  98   0.046   1.436   1.436
  770   1HD2  LEU  98          3HD2      LEU  98   0.256   3.691   3.691
  771   2HD2  LEU  98          2HD2      LEU  98   0.105   1.953   1.953
  772   3HD2  LEU  98          1HD2      LEU  98   1.342   2.577   2.577
  773    H    GLN  99           H        GLN  99  -2.328   6.007   6.007
  774    HA   GLN  99           HA       GLN  99  -4.818   7.250   7.250
  775   1HB   GLN  99          2HB       GLN  99  -3.133   7.490   7.490
  776   2HB   GLN  99          1HB       GLN  99  -3.374   9.068   9.068
  777   1HG   GLN  99          2HG       GLN  99  -5.744   7.324   7.324
  778   2HG   GLN  99          1HG       GLN  99  -5.029   8.113   8.113
  779   1HE2  GLN  99          2HE2      GLN  99  -7.642  10.340  10.340
  780   2HE2  GLN  99          1HE2      GLN  99  -7.545   8.754   8.754
  781    H    GLY 100           H        GLY 100  -4.935   8.978   8.978
  782   1HA   GLY 100          2HA       GLY 100  -4.240  10.675  10.675
  783   2HA   GLY 100          1HA       GLY 100  -2.632  10.540  10.540
  784    H    ASP 101           H        ASP 101  -2.887  10.995  10.995
  785    HA   ASP 101           HA       ASP 101  -2.940   8.636   8.636
  786   1HB   ASP 101          2HB       ASP 101  -1.821  10.106  10.106
  787   2HB   ASP 101          1HB       ASP 101  -3.358  10.700  10.700
  788    H    GLN 102           H        GLN 102  -1.576   7.088   7.088
  789    HA   GLN 102           HA       GLN 102   1.282   7.735   7.735
  790   1HB   GLN 102          2HB       GLN 102  -0.491   5.939   5.939
  791   2HB   GLN 102          1HB       GLN 102   1.011   5.178   5.178
  792   1HG   GLN 102          2HG       GLN 102   0.987   6.252   6.252
  793   2HG   GLN 102          1HG       GLN 102   2.315   6.700   6.700
  794   1HE2  GLN 102          2HE2      GLN 102  -0.633   9.508   9.508
  795   2HE2  GLN 102          1HE2      GLN 102  -0.997   7.859   7.859
  796    H    ARG 103           H        ARG 103  -0.704   6.807   6.807
  797    HA   ARG 103           HA       ARG 103   0.016   4.362   4.362
  798   1HB   ARG 103          2HB       ARG 103  -0.316   5.426   5.426
  799   2HB   ARG 103          1HB       ARG 103  -1.654   5.555   5.555
  800   1HG   ARG 103          2HG       ARG 103  -1.321   7.818   7.818
  801   2HG   ARG 103          1HG       ARG 103   0.356   7.755   7.755
  802   1HD   ARG 103          2HD       ARG 103  -0.285   8.345   8.345
  803   2HD   ARG 103          1HD       ARG 103  -1.275   6.892   6.892
  804    HE   ARG 103           HE       ARG 103  -3.105   8.224   8.224
  805   1HH1  ARG 103          2HH1      ARG 103  -0.394   9.881   9.881
  806   2HH1  ARG 103          1HH1      ARG 103  -1.297  11.316  11.316
  807   1HH2  ARG 103          1HH2      ARG 103  -4.295  10.112  10.112
  808   2HH2  ARG 103          2HH2      ARG 103  -3.512  11.448  11.448
  809    H    LYS 104           H        LYS 104   1.950   7.246   7.246
  810    HA   LYS 104           HA       LYS 104   4.004   6.070   6.070
  811   1HB   LYS 104          2HB       LYS 104   3.819   8.809   8.809
  812   2HB   LYS 104          1HB       LYS 104   5.110   8.275   8.275
  813   1HG   LYS 104          2HG       LYS 104   2.202   8.559   8.559
  814   2HG   LYS 104          1HG       LYS 104   3.520   9.626   9.626
  815   1HD   LYS 104          2HD       LYS 104   3.250   6.706   6.706
  816   2HD   LYS 104          1HD       LYS 104   2.914   8.067   8.067
  817   1HE   LYS 104          2HE       LYS 104   5.431   8.661   8.661
  818   2HE   LYS 104          1HE       LYS 104   5.481   6.898   6.898
  819   1HZ   LYS 104          2HZ       LYS 104   4.354   8.252   8.252
  820   2HZ   LYS 104          1HZ       LYS 104   6.035   8.223   8.223
  821   3HZ   LYS 104          3HZ       LYS 104   5.167   6.772   6.772
  822    H    ASN 105           H        ASN 105   3.266   6.577   6.577
  823    HA   ASN 105           HA       ASN 105   6.046   6.194   6.194
  824   1HB   ASN 105          2HB       ASN 105   3.525   7.013   7.013
  825   2HB   ASN 105          1HB       ASN 105   4.823   6.306   6.306
  826   1HD2  ASN 105          2HD2      ASN 105   4.960  10.133  10.133
  827   2HD2  ASN 105          1HD2      ASN 105   3.568   9.119   9.119
  828    H    ILE 106           H        ILE 106   2.939   4.516   4.516
  829    HA   ILE 106           HA       ILE 106   3.754   2.386   2.386
  830    HB   ILE 106           HB       ILE 106   1.385   2.931   2.931
  831   1HG1  ILE 106          2HG1      ILE 106   0.612   0.651   0.651
  832   2HG1  ILE 106          1HG1      ILE 106   2.109   0.076   0.076
  833   1HG2  ILE 106          1HG2      ILE 106   1.743   3.235   3.235
  834   2HG2  ILE 106          3HG2      ILE 106   1.840   1.480   1.480
  835   3HG2  ILE 106          2HG2      ILE 106   0.352   2.238   2.238
  836   1HD1  ILE 106          1HD1      ILE 106   2.499   1.563   1.563
  837   2HD1  ILE 106          3HD1      ILE 106   1.537   0.098   0.098
  838   3HD1  ILE 106          2HD1      ILE 106   3.155   0.009   0.009
  839    H    CYS 107           H        CYS 107   3.580   2.610   2.610
  840    HA   CYS 107           HA       CYS 107   4.594   0.053   0.053
  841   1HB   CYS 107          2HB       CYS 107   4.587   2.658   2.658
  842   2HB   CYS 107          1HB       CYS 107   5.475   1.280   1.280
  843    HG   CYS 107           HG       CYS 107   2.410   1.532   1.532
  844    H    GLN 108           H        GLN 108   6.093   3.092   3.092
  845    HA   GLN 108           HA       GLN 108   8.795   2.294   2.294
  846   1HB   GLN 108          2HB       GLN 108   8.548   4.593   4.593
  847   2HB   GLN 108          1HB       GLN 108   7.383   4.608   4.608
  848   1HG   GLN 108          2HG       GLN 108   9.096   5.523   5.523
  849   2HG   GLN 108          1HG       GLN 108   9.557   3.841   3.841
  850   1HE2  GLN 108          2HE2      GLN 108  12.330   3.948   3.948
  851   2HE2  GLN 108          1HE2      GLN 108  11.125   2.927   2.927
  852    H    PHE 109           H        PHE 109   6.536   2.172   2.172
  853    HA   PHE 109           HA       PHE 109   8.432   1.498   1.498
  854   1HB   PHE 109          2HB       PHE 109   6.282   2.491   2.491
  855   2HB   PHE 109          1HB       PHE 109   5.432   1.122   1.122
  856    HD1  PHE 109           HD2      PHE 109   7.987   1.880   1.880
  857    HD2  PHE 109           HD1      PHE 109   4.740  -0.585  -0.585
  858    HE1  PHE 109           HE2      PHE 109   8.042   0.736   0.736
  859    HE2  PHE 109           HE1      PHE 109   4.790  -1.736  -1.736
  860    HZ   PHE 109           HZ       PHE 109   6.442  -1.073  -1.073
  861    H    LEU 110           H        LEU 110   6.158  -0.349  -0.349
  862    HA   LEU 110           HA       LEU 110   6.597  -2.877  -2.877
  863   1HB   LEU 110          2HB       LEU 110   5.648  -1.838  -1.838
  864   2HB   LEU 110          1HB       LEU 110   6.096  -3.530  -3.530
  865    HG   LEU 110           HG       LEU 110   4.395  -4.019  -4.019
  866   1HD1  LEU 110          1HD1      LEU 110   4.755  -2.052  -2.052
  867   2HD1  LEU 110          3HD1      LEU 110   3.885  -1.062  -1.062
  868   3HD1  LEU 110          2HD1      LEU 110   3.049  -2.361  -2.361
  869   1HD2  LEU 110          3HD2      LEU 110   3.726  -3.493  -3.493
  870   2HD2  LEU 110          2HD2      LEU 110   2.444  -3.538  -3.538
  871   3HD2  LEU 110          1HD2      LEU 110   3.067  -1.988  -1.988
  872    H    VAL 111           H        VAL 111   8.512  -0.991  -0.991
  873    HA   VAL 111           HA       VAL 111  10.271  -3.247  -3.247
  874    HB   VAL 111           HB       VAL 111  10.409  -0.390  -0.390
  875   1HG1  VAL 111          2HG1      VAL 111  12.145  -2.756  -2.756
  876   2HG1  VAL 111          1HG1      VAL 111  11.813  -1.764  -1.764
  877   3HG1  VAL 111          3HG1      VAL 111  12.551  -1.040  -1.040
  878   1HG2  VAL 111          3HG2      VAL 111   8.420  -1.828  -1.828
  879   2HG2  VAL 111          2HG2      VAL 111   9.370  -1.084  -1.084
  880   3HG2  VAL 111          1HG2      VAL 111   9.587  -2.792  -2.792
  881    H    GLU 112           H        GLU 112  10.172  -0.304  -0.304
  882    HA   GLU 112           HA       GLU 112  12.945  -0.148  -0.148
  883   1HB   GLU 112          2HB       GLU 112  10.471   1.014   1.014
  884   2HB   GLU 112          1HB       GLU 112  12.037   1.210   1.210
  885   1HG   GLU 112          2HG       GLU 112  11.979   1.887   1.887
  886   2HG   GLU 112          1HG       GLU 112  10.990   2.914   2.914
  887    H    ILE 113           H        ILE 113  10.213  -1.744  -1.744
  888    HA   ILE 113           HA       ILE 113  11.930  -2.732  -2.732
  889    HB   ILE 113           HB       ILE 113   9.962  -3.453  -3.453
  890   1HG1  ILE 113          2HG1      ILE 113   8.534  -2.973  -2.973
  891   2HG1  ILE 113          1HG1      ILE 113   8.766  -4.515  -4.515
  892   1HG2  ILE 113          3HG2      ILE 113  10.460  -0.907  -0.907
  893   2HG2  ILE 113          2HG2      ILE 113   8.935  -0.947  -0.947
  894   3HG2  ILE 113          1HG2      ILE 113   8.981  -1.425  -1.425
  895   1HD1  ILE 113          3HD1      ILE 113   7.429  -2.722  -2.722
  896   2HD1  ILE 113          2HD1      ILE 113   6.599  -2.743  -2.743
  897   3HD1  ILE 113          1HD1      ILE 113   6.865  -4.248  -4.248
  898    H    GLY 114           H        GLY 114  10.376  -3.789  -3.789
  899   1HA   GLY 114          2HA       GLY 114  11.085  -5.716  -5.716
  900   2HA   GLY 114          1HA       GLY 114  11.640  -6.417  -6.417
  901    H    LEU 115           H        LEU 115   8.526  -4.890  -4.890
  902    HA   LEU 115           HA       LEU 115   7.184  -7.252  -7.252
  903   1HB   LEU 115          2HB       LEU 115   6.660  -4.598  -4.598
  904   2HB   LEU 115          1HB       LEU 115   5.587  -5.041  -5.041
  905    HG   LEU 115           HG       LEU 115   4.403  -6.591  -6.591
  906   1HD1  LEU 115          3HD1      LEU 115   6.655  -6.127  -6.127
  907   2HD1  LEU 115          2HD1      LEU 115   5.080  -6.686  -6.686
  908   3HD1  LEU 115          1HD1      LEU 115   5.995  -7.649  -7.649
  909   1HD2  LEU 115          1HD2      LEU 115   4.288  -3.927  -3.927
  910   2HD2  LEU 115          3HD2      LEU 115   3.232  -5.053  -5.053
  911   3HD2  LEU 115          2HD2      LEU 115   4.664  -4.403  -4.403
  912    H    ALA 116           H        ALA 116   6.458  -5.238  -5.238
  913    HA   ALA 116           HA       ALA 116   5.453  -7.592  -7.592
  914   1HB   ALA 116          3HB       ALA 116   4.246  -5.355  -5.355
  915   2HB   ALA 116          2HB       ALA 116   5.481  -4.778  -4.778
  916   3HB   ALA 116          1HB       ALA 116   4.428  -6.114  -6.114
  917    H    LYS 117           H        LYS 117   5.957  -6.855  -6.855
  918    HA   LYS 117           HA       LYS 117   8.897  -6.929  -6.929
  919   1HB   LYS 117          2HB       LYS 117   6.888  -8.800  -8.800
  920   2HB   LYS 117          1HB       LYS 117   8.153  -8.323  -8.323
  921   1HG   LYS 117          2HG       LYS 117   8.830  -9.294  -9.294
  922   2HG   LYS 117          1HG       LYS 117   8.495 -10.426 -10.426
  923   1HD   LYS 117          2HD       LYS 117  10.685 -10.237 -10.237
  924   2HD   LYS 117          1HD       LYS 117  10.240  -8.696  -8.696
  925   1HE   LYS 117          2HE       LYS 117  11.323  -7.531  -7.531
  926   2HE   LYS 117          1HE       LYS 117  10.606  -8.476  -8.476
  927   1HZ   LYS 117          2HZ       LYS 117  12.888  -9.422  -9.422
  928   2HZ   LYS 117          1HZ       LYS 117  13.071  -8.621  -8.621
  929   3HZ   LYS 117          3HZ       LYS 117  12.286 -10.119 -10.119
  930    H    ASP 118           H        ASP 118   9.835  -5.830  -5.830
  931    HA   ASP 118           HA       ASP 118   8.604  -3.531  -3.531
  932   1HB   ASP 118          2HB       ASP 118  10.756  -4.959  -4.959
  933   2HB   ASP 118          1HB       ASP 118  10.444  -3.227  -3.227
  934    H    ASP 119           H        ASP 119   8.505  -6.750  -6.750
  935    HA   ASP 119           HA       ASP 119   7.339  -5.947  -5.947
  936   1HB   ASP 119          2HB       ASP 119   8.601  -8.241  -8.241
  937   2HB   ASP 119          1HB       ASP 119   6.919  -8.735  -8.735
  938    H    GLN 120           H        GLN 120   6.240  -6.780  -6.780
  939    HA   GLN 120           HA       GLN 120   3.506  -7.243  -7.243
  940   1HB   GLN 120          2HB       GLN 120   4.716  -7.010  -7.010
  941   2HB   GLN 120          1HB       GLN 120   3.062  -7.490  -7.490
  942   1HG   GLN 120          2HG       GLN 120   3.885  -9.464  -9.464
  943   2HG   GLN 120          1HG       GLN 120   5.542  -8.985  -8.985
  944   1HE2  GLN 120          2HE2      GLN 120   3.188 -10.007 -10.007
  945   2HE2  GLN 120          1HE2      GLN 120   2.557  -9.054  -9.054
  946    H    LEU 121           H        LEU 121   5.424  -4.559  -4.559
  947    HA   LEU 121           HA       LEU 121   3.859  -2.814  -2.814
  948   1HB   LEU 121          2HB       LEU 121   5.696  -2.350  -2.350
  949   2HB   LEU 121          1HB       LEU 121   4.888  -1.022  -1.022
  950    HG   LEU 121           HG       LEU 121   6.673  -2.978  -2.978
  951   1HD1  LEU 121          1HD1      LEU 121   7.329  -0.388  -0.388
  952   2HD1  LEU 121          3HD1      LEU 121   8.306  -1.026  -1.026
  953   3HD1  LEU 121          2HD1      LEU 121   8.123  -1.955  -1.955
  954   1HD2  LEU 121          2HD2      LEU 121   4.883  -0.998  -0.998
  955   2HD2  LEU 121          1HD2      LEU 121   6.063  -1.901  -1.901
  956   3HD2  LEU 121          3HD2      LEU 121   6.505  -0.351  -0.351
  957    H    LYS 122           H        LYS 122   1.672  -3.044  -3.044
  958    HA   LYS 122           HA       LYS 122   0.709  -2.186  -2.186
  959   1HB   LYS 122          2HB       LYS 122  -0.226  -4.241  -4.241
  960   2HB   LYS 122          1HB       LYS 122  -1.482  -3.303  -3.303
  961   1HG   LYS 122          2HG       LYS 122   0.713  -4.730  -4.730
  962   2HG   LYS 122          1HG       LYS 122  -0.868  -5.438  -5.438
  963   1HD   LYS 122          2HD       LYS 122  -1.856  -4.265  -4.265
  964   2HD   LYS 122          1HD       LYS 122  -1.019  -2.776  -2.776
  965   1HE   LYS 122          2HE       LYS 122   0.943  -3.459  -3.459
  966   2HE   LYS 122          1HE       LYS 122   0.236  -5.041  -5.041
  967   1HZ   LYS 122          1HZ       LYS 122  -0.902  -2.474  -2.474
  968   2HZ   LYS 122          3HZ       LYS 122   0.102  -3.475  -3.475
  969   3HZ   LYS 122          2HZ       LYS 122  -1.413  -4.031  -4.031
  970    H    VAL 123           H        VAL 123   0.885   0.032   0.032
  971    HA   VAL 123           HA       VAL 123  -0.755   0.998   0.998
  972    HB   VAL 123           HB       VAL 123   1.472   1.980   1.980
  973   1HG1  VAL 123          2HG1      VAL 123   0.924   1.868   1.868
  974   2HG1  VAL 123          1HG1      VAL 123   0.750   3.589   3.589
  975   3HG1  VAL 123          3HG1      VAL 123   2.258   2.759   2.759
  976   1HG2  VAL 123          2HG2      VAL 123  -0.414   3.283   3.283
  977   2HG2  VAL 123          1HG2      VAL 123   0.848   4.276   4.276
  978   3HG2  VAL 123          3HG2      VAL 123  -0.672   4.012   4.012
  979    H    HIS 124           H        HIS 124  -2.802   1.618   1.618
  980    HA   HIS 124           HA       HIS 124  -3.639   2.570   2.570
  981   1HB   HIS 124          2HB       HIS 124  -5.305   0.837   0.837
  982   2HB   HIS 124          1HB       HIS 124  -5.753   1.407   1.407
  983    HD1  HIS 124           HD1      HIS 124  -5.094  -0.031  -0.031
  984    HD2  HIS 124           HD2      HIS 124  -3.139  -1.094  -1.094
  985    HE1  HIS 124           HE1      HIS 124  -3.861  -2.156  -2.156
  986    HE2  HIS 124           HE2      HIS 124  -2.807  -2.852  -2.852
  987    H    GLY 125           H        GLY 125  -3.260   4.700   4.700
  988   1HA   GLY 125          2HA       GLY 125  -4.642   5.662   5.662
  989   2HA   GLY 125          1HA       GLY 125  -4.006   6.653   6.653
  990    H    PHE 126           HN       PHE 126  -6.744   5.938   5.938
  991    HA   PHE 126           HA       PHE 126  -8.766   5.445   5.445
  992   1HB   PHE 126          2HB       PHE 126 -10.247   6.382   6.382
  993   2HB   PHE 126          1HB       PHE 126  -8.860   5.919   5.919
  994    HD1  PHE 126           HD2      PHE 126  -6.998   7.900   7.900
  995    HD2  PHE 126           HD1      PHE 126 -11.189   8.396   8.396
  996    HE1  PHE 126           HE2      PHE 126  -6.830  10.206  10.206
  997    HE2  PHE 126           HE1      PHE 126 -11.030  10.702  10.702
  998    HZ   PHE 126           HZ       PHE 126  -8.850  11.610  11.610

  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  -2.210  18.116  18.116
    2   2H    MET   1          3H        MET   1  -0.954  18.862  18.862
    3   3H    MET   1          2H        MET   1  -2.539  18.779  18.779
    4    HA   MET   1           HA       MET   1  -1.384  17.151  17.151
    5   1HB   MET   1          2HB       MET   1   0.087  15.576  15.576
    6   2HB   MET   1          1HB       MET   1   0.579  17.230  17.230
    7   1HG   MET   1          2HG       MET   1  -0.235  17.152  17.152
    8   2HG   MET   1          1HG       MET   1  -1.188  15.703  15.703
    9   1HE   MET   1          3HE       MET   1   2.317  16.797  16.797
   10   2HE   MET   1          2HE       MET   1   2.640  16.950  16.950
   11   3HE   MET   1          1HE       MET   1   3.394  15.653  15.653
   12    H    ARG   2           H        ARG   2  -3.996  17.429  17.429
   13    HA   ARG   2           HA       ARG   2  -4.754  14.913  14.913
   14   1HB   ARG   2          2HB       ARG   2  -5.885  17.368  17.368
   15   2HB   ARG   2          1HB       ARG   2  -6.833  16.605  16.605
   16   1HG   ARG   2          2HG       ARG   2  -6.503  15.612  15.612
   17   2HG   ARG   2          1HG       ARG   2  -7.938  16.377  16.377
   18   1HD   ARG   2          2HD       ARG   2  -8.111  14.519  14.519
   19   2HD   ARG   2          1HD       ARG   2  -6.731  13.745  13.745
   20    HE   ARG   2           HE       ARG   2  -8.112  13.049  13.049
   21   1HH1  ARG   2          2HH1      ARG   2  -9.730  15.546  15.546
   22   2HH1  ARG   2          1HH1      ARG   2 -11.245  15.330  15.330
   23   1HH2  ARG   2          1HH2      ARG   2 -10.104  12.764  12.764
   24   2HH2  ARG   2          2HH2      ARG   2 -11.458  13.752  13.752
   25    H    GLY   3           H        GLY   3  -4.763  16.321  16.321
   26   1HA   GLY   3          2HA       GLY   3  -5.918  13.816  13.816
   27   2HA   GLY   3          1HA       GLY   3  -5.982  15.369  15.369
   28    H    SER   4           H        SER   4  -3.772  12.819  12.819
   29    HA   SER   4           HA       SER   4  -1.584  13.765  13.765
   30   1HB   SER   4          2HB       SER   4  -1.459  10.931  10.931
   31   2HB   SER   4          1HB       SER   4  -0.402  12.249  12.249
   32    HG   SER   4           HG       SER   4  -2.389  11.023  11.023
   33    H    HIS   5           H        HIS   5  -0.536  12.279  12.279
   34    HA   HIS   5           HA       HIS   5  -0.575  11.304  11.304
   35   1HB   HIS   5          2HB       HIS   5  -1.671   9.478   9.478
   36   2HB   HIS   5          1HB       HIS   5  -3.203  10.040  10.040
   37    HD1  HIS   5           HD1      HIS   5  -0.042   8.279   8.279
   38    HD2  HIS   5           HD2      HIS   5  -3.693   9.333   9.333
   39    HE1  HIS   5           HE1      HIS   5  -0.172   7.017   7.017
   40    HE2  HIS   5           HE2      HIS   5  -2.345   7.747   7.747
   41    H    HIS   6           H        HIS   6  -1.538  11.450  11.450
   42    HA   HIS   6           HA       HIS   6  -3.305  13.747  13.747
   43   1HB   HIS   6          2HB       HIS   6  -1.156  13.303  13.303
   44   2HB   HIS   6          1HB       HIS   6  -2.171  12.212  12.212
   45    HD1  HIS   6           HD1      HIS   6  -2.870  13.347  13.347
   46    HD2  HIS   6           HD2      HIS   6  -2.801  15.959  15.959
   47    HE1  HIS   6           HE1      HIS   6  -3.661  15.556  15.556
   48    HE2  HIS   6           HE2      HIS   6  -3.533  17.141  17.141
   49    H    HIS   7           H        HIS   7  -3.177  10.634  10.634
   50    HA   HIS   7           HA       HIS   7  -5.710   9.719   9.719
   51   1HB   HIS   7          2HB       HIS   7  -5.819  11.916  11.916
   52   2HB   HIS   7          1HB       HIS   7  -6.313  10.466  10.466
   53    HD1  HIS   7           HD1      HIS   7  -8.080   8.968   8.968
   54    HD2  HIS   7           HD2      HIS   7  -7.994  13.119  13.119
   55    HE1  HIS   7           HE1      HIS   7 -10.274   9.646   9.646
   56    HE2  HIS   7           HE2      HIS   7 -10.161  12.157  12.157
   57    H    HIS   8           H        HIS   8  -3.895  10.116  10.116
   58    HA   HIS   8           HA       HIS   8  -3.029   7.399   7.399
   59   1HB   HIS   8          2HB       HIS   8  -4.265   6.644   6.644
   60   2HB   HIS   8          1HB       HIS   8  -5.366   7.038   7.038
   61    HD1  HIS   8           HD1      HIS   8  -4.344   8.129   8.129
   62    HD2  HIS   8           HD2      HIS   8  -7.029   9.256   9.256
   63    HE1  HIS   8           HE1      HIS   8  -5.905   9.768   9.768
   64    HE2  HIS   8           HE2      HIS   8  -7.459  10.510  10.510
   65    H    HIS   9           H        HIS   9  -1.213   7.246   7.246
   66    HA   HIS   9           HA       HIS   9  -0.762   8.637   8.637
   67   1HB   HIS   9          2HB       HIS   9   1.206   9.992   9.992
   68   2HB   HIS   9          1HB       HIS   9  -0.410  10.606  10.606
   69    HD1  HIS   9           HD1      HIS   9   2.661   9.378   9.378
   70    HD2  HIS   9           HD2      HIS   9  -1.247  10.286  10.286
   71    HE1  HIS   9           HE1      HIS   9   2.673   9.523   9.523
   72    HE2  HIS   9           HE2      HIS   9   0.317  10.162  10.162
   73    H    HIS  10           H        HIS  10   1.496   8.323   8.323
   74    HA   HIS  10           HA       HIS  10   2.321   5.631   5.631
   75   1HB   HIS  10          2HB       HIS  10   2.395   7.042   7.042
   76   2HB   HIS  10          1HB       HIS  10   3.984   7.504   7.504
   77    HD1  HIS  10           HD1      HIS  10   3.403   5.710   5.710
   78    HD2  HIS  10           HD2      HIS  10   4.573   4.349   4.349
   79    HE1  HIS  10           HE1      HIS  10   4.480   3.474   3.474
   80    HE2  HIS  10           HE2      HIS  10   5.102   2.631   2.631
   81    H    THR  11           H        THR  11   3.512   8.842   8.842
   82    HA   THR  11           HA       THR  11   5.041   9.568   9.568
   83    HB   THR  11           HB       THR  11   5.681   6.891   6.891
   84    HG1  THR  11           HG1      THR  11   3.674   6.585   6.585
   85   1HG2  THR  11          1HG2      THR  11   4.731   9.449   9.449
   86   2HG2  THR  11          3HG2      THR  11   5.159   7.980   7.980
   87   3HG2  THR  11          2HG2      THR  11   6.387   8.845   8.845
   88    H    ASP  12           H        ASP  12   6.243   6.287   6.287
   89    HA   ASP  12           HA       ASP  12   8.249   7.145   7.145
   90   1HB   ASP  12          2HB       ASP  12   8.925   7.100   7.100
   91   2HB   ASP  12          1HB       ASP  12  10.084   6.321   6.321
   92    HA   PRO  13           HA       PRO  13   8.106   2.783   2.783
   93   1HB   PRO  13          2HB       PRO  13  10.232   2.492   2.492
   94   2HB   PRO  13          1HB       PRO  13   8.760   3.324   3.324
   95   1HG   PRO  13          2HG       PRO  13  11.353   4.478   4.478
   96   2HG   PRO  13          1HG       PRO  13  10.330   4.992   4.992
   97   1HD   PRO  13          2HD       PRO  13  10.329   6.222   6.222
   98   2HD   PRO  13          1HD       PRO  13   8.917   6.184   6.184
   99    H    MET  14           H        MET  14  11.323   4.096   4.096
  100    HA   MET  14           HA       MET  14  12.354   1.600   1.600
  101   1HB   MET  14          2HB       MET  14  13.323   4.440   4.440
  102   2HB   MET  14          1HB       MET  14  14.207   3.045   3.045
  103   1HG   MET  14          2HG       MET  14  13.726   2.364   2.364
  104   2HG   MET  14          1HG       MET  14  13.988   4.104   4.104
  105   1HE   MET  14          2HE       MET  14  15.730   2.037   2.037
  106   2HE   MET  14          1HE       MET  14  17.246   1.553   1.553
  107   3HE   MET  14          3HE       MET  14  15.733   0.781   0.781
  108    H    SER  15           H        SER  15  10.429   4.063   4.063
  109    HA   SER  15           HA       SER  15  11.131   3.346   3.346
  110   1HB   SER  15          2HB       SER  15   9.125   5.280   5.280
  111   2HB   SER  15          1HB       SER  15   9.272   4.980   4.980
  112    HG   SER  15           HG       SER  15  10.536   6.753   6.753
  113    H    ALA  16           H        ALA  16   8.671   2.607   2.607
  114    HA   ALA  16           HA       ALA  16   7.169   1.091   1.091
  115   1HB   ALA  16          2HB       ALA  16   6.157   2.887   2.887
  116   2HB   ALA  16          1HB       ALA  16   6.064   1.469   1.469
  117   3HB   ALA  16          3HB       ALA  16   5.251   1.466   1.466
  118    H    ILE  17           H        ILE  17   9.449  -0.148  -0.148
  119    HA   ILE  17           HA       ILE  17   8.978  -2.015  -2.015
  120    HB   ILE  17           HB       ILE  17  11.301  -1.965  -1.965
  121   1HG1  ILE  17          2HG1      ILE  17  11.082  -0.696  -0.696
  122   2HG1  ILE  17          1HG1      ILE  17  11.083   0.181   0.181
  123   1HG2  ILE  17          2HG2      ILE  17  10.726  -3.399  -3.399
  124   2HG2  ILE  17          1HG2      ILE  17  12.387  -3.080  -3.080
  125   3HG2  ILE  17          3HG2      ILE  17  11.324  -4.042  -4.042
  126   1HD1  ILE  17          1HD1      ILE  17  13.364  -1.626  -1.626
  127   2HD1  ILE  17          3HD1      ILE  17  13.266  -0.165  -0.165
  128   3HD1  ILE  17          2HD1      ILE  17  13.312  -0.044  -0.044
  129    H    GLN  18           H        GLN  18   8.601  -4.189  -4.189
  130    HA   GLN  18           HA       GLN  18   7.619  -5.018  -5.018
  131   1HB   GLN  18          2HB       GLN  18   7.467  -6.548  -6.548
  132   2HB   GLN  18          1HB       GLN  18   6.524  -6.822  -6.822
  133   1HG   GLN  18          2HG       GLN  18   4.945  -5.508  -5.508
  134   2HG   GLN  18          1HG       GLN  18   6.071  -4.152  -4.152
  135   1HE2  GLN  18          2HE2      GLN  18   5.653  -6.201  -6.201
  136   2HE2  GLN  18          1HE2      GLN  18   5.546  -7.031  -7.031
  137    H    ASN  19           H        ASN  19   9.271  -5.657  -5.657
  138    HA   ASN  19           HA       ASN  19  11.166  -7.623  -7.623
  139   1HB   ASN  19          2HB       ASN  19  11.449  -5.426  -5.426
  140   2HB   ASN  19          1HB       ASN  19  12.387  -6.890  -6.890
  141   1HD2  ASN  19          2HD2      ASN  19  13.887  -4.212  -4.212
  142   2HD2  ASN  19          1HD2      ASN  19  12.782  -3.969  -3.969
  143    H    LEU  20           H        LEU  20   9.591  -9.308  -9.308
  144    HA   LEU  20           HA       LEU  20   8.723 -11.067 -11.067
  145   1HB   LEU  20          2HB       LEU  20  11.265 -10.611 -10.611
  146   2HB   LEU  20          1HB       LEU  20  10.249 -10.753 -10.753
  147    HG   LEU  20           HG       LEU  20   9.384 -12.930 -12.930
  148   1HD1  LEU  20          3HD1      LEU  20  11.762 -12.350 -12.350
  149   2HD1  LEU  20          2HD1      LEU  20  11.187 -13.992 -13.992
  150   3HD1  LEU  20          1HD1      LEU  20  10.128 -12.805 -12.805
  151   1HD2  LEU  20          2HD2      LEU  20  11.179 -12.504 -12.504
  152   2HD2  LEU  20          1HD2      LEU  20  10.910 -14.121 -14.121
  153   3HD2  LEU  20          3HD2      LEU  20  12.278 -13.159 -13.159
  154    H    HIS  21           H        HIS  21   7.753 -11.696 -11.696
  155    HA   HIS  21           HA       HIS  21   6.113 -11.311 -11.311
  156   1HB   HIS  21          2HB       HIS  21   7.962  -9.016  -9.016
  157   2HB   HIS  21          1HB       HIS  21   6.364  -8.815  -8.815
  158    HD1  HIS  21           HD1      HIS  21   5.721 -10.464 -10.464
  159    HD2  HIS  21           HD2      HIS  21   9.655 -10.745 -10.745
  160    HE1  HIS  21           HE1      HIS  21   6.924 -11.781 -11.781
  161    HE2  HIS  21           HE2      HIS  21   9.281 -12.017 -12.017
  162    H    SER  22           H        SER  22   4.487 -11.380 -11.380
  163    HA   SER  22           HA       SER  22   3.605  -9.012  -9.012
  164   1HB   SER  22          2HB       SER  22   2.204 -11.671 -11.671
  165   2HB   SER  22          1HB       SER  22   1.712 -10.402 -10.402
  166    HG   SER  22           HG       SER  22   3.009 -11.376 -11.376
  167    H    PHE  23           H        PHE  23   1.759 -11.088 -11.088
  168    HA   PHE  23           HA       PHE  23   0.173 -10.609 -10.609
  169   1HB   PHE  23          2HB       PHE  23   2.072  -9.573  -9.573
  170   2HB   PHE  23          1HB       PHE  23   1.785  -8.065  -8.065
  171    HD1  PHE  23           HD2      PHE  23  -0.578 -10.398 -10.398
  172    HD2  PHE  23           HD1      PHE  23   1.138  -6.506  -6.506
  173    HE1  PHE  23           HE2      PHE  23  -2.109  -9.673  -9.673
  174    HE2  PHE  23           HE1      PHE  23  -0.388  -5.774  -5.774
  175    HZ   PHE  23           HZ       PHE  23  -2.015  -7.358  -7.358
  176    H    ASP  24           H        ASP  24  -1.755 -10.392 -10.392
  177    HA   ASP  24           HA       ASP  24  -2.494  -8.438  -8.438
  178   1HB   ASP  24          2HB       ASP  24  -3.954 -10.378 -10.378
  179   2HB   ASP  24          1HB       ASP  24  -4.893  -9.071  -9.071
  180    HA   PRO  25           HA       PRO  25  -2.491  -4.892  -4.892
  181   1HB   PRO  25          2HB       PRO  25  -3.787  -3.701  -3.701
  182   2HB   PRO  25          1HB       PRO  25  -2.440  -3.094  -3.094
  183   1HG   PRO  25          2HG       PRO  25  -2.014  -4.176  -4.176
  184   2HG   PRO  25          1HG       PRO  25  -0.892  -4.462  -4.462
  185   1HD   PRO  25          2HD       PRO  25  -2.955  -6.273  -6.273
  186   2HD   PRO  25          1HD       PRO  25  -1.355  -6.662  -6.662
  187    H    PHE  26           H        PHE  26  -5.153  -6.242  -6.242
  188    HA   PHE  26           HA       PHE  26  -7.052  -4.975  -4.975
  189   1HB   PHE  26          2HB       PHE  26  -8.709  -5.801  -5.801
  190   2HB   PHE  26          1HB       PHE  26  -7.850  -4.270  -4.270
  191    HD1  PHE  26           HD1      PHE  26  -5.740  -4.188  -4.188
  192    HD2  PHE  26           HD2      PHE  26  -8.412  -7.499  -7.499
  193    HE1  PHE  26           HE1      PHE  26  -4.762  -4.919  -4.919
  194    HE2  PHE  26           HE2      PHE  26  -7.439  -8.236  -8.236
  195    HZ   PHE  26           HZ       PHE  26  -5.610  -6.946  -6.946
  196    H    ALA  27           H        ALA  27  -5.686  -7.148  -7.148
  197    HA   ALA  27           HA       ALA  27  -7.823  -8.962  -8.962
  198   1HB   ALA  27          3HB       ALA  27  -6.779  -9.687  -9.687
  199   2HB   ALA  27          2HB       ALA  27  -5.469 -10.305 -10.305
  200   3HB   ALA  27          1HB       ALA  27  -7.113 -10.903 -10.903
  201    H    ASP  28           H        ASP  28  -7.431  -8.478  -8.478
  202    HA   ASP  28           HA       ASP  28  -4.975  -9.645  -9.645
  203   1HB   ASP  28          2HB       ASP  28  -4.960  -7.789  -7.789
  204   2HB   ASP  28          1HB       ASP  28  -4.575  -7.281  -7.281
  205    H    ALA  29           H        ALA  29  -8.230  -8.426  -8.426
  206    HA   ALA  29           HA       ALA  29  -8.448  -9.851  -9.851
  207   1HB   ALA  29          3HB       ALA  29 -10.269  -8.222  -8.222
  208   2HB   ALA  29          2HB       ALA  29 -10.989  -9.311  -9.311
  209   3HB   ALA  29          1HB       ALA  29  -9.861  -8.060  -8.060
  210    H    SER  30           H        SER  30  -8.974 -11.909 -11.909
  211    HA   SER  30           HA       SER  30  -9.611 -14.062 -14.062
  212   1HB   SER  30          2HB       SER  30 -11.620 -12.457 -12.457
  213   2HB   SER  30          1HB       SER  30 -11.548 -14.174 -14.174
  214    HG   SER  30           HG       SER  30 -11.897 -14.646 -14.646
  215    H    LYS  31           H        LYS  31  -7.726 -14.863 -14.863
  216    HA   LYS  31           HA       LYS  31  -7.148 -14.584 -14.584
  217   1HB   LYS  31          2HB       LYS  31  -5.784 -16.400 -16.400
  218   2HB   LYS  31          1HB       LYS  31  -5.144 -15.823 -15.823
  219   1HG   LYS  31          2HG       LYS  31  -5.908 -13.791 -13.791
  220   2HG   LYS  31          1HG       LYS  31  -4.456 -14.748 -14.748
  221   1HD   LYS  31          2HD       LYS  31  -4.123 -14.074 -14.074
  222   2HD   LYS  31          1HD       LYS  31  -4.961 -12.650 -12.650
  223   1HE   LYS  31          2HE       LYS  31  -3.135 -13.066 -13.066
  224   2HE   LYS  31          1HE       LYS  31  -2.246 -13.642 -13.642
  225   1HZ   LYS  31          1HZ       LYS  31  -3.631 -11.115 -11.115
  226   2HZ   LYS  31          3HZ       LYS  31  -2.334 -11.091 -11.091
  227   3HZ   LYS  31          2HZ       LYS  31  -2.087 -11.582 -11.582
  228    H    GLY  32           H        GLY  32  -9.206 -15.555 -15.555
  229   1HA   GLY  32          2HA       GLY  32 -10.372 -17.287 -17.287
  230   2HA   GLY  32          1HA       GLY  32  -8.855 -18.174 -18.174
  231    H    ASP  33           H        ASP  33 -11.772 -17.442 -17.442
  232    HA   ASP  33           HA       ASP  33 -12.873 -18.554 -18.554
  233   1HB   ASP  33          2HB       ASP  33 -12.600 -20.383 -20.383
  234   2HB   ASP  33          1HB       ASP  33 -11.282 -20.996 -20.996
  235    H    ASP  34           H        ASP  34 -10.299 -17.278 -17.278
  236    HA   ASP  34           HA       ASP  34  -8.833 -17.044 -17.044
  237   1HB   ASP  34          2HB       ASP  34 -11.266 -18.097 -18.097
  238   2HB   ASP  34          1HB       ASP  34  -9.888 -18.726 -18.726
  239    H    LEU  35           H        LEU  35  -7.177 -18.165 -18.165
  240    HA   LEU  35           HA       LEU  35  -6.818 -20.998 -20.998
  241   1HB   LEU  35          2HB       LEU  35  -6.220 -19.473 -19.473
  242   2HB   LEU  35          1HB       LEU  35  -4.670 -19.480 -19.480
  243    HG   LEU  35           HG       LEU  35  -4.760 -21.982 -21.982
  244   1HD1  LEU  35          3HD1      LEU  35  -7.383 -21.734 -21.734
  245   2HD1  LEU  35          2HD1      LEU  35  -6.792 -21.961 -21.961
  246   3HD1  LEU  35          1HD1      LEU  35  -6.450 -23.174 -23.174
  247   1HD2  LEU  35          2HD2      LEU  35  -3.467 -20.762 -20.762
  248   2HD2  LEU  35          1HD2      LEU  35  -4.179 -22.218 -22.218
  249   3HD2  LEU  35          3HD2      LEU  35  -4.893 -20.640 -20.640
  250    H    LEU  36           H        LEU  36  -5.402 -21.858 -21.858
  251    HA   LEU  36           HA       LEU  36  -3.914 -22.022 -22.022
  252   1HB   LEU  36          2HB       LEU  36  -2.826 -19.857 -19.857
  253   2HB   LEU  36          1HB       LEU  36  -2.224 -19.905 -19.905
  254    HG   LEU  36           HG       LEU  36  -1.542 -22.268 -22.268
  255   1HD1  LEU  36          1HD1      LEU  36  -2.873 -21.770 -21.770
  256   2HD1  LEU  36          3HD1      LEU  36  -1.351 -22.660 -22.660
  257   3HD1  LEU  36          2HD1      LEU  36  -2.685 -23.266 -23.266
  258   1HD2  LEU  36          3HD2      LEU  36  -0.440 -20.100 -20.100
  259   2HD2  LEU  36          2HD2      LEU  36   0.180 -20.689 -20.689
  260   3HD2  LEU  36          1HD2      LEU  36   0.303 -21.696 -21.696
  261    HA   PRO  37           HA       PRO  37  -5.649 -19.584 -19.584
  262   1HB   PRO  37          2HB       PRO  37  -3.922 -20.109 -20.109
  263   2HB   PRO  37          1HB       PRO  37  -5.051 -21.320 -21.320
  264   1HG   PRO  37          2HG       PRO  37  -2.141 -20.962 -20.962
  265   2HG   PRO  37          1HG       PRO  37  -3.040 -22.456 -22.456
  266   1HD   PRO  37          2HD       PRO  37  -2.388 -21.636 -21.636
  267   2HD   PRO  37          1HD       PRO  37  -3.842 -22.590 -22.590
  268    H    ALA  38           H        ALA  38  -2.175 -19.238 -19.238
  269    HA   ALA  38           HA       ALA  38  -2.345 -16.449 -16.449
  270   1HB   ALA  38          2HB       ALA  38  -0.751 -18.062 -18.062
  271   2HB   ALA  38          1HB       ALA  38   0.207 -18.000 -18.000
  272   3HB   ALA  38          3HB       ALA  38  -0.078 -16.528 -16.528
  273    H    GLY  39           H        GLY  39  -1.805 -14.808 -14.808
  274   1HA   GLY  39          2HA       GLY  39  -0.349 -15.300 -15.300
  275   2HA   GLY  39          1HA       GLY  39  -2.045 -14.905 -14.905
  276    H    THR  40           H        THR  40  -0.236 -13.549 -13.549
  277    HA   THR  40           HA       THR  40   0.355 -11.099 -11.099
  278    HB   THR  40           HB       THR  40  -0.940  -9.971  -9.971
  279    HG1  THR  40           HG1      THR  40  -1.783 -12.113 -12.113
  280   1HG2  THR  40          2HG2      THR  40  -1.317 -10.069 -10.069
  281   2HG2  THR  40          1HG2      THR  40  -2.893 -10.386 -10.386
  282   3HG2  THR  40          3HG2      THR  40  -2.006  -8.922  -8.922
  283    H    GLU  41           H        GLU  41   1.722 -13.238 -13.238
  284    HA   GLU  41           HA       GLU  41   3.352 -13.468 -13.468
  285   1HB   GLU  41          2HB       GLU  41   3.716 -10.894 -10.894
  286   2HB   GLU  41          1HB       GLU  41   4.393 -10.914 -10.914
  287   1HG   GLU  41          2HG       GLU  41   5.740 -12.845 -12.845
  288   2HG   GLU  41          1HG       GLU  41   5.011 -12.922 -12.922
  289    H    ASP  42           H        ASP  42   0.610 -12.595 -12.595
  290    HA   ASP  42           HA       ASP  42  -0.472 -11.839 -11.839
  291   1HB   ASP  42          2HB       ASP  42   0.992 -13.953 -13.953
  292   2HB   ASP  42          1HB       ASP  42   1.834 -12.787 -12.787
  293    H    TYR  43           H        TYR  43   0.171  -9.593  -9.593
  294    HA   TYR  43           HA       TYR  43   2.233  -8.180  -8.180
  295   1HB   TYR  43          2HB       TYR  43  -0.197  -7.079  -7.079
  296   2HB   TYR  43          1HB       TYR  43   1.246  -6.175  -6.175
  297    HD1  TYR  43           HD2      TYR  43   3.144  -8.567  -8.567
  298    HD2  TYR  43           HD1      TYR  43  -0.026  -6.498  -6.498
  299    HE1  TYR  43           HE2      TYR  43   4.139  -9.101  -9.101
  300    HE2  TYR  43           HE1      TYR  43   0.963  -7.036  -7.036
  301    HH   TYR  43           HH       TYR  43   4.029  -7.989  -7.989
  302    H    ILE  44           H        ILE  44   1.596  -6.063  -6.063
  303    HA   ILE  44           HA       ILE  44  -0.390  -6.766  -6.766
  304    HB   ILE  44           HB       ILE  44   2.043  -4.996  -4.996
  305   1HG1  ILE  44          2HG1      ILE  44   2.813  -7.233  -7.233
  306   2HG1  ILE  44          1HG1      ILE  44   2.726  -6.818  -6.818
  307   1HG2  ILE  44          3HG2      ILE  44   0.037  -4.363  -4.363
  308   2HG2  ILE  44          2HG2      ILE  44   0.182  -5.932  -5.932
  309   3HG2  ILE  44          1HG2      ILE  44   1.488  -4.755  -4.755
  310   1HD1  ILE  44          3HD1      ILE  44   0.423  -7.914  -7.914
  311   2HD1  ILE  44          2HD1      ILE  44   0.924  -8.601  -8.601
  312   3HD1  ILE  44          1HD1      ILE  44   1.840  -8.962  -8.962
  313    H    HIS  45           H        HIS  45  -2.200  -5.791  -5.791
  314    HA   HIS  45           HA       HIS  45  -2.274  -3.276  -3.276
  315   1HB   HIS  45          2HB       HIS  45  -4.091  -5.374  -5.374
  316   2HB   HIS  45          1HB       HIS  45  -4.802  -3.863  -3.863
  317    HD1  HIS  45           HD1      HIS  45  -3.687  -5.633  -5.633
  318    HD2  HIS  45           HD2      HIS  45  -5.615  -2.123  -2.123
  319    HE1  HIS  45           HE1      HIS  45  -4.635  -4.689  -4.689
  320    HE2  HIS  45           HE2      HIS  45  -5.888  -2.620  -2.620
  321    H    ILE  46           H        ILE  46  -2.022  -1.350  -1.350
  322    HA   ILE  46           HA       ILE  46  -2.170  -0.903  -0.903
  323    HB   ILE  46           HB       ILE  46  -1.671   1.076   1.076
  324   1HG1  ILE  46          2HG1      ILE  46   0.020  -0.733  -0.733
  325   2HG1  ILE  46          1HG1      ILE  46   0.680   0.854   0.854
  326   1HG2  ILE  46          3HG2      ILE  46  -1.783   1.330   1.330
  327   2HG2  ILE  46          2HG2      ILE  46  -0.524   2.224   2.224
  328   3HG2  ILE  46          1HG2      ILE  46  -2.220   2.488   2.488
  329   1HD1  ILE  46          2HD1      ILE  46   0.044   0.081   0.081
  330   2HD1  ILE  46          1HD1      ILE  46   0.286  -1.505  -1.505
  331   3HD1  ILE  46          3HD1      ILE  46   1.587  -0.314  -0.314
  332    H    ARG  47           H        ARG  47  -3.405   1.624   1.624
  333    HA   ARG  47           HA       ARG  47  -5.500   2.442   2.442
  334   1HB   ARG  47          2HB       ARG  47  -6.103  -0.164  -0.164
  335   2HB   ARG  47          1HB       ARG  47  -6.958   0.628   0.628
  336   1HG   ARG  47          2HG       ARG  47  -7.317   1.866   1.866
  337   2HG   ARG  47          1HG       ARG  47  -7.974   0.236   0.236
  338   1HD   ARG  47          2HD       ARG  47  -8.790   1.419   1.419
  339   2HD   ARG  47          1HD       ARG  47  -8.869   2.761   2.761
  340    HE   ARG  47           HE       ARG  47 -10.097   0.332   0.332
  341   1HH1  ARG  47          2HH1      ARG  47 -10.578   3.294   3.294
  342   2HH1  ARG  47          1HH1      ARG  47 -12.290   3.317   3.317
  343   1HH2  ARG  47          1HH2      ARG  47 -12.349   0.362   0.362
  344   2HH2  ARG  47          2HH2      ARG  47 -13.296   1.652   1.652
  345    H    ILE  48           H        ILE  48  -6.187   4.231   4.231
  346    HA   ILE  48           HA       ILE  48  -5.900   4.597   4.597
  347    HB   ILE  48           HB       ILE  48  -5.946   6.537   6.537
  348   1HG1  ILE  48          2HG1      ILE  48  -4.005   6.170   6.170
  349   2HG1  ILE  48          1HG1      ILE  48  -3.791   5.512   5.512
  350   1HG2  ILE  48          1HG2      ILE  48  -6.287   7.193   7.193
  351   2HG2  ILE  48          3HG2      ILE  48  -5.854   8.370   8.370
  352   3HG2  ILE  48          2HG2      ILE  48  -7.409   7.542   7.542
  353   1HD1  ILE  48          1HD1      ILE  48  -4.095   8.448   8.448
  354   2HD1  ILE  48          3HD1      ILE  48  -2.536   7.624   7.624
  355   3HD1  ILE  48          2HD1      ILE  48  -3.562   7.673   7.673
  356    H    GLN  49           H        GLN  49  -7.574   5.788   5.788
  357    HA   GLN  49           HA       GLN  49 -10.206   5.728   5.728
  358   1HB   GLN  49          2HB       GLN  49 -11.239   4.798   4.798
  359   2HB   GLN  49          1HB       GLN  49  -9.997   3.709   3.709
  360   1HG   GLN  49          2HG       GLN  49  -9.014   3.714   3.714
  361   2HG   GLN  49          1HG       GLN  49  -8.800   5.462   5.462
  362   1HE2  GLN  49          1HE2      GLN  49 -10.719   2.866   2.866
  363   2HE2  GLN  49          2HE2      GLN  49 -11.667   3.812   3.812
  364    H    GLN  50           H        GLN  50  -9.811   8.001   8.001
  365    HA   GLN  50           HA       GLN  50  -9.685   9.611   9.611
  366   1HB   GLN  50          2HB       GLN  50  -8.670   9.958   9.958
  367   2HB   GLN  50          1HB       GLN  50 -10.090  10.996  10.996
  368   1HG   GLN  50          2HG       GLN  50  -9.284  12.379  12.379
  369   2HG   GLN  50          1HG       GLN  50  -8.176  11.156  11.156
  370   1HE2  GLN  50          2HE2      GLN  50  -6.157  13.674  13.674
  371   2HE2  GLN  50          1HE2      GLN  50  -7.203  13.611  13.611
  372    H    ARG  51           H        ARG  51 -11.611   9.531   9.531
  373    HA   ARG  51           HA       ARG  51 -14.123   9.705   9.705
  374   1HB   ARG  51          2HB       ARG  51 -13.204   9.376   9.376
  375   2HB   ARG  51          1HB       ARG  51 -14.699  10.288  10.288
  376   1HG   ARG  51          2HG       ARG  51 -15.858   8.436   8.436
  377   2HG   ARG  51          1HG       ARG  51 -14.799   7.961   7.961
  378   1HD   ARG  51          2HD       ARG  51 -14.867   6.275   6.275
  379   2HD   ARG  51          1HD       ARG  51 -13.251   6.940   6.940
  380    HE   ARG  51           HE       ARG  51 -13.320   7.723   7.723
  381   1HH1  ARG  51          2HH1      ARG  51 -16.591   7.103   7.103
  382   2HH1  ARG  51          1HH1      ARG  51 -17.284   7.433   7.433
  383   1HH2  ARG  51          1HH2      ARG  51 -14.230   8.157   8.157
  384   2HH2  ARG  51          2HH2      ARG  51 -15.945   8.032   8.032
  385    H    ASN  52           H        ASN  52 -15.169  11.480  11.480
  386    HA   ASN  52           HA       ASN  52 -15.753  13.659  13.659
  387   1HB   ASN  52          2HB       ASN  52 -16.030  13.382  13.382
  388   2HB   ASN  52          1HB       ASN  52 -14.538  14.312  14.312
  389   1HD2  ASN  52          2HD2      ASN  52 -16.078  17.356  17.356
  390   2HD2  ASN  52          1HD2      ASN  52 -14.678  16.443  16.443
  391    H    GLY  53           H        GLY  53 -12.981  12.622  12.622
  392   1HA   GLY  53          2HA       GLY  53 -11.070  13.464  13.464
  393   2HA   GLY  53          1HA       GLY  53 -11.899  15.011  15.011
  394    H    ARG  54           H        ARG  54 -11.234  13.231  13.231
  395    HA   ARG  54           HA       ARG  54  -8.986  14.950  14.950
  396   1HB   ARG  54          2HB       ARG  54 -11.384  14.920  14.920
  397   2HB   ARG  54          1HB       ARG  54  -9.933  15.901  15.901
  398   1HG   ARG  54          2HG       ARG  54 -10.610  16.955  16.955
  399   2HG   ARG  54          1HG       ARG  54 -12.175  16.177  16.177
  400   1HD   ARG  54          2HD       ARG  54 -12.374  17.316  17.316
  401   2HD   ARG  54          1HD       ARG  54 -10.839  18.129  18.129
  402    HE   ARG  54           HE       ARG  54 -12.592  18.626  18.626
  403   1HH1  ARG  54          2HH1      ARG  54 -12.158  19.439  19.439
  404   2HH1  ARG  54          1HH1      ARG  54 -12.954  20.970  20.970
  405   1HH2  ARG  54          1HH2      ARG  54 -13.639  20.641  20.641
  406   2HH2  ARG  54          2HH2      ARG  54 -13.795  21.653  21.653
  407    H    LYS  55           H        LYS  55 -11.320  12.747  12.747
  408    HA   LYS  55           HA       LYS  55  -9.431  11.658  11.658
  409   1HB   LYS  55          2HB       LYS  55 -12.215  11.338  11.338
  410   2HB   LYS  55          1HB       LYS  55 -11.480   9.744   9.744
  411   1HG   LYS  55          2HG       LYS  55 -12.284  10.319  10.319
  412   2HG   LYS  55          1HG       LYS  55 -10.520  10.368  10.368
  413   1HD   LYS  55          2HD       LYS  55 -11.078  12.929  12.929
  414   2HD   LYS  55          1HD       LYS  55 -12.486  12.538  12.538
  415   1HE   LYS  55          2HE       LYS  55 -10.609  11.536  11.536
  416   2HE   LYS  55          1HE       LYS  55  -9.619  12.734  12.734
  417   1HZ   LYS  55          2HZ       LYS  55 -11.209  14.439  14.439
  418   2HZ   LYS  55          1HZ       LYS  55 -12.146  13.287  13.287
  419   3HZ   LYS  55          3HZ       LYS  55 -10.585  13.646  13.646
  420    H    THR  56           H        THR  56  -7.691  11.349  11.349
  421    HA   THR  56           HA       THR  56  -7.936   9.191   9.191
  422    HB   THR  56           HB       THR  56  -5.224  10.044  10.044
  423    HG1  THR  56           HG1      THR  56  -5.631  12.077  12.077
  424   1HG2  THR  56          1HG2      THR  56  -6.897   9.725   9.725
  425   2HG2  THR  56          3HG2      THR  56  -5.542  10.850  10.850
  426   3HG2  THR  56          2HG2      THR  56  -5.259   9.158   9.158
  427    H    LEU  57           H        LEU  57  -7.501   7.116   7.116
  428    HA   LEU  57           HA       LEU  57  -5.814   6.309   6.309
  429   1HB   LEU  57          2HB       LEU  57  -8.632   6.077   6.077
  430   2HB   LEU  57          1HB       LEU  57  -7.987   4.460   4.460
  431    HG   LEU  57           HG       LEU  57  -6.509   5.045   5.045
  432   1HD1  LEU  57          1HD1      LEU  57  -7.249   7.473   7.473
  433   2HD1  LEU  57          3HD1      LEU  57  -8.786   6.922   6.922
  434   3HD1  LEU  57          2HD1      LEU  57  -7.298   6.696   6.696
  435   1HD2  LEU  57          3HD2      LEU  57  -9.201   4.020   4.020
  436   2HD2  LEU  57          2HD2      LEU  57  -7.877   3.448   3.448
  437   3HD2  LEU  57          1HD2      LEU  57  -8.937   4.733   4.733
  438    H    THR  58           H        THR  58  -4.238   5.755   5.755
  439    HA   THR  58           HA       THR  58  -4.677   4.149   4.149
  440    HB   THR  58           HB       THR  58  -2.149   4.444   4.444
  441    HG1  THR  58           HG1      THR  58  -3.263   6.390   6.390
  442   1HG2  THR  58          2HG2      THR  58  -2.639   3.451   3.451
  443   2HG2  THR  58          1HG2      THR  58  -1.090   4.136   4.136
  444   3HG2  THR  58          3HG2      THR  58  -1.714   2.700   2.700
  445    H    THR  59           H        THR  59  -5.074   2.027   2.027
  446    HA   THR  59           HA       THR  59  -4.570   0.319   0.319
  447    HB   THR  59           HB       THR  59  -6.184  -1.206  -1.206
  448    HG1  THR  59           HG1      THR  59  -6.731   0.227   0.227
  449   1HG2  THR  59          2HG2      THR  59  -6.415   0.004   0.004
  450   2HG2  THR  59          1HG2      THR  59  -7.786   0.650   0.650
  451   3HG2  THR  59          3HG2      THR  59  -7.583  -1.094  -1.094
  452    H    VAL  60           H        VAL  60  -3.893  -1.889  -1.889
  453    HA   VAL  60           HA       VAL  60  -2.341  -2.198  -2.198
  454    HB   VAL  60           HB       VAL  60  -1.464  -3.237  -3.237
  455   1HG1  VAL  60          3HG1      VAL  60  -0.659  -4.404  -4.404
  456   2HG1  VAL  60          2HG1      VAL  60   0.095  -2.890  -2.890
  457   3HG1  VAL  60          1HG1      VAL  60   0.627  -3.695  -3.695
  458   1HG2  VAL  60          1HG2      VAL  60  -0.893  -0.647  -0.647
  459   2HG2  VAL  60          3HG2      VAL  60  -1.268  -0.952  -0.952
  460   3HG2  VAL  60          2HG2      VAL  60   0.317  -1.384  -1.384
  461    H    GLN  61           H        GLN  61  -2.890  -3.922  -3.922
  462    HA   GLN  61           HA       GLN  61  -4.133  -6.194  -6.194
  463   1HB   GLN  61          2HB       GLN  61  -5.350  -4.631  -4.631
  464   2HB   GLN  61          1HB       GLN  61  -4.686  -5.907  -5.907
  465   1HG   GLN  61          2HG       GLN  61  -5.777  -7.382  -7.382
  466   2HG   GLN  61          1HG       GLN  61  -6.858  -5.990  -5.990
  467   1HE2  GLN  61          2HE2      GLN  61  -7.425  -6.677  -6.677
  468   2HE2  GLN  61          1HE2      GLN  61  -6.526  -5.460  -5.460
  469    H    GLY  62           H        GLY  62  -3.621  -8.280  -8.280
  470   1HA   GLY  62          2HA       GLY  62  -2.478  -9.800  -9.800
  471   2HA   GLY  62          1HA       GLY  62  -1.376  -8.493  -8.493
  472    H    ILE  63           H        ILE  63  -1.096  -7.670  -7.670
  473    HA   ILE  63           HA       ILE  63   1.196  -9.125  -9.125
  474    HB   ILE  63           HB       ILE  63  -0.531  -7.330  -7.330
  475   1HG1  ILE  63          2HG1      ILE  63   0.407  -5.958  -5.958
  476   2HG1  ILE  63          1HG1      ILE  63   1.616  -5.870  -5.870
  477   1HG2  ILE  63          3HG2      ILE  63   1.735  -8.997  -8.997
  478   2HG2  ILE  63          2HG2      ILE  63   1.970  -7.296  -7.296
  479   3HG2  ILE  63          1HG2      ILE  63   0.565  -8.160  -8.160
  480   1HD1  ILE  63          2HD1      ILE  63   2.786  -7.766  -7.766
  481   2HD1  ILE  63          1HD1      ILE  63   1.726  -7.342  -7.342
  482   3HD1  ILE  63          3HD1      ILE  63   2.847  -6.146  -6.146
  483    H    ALA  64           H        ALA  64   1.634 -10.696 -10.696
  484    HA   ALA  64           HA       ALA  64  -0.555 -12.492 -12.492
  485   1HB   ALA  64          1HB       ALA  64   2.320 -12.687 -12.687
  486   2HB   ALA  64          3HB       ALA  64   1.733 -13.541 -13.541
  487   3HB   ALA  64          2HB       ALA  64   1.085 -13.934 -13.934
  488    H    ASP  65           H        ASP  65  -1.485 -12.835 -12.835
  489    HA   ASP  65           HA       ASP  65  -1.178 -10.971 -10.971
  490   1HB   ASP  65          2HB       ASP  65  -3.238 -12.355 -12.355
  491   2HB   ASP  65          1HB       ASP  65  -2.426 -13.710 -13.710
  492    H    ASP  66           H        ASP  66   0.584 -13.786 -13.786
  493    HA   ASP  66           HA       ASP  66   1.449 -14.449 -14.449
  494   1HB   ASP  66          2HB       ASP  66   2.460 -15.242 -15.242
  495   2HB   ASP  66          1HB       ASP  66   3.153 -15.848 -15.848
  496    H    TYR  67           H        TYR  67   2.223 -11.947 -11.947
  497    HA   TYR  67           HA       TYR  67   4.955 -11.606 -11.606
  498   1HB   TYR  67          2HB       TYR  67   2.662  -9.694  -9.694
  499   2HB   TYR  67          1HB       TYR  67   4.293  -9.075  -9.075
  500    HD1  TYR  67           HD1      TYR  67   4.195 -12.188 -12.188
  501    HD2  TYR  67           HD2      TYR  67   3.786  -7.979  -7.979
  502    HE1  TYR  67           HE1      TYR  67   4.604 -12.412 -12.412
  503    HE2  TYR  67           HE2      TYR  67   4.191  -8.188  -8.188
  504    HH   TYR  67           HH       TYR  67   3.927 -10.031 -10.031
  505    H    ASP  68           H        ASP  68   5.733  -9.431  -9.431
  506    HA   ASP  68           HA       ASP  68   6.078 -10.163 -10.163
  507   1HB   ASP  68          2HB       ASP  68   6.215  -7.345  -7.345
  508   2HB   ASP  68          1HB       ASP  68   7.021  -7.956  -7.956
  509    H    LYS  69           H        LYS  69   3.538  -8.300  -8.300
  510    HA   LYS  69           HA       LYS  69   1.541  -7.539  -7.539
  511   1HB   LYS  69          2HB       LYS  69   2.110  -9.827  -9.827
  512   2HB   LYS  69          1HB       LYS  69   1.496  -8.610  -8.610
  513   1HG   LYS  69          2HG       LYS  69  -0.147  -8.595  -8.595
  514   2HG   LYS  69          1HG       LYS  69   0.055 -10.267 -10.267
  515   1HD   LYS  69          2HD       LYS  69  -0.561  -8.176  -8.176
  516   2HD   LYS  69          1HD       LYS  69  -1.858  -8.761  -8.761
  517   1HE   LYS  69          2HE       LYS  69  -0.078 -10.689 -10.689
  518   2HE   LYS  69          1HE       LYS  69  -1.429  -9.928  -9.928
  519   1HZ   LYS  69          3HZ       LYS  69  -2.907 -10.796 -10.796
  520   2HZ   LYS  69          2HZ       LYS  69  -1.600 -11.575 -11.575
  521   3HZ   LYS  69          1HZ       LYS  69  -2.095 -12.039 -12.039
  522    H    LYS  70           H        LYS  70   3.219  -7.763  -7.763
  523    HA   LYS  70           HA       LYS  70   2.430  -5.249  -5.249
  524   1HB   LYS  70          2HB       LYS  70   4.787  -6.978  -6.978
  525   2HB   LYS  70          1HB       LYS  70   4.400  -5.481  -5.481
  526   1HG   LYS  70          2HG       LYS  70   3.165  -6.746  -6.746
  527   2HG   LYS  70          1HG       LYS  70   2.003  -6.809  -6.809
  528   1HD   LYS  70          2HD       LYS  70   2.362  -8.988  -8.988
  529   2HD   LYS  70          1HD       LYS  70   4.112  -8.763  -8.763
  530   1HE   LYS  70          2HE       LYS  70   3.451 -10.261 -10.261
  531   2HE   LYS  70          1HE       LYS  70   4.158  -8.776  -8.776
  532   1HZ   LYS  70          3HZ       LYS  70   1.585  -8.116  -8.116
  533   2HZ   LYS  70          2HZ       LYS  70   1.442  -9.781  -9.781
  534   3HZ   LYS  70          1HZ       LYS  70   2.337  -8.830  -8.830
  535    H    LYS  71           H        LYS  71   5.778  -6.092  -6.092
  536    HA   LYS  71           HA       LYS  71   6.657  -3.452  -3.452
  537   1HB   LYS  71          2HB       LYS  71   7.805  -5.975  -5.975
  538   2HB   LYS  71          1HB       LYS  71   8.035  -5.306  -5.306
  539   1HG   LYS  71          2HG       LYS  71   9.013  -3.270  -3.270
  540   2HG   LYS  71          1HG       LYS  71   8.980  -4.171  -4.171
  541   1HD   LYS  71          2HD       LYS  71  11.117  -4.615  -4.615
  542   2HD   LYS  71          1HD       LYS  71  10.242  -5.988  -5.988
  543   1HE   LYS  71          2HE       LYS  71  10.675  -5.348  -5.348
  544   2HE   LYS  71          1HE       LYS  71  10.233  -3.674  -3.674
  545   1HZ   LYS  71          1HZ       LYS  71  12.823  -4.803  -4.803
  546   2HZ   LYS  71          3HZ       LYS  71  12.621  -4.135  -4.135
  547   3HZ   LYS  71          2HZ       LYS  71  12.386  -3.177  -3.177
  548    H    LEU  72           H        LEU  72   4.778  -5.416  -5.416
  549    HA   LEU  72           HA       LEU  72   5.374  -4.393  -4.393
  550   1HB   LEU  72          2HB       LEU  72   3.762  -6.279  -6.279
  551   2HB   LEU  72          1HB       LEU  72   2.566  -5.012  -5.012
  552    HG   LEU  72           HG       LEU  72   4.001  -5.745  -5.745
  553   1HD1  LEU  72          2HD1      LEU  72   1.365  -6.399  -6.399
  554   2HD1  LEU  72          1HD1      LEU  72   1.412  -6.033  -6.033
  555   3HD1  LEU  72          3HD1      LEU  72   2.398  -7.342  -7.342
  556   1HD2  LEU  72          3HD2      LEU  72   2.131  -3.501  -3.501
  557   2HD2  LEU  72          2HD2      LEU  72   3.686  -3.431  -3.431
  558   3HD2  LEU  72          1HD2      LEU  72   2.280  -4.113  -4.113
  559    H    VAL  73           H        VAL  73   2.566  -3.363  -3.363
  560    HA   VAL  73           HA       VAL  73   2.517  -0.838  -0.838
  561    HB   VAL  73           HB       VAL  73   0.446  -2.227  -2.227
  562   1HG1  VAL  73          1HG1      VAL  73   1.035  -2.640  -2.640
  563   2HG1  VAL  73          3HG1      VAL  73   0.730  -0.935  -0.935
  564   3HG1  VAL  73          2HG1      VAL  73  -0.584  -1.972  -1.972
  565   1HG2  VAL  73          3HG2      VAL  73   0.782   0.696   0.696
  566   2HG2  VAL  73          2HG2      VAL  73  -0.147  -0.206  -0.206
  567   3HG2  VAL  73          1HG2      VAL  73  -0.778  -0.003  -0.003
  568    H    LYS  74           H        LYS  74   3.319  -2.060  -2.060
  569    HA   LYS  74           HA       LYS  74   3.274   0.334   0.334
  570   1HB   LYS  74          2HB       LYS  74   3.550  -1.946  -1.946
  571   2HB   LYS  74          1HB       LYS  74   5.199  -1.966  -1.966
  572   1HG   LYS  74          2HG       LYS  74   4.266   0.227   0.227
  573   2HG   LYS  74          1HG       LYS  74   4.787  -1.329  -1.329
  574   1HD   LYS  74          2HD       LYS  74   6.785  -0.710  -0.710
  575   2HD   LYS  74          1HD       LYS  74   6.363   0.864   0.864
  576   1HE   LYS  74          2HE       LYS  74   8.157  -0.283  -0.283
  577   2HE   LYS  74          1HE       LYS  74   6.731   0.052   0.052
  578   1HZ   LYS  74          3HZ       LYS  74   6.807  -2.540  -2.540
  579   2HZ   LYS  74          2HZ       LYS  74   7.924  -2.311  -2.311
  580   3HZ   LYS  74          1HZ       LYS  74   6.270  -2.126  -2.126
  581    H    ALA  75           H        ALA  75   5.797  -1.130  -1.130
  582    HA   ALA  75           HA       ALA  75   7.832   0.731   0.731
  583   1HB   ALA  75          1HB       ALA  75   8.292  -1.437  -1.437
  584   2HB   ALA  75          3HB       ALA  75   7.443  -0.935  -0.935
  585   3HB   ALA  75          2HB       ALA  75   8.934  -0.123  -0.123
  586    H    PHE  76           H        PHE  76   5.138   0.775   0.775
  587    HA   PHE  76           HA       PHE  76   5.953   2.789   2.789
  588   1HB   PHE  76          2HB       PHE  76   3.800   1.281   1.281
  589   2HB   PHE  76          1HB       PHE  76   3.105   2.646   2.646
  590    HD1  PHE  76           HD2      PHE  76   4.588   1.557   1.557
  591    HD2  PHE  76           HD1      PHE  76   2.570   4.684   4.684
  592    HE1  PHE  76           HE2      PHE  76   4.158   2.690   2.690
  593    HE2  PHE  76           HE1      PHE  76   2.138   5.821   5.821
  594    HZ   PHE  76           HZ       PHE  76   2.933   4.821   4.821
  595    H    LYS  77           H        LYS  77   4.287   2.999   2.999
  596    HA   LYS  77           HA       LYS  77   4.032   5.823   5.823
  597   1HB   LYS  77          2HB       LYS  77   4.091   3.997   3.997
  598   2HB   LYS  77          1HB       LYS  77   3.350   5.588   5.588
  599   1HG   LYS  77          2HG       LYS  77   1.943   4.468   4.468
  600   2HG   LYS  77          1HG       LYS  77   2.413   2.978   2.978
  601   1HD   LYS  77          2HD       LYS  77   1.633   4.561   4.561
  602   2HD   LYS  77          1HD       LYS  77   0.521   5.059   5.059
  603   1HE   LYS  77          2HE       LYS  77  -0.379   2.925   2.925
  604   2HE   LYS  77          1HE       LYS  77   1.007   2.157   2.157
  605   1HZ   LYS  77          3HZ       LYS  77   0.279   3.378   3.378
  606   2HZ   LYS  77          2HZ       LYS  77  -1.179   3.688   3.688
  607   3HZ   LYS  77          1HZ       LYS  77  -0.703   2.094   2.094
  608    H    LYS  78           H        LYS  78   6.720   3.812   3.812
  609    HA   LYS  78           HA       LYS  78   8.130   5.768   5.768
  610   1HB   LYS  78          2HB       LYS  78   8.237   3.325   3.325
  611   2HB   LYS  78          1HB       LYS  78   9.097   3.074   3.074
  612   1HG   LYS  78          2HG       LYS  78  10.616   5.012   5.012
  613   2HG   LYS  78          1HG       LYS  78  10.033   4.216   4.216
  614   1HD   LYS  78          2HD       LYS  78  11.202   2.320   2.320
  615   2HD   LYS  78          1HD       LYS  78  10.982   2.435   2.435
  616   1HE   LYS  78          2HE       LYS  78  13.270   2.780   2.780
  617   2HE   LYS  78          1HE       LYS  78  12.613   4.405   4.405
  618   1HZ   LYS  78          2HZ       LYS  78  12.464   4.203   4.203
  619   2HZ   LYS  78          1HZ       LYS  78  13.741   3.121   3.121
  620   3HZ   LYS  78          3HZ       LYS  78  13.876   4.722   4.722
  621    H    LYS  79           H        LYS  79   7.814   4.756   4.756
  622    HA   LYS  79           HA       LYS  79  10.352   6.013   6.013
  623   1HB   LYS  79          2HB       LYS  79   9.874   3.760   3.760
  624   2HB   LYS  79          1HB       LYS  79   8.439   4.393   4.393
  625   1HG   LYS  79          2HG       LYS  79   9.814   5.836   5.836
  626   2HG   LYS  79          1HG       LYS  79  11.267   5.268   5.268
  627   1HD   LYS  79          2HD       LYS  79  10.615   2.938   2.938
  628   2HD   LYS  79          1HD       LYS  79   9.419   3.711   3.711
  629   1HE   LYS  79          2HE       LYS  79  11.354   3.328   3.328
  630   2HE   LYS  79          1HE       LYS  79  11.291   5.057   5.057
  631   1HZ   LYS  79          2HZ       LYS  79  12.816   3.409   3.409
  632   2HZ   LYS  79          1HZ       LYS  79  13.479   3.621   3.621
  633   3HZ   LYS  79          3HZ       LYS  79  13.133   4.967   4.967
  634    H    PHE  80           H        PHE  80   6.871   6.268   6.268
  635    HA   PHE  80           HA       PHE  80   7.350   8.801   8.801
  636   1HB   PHE  80          2HB       PHE  80   4.791   7.221   7.221
  637   2HB   PHE  80          1HB       PHE  80   5.367   8.473   8.473
  638    HD1  PHE  80           HD1      PHE  80   5.658   4.963   4.963
  639    HD2  PHE  80           HD2      PHE  80   6.983   7.975   7.975
  640    HE1  PHE  80           HE1      PHE  80   6.625   3.231   3.231
  641    HE2  PHE  80           HE2      PHE  80   7.952   6.249   6.249
  642    HZ   PHE  80           HZ       PHE  80   7.775   3.872   3.872
  643    H    ALA  81           H        ALA  81   6.106   7.446   7.446
  644    HA   ALA  81           HA       ALA  81   5.105   8.375   8.375
  645   1HB   ALA  81          3HB       ALA  81   6.195  10.681  10.681
  646   2HB   ALA  81          2HB       ALA  81   4.827  11.064  11.064
  647   3HB   ALA  81          1HB       ALA  81   6.254  10.276  10.276
  648    H    CYS  82           H        CYS  82   3.579   7.422   7.422
  649    HA   CYS  82           HA       CYS  82   1.220   9.164   9.164
  650   1HB   CYS  82          2HB       CYS  82   1.891   6.805   6.805
  651   2HB   CYS  82          1HB       CYS  82   0.410   7.751   7.751
  652    HG   CYS  82           HG       CYS  82   3.183   9.029   9.029
  653    H    ASN  83           H        ASN  83  -0.866   7.589   7.589
  654    HA   ASN  83           HA       ASN  83  -0.807   5.800   5.800
  655   1HB   ASN  83          2HB       ASN  83  -2.349   7.365   7.365
  656   2HB   ASN  83          1HB       ASN  83  -2.792   7.782   7.782
  657   1HD2  ASN  83          2HD2      ASN  83  -5.302   5.336   5.336
  658   2HD2  ASN  83          1HD2      ASN  83  -4.145   6.266   6.266
  659    H    GLY  84           H        GLY  84  -0.818   3.728   3.728
  660   1HA   GLY  84          2HA       GLY  84  -2.237   2.948   2.948
  661   2HA   GLY  84          1HA       GLY  84  -0.809   2.131   2.131
  662    H    THR  85           H        THR  85  -3.766   1.429   1.429
  663    HA   THR  85           HA       THR  85  -4.113  -0.106  -0.106
  664    HB   THR  85           HB       THR  85  -6.558   0.185   0.185
  665    HG1  THR  85           HG1      THR  85  -5.911   2.065   2.065
  666   1HG2  THR  85          2HG2      THR  85  -4.801   2.547   2.547
  667   2HG2  THR  85          1HG2      THR  85  -6.548   2.784   2.784
  668   3HG2  THR  85          3HG2      THR  85  -5.843   1.709   1.709
  669    H    VAL  86           H        VAL  86  -4.452  -2.222  -2.222
  670    HA   VAL  86           HA       VAL  86  -4.525  -3.274  -3.274
  671    HB   VAL  86           HB       VAL  86  -3.015  -4.289  -4.289
  672   1HG1  VAL  86          2HG1      VAL  86  -5.024  -3.982  -3.982
  673   2HG1  VAL  86          1HG1      VAL  86  -5.149  -5.705  -5.705
  674   3HG1  VAL  86          3HG1      VAL  86  -3.629  -5.036  -5.036
  675   1HG2  VAL  86          3HG2      VAL  86  -5.084  -5.792  -5.792
  676   2HG2  VAL  86          2HG2      VAL  86  -3.326  -5.919  -5.919
  677   3HG2  VAL  86          1HG2      VAL  86  -4.217  -6.706  -6.706
  678    H    ILE  87           H        ILE  87  -6.778  -2.172  -2.172
  679    HA   ILE  87           HA       ILE  87  -8.970  -3.408  -3.408
  680    HB   ILE  87           HB       ILE  87 -10.360  -2.299  -2.299
  681   1HG1  ILE  87          2HG1      ILE  87  -8.077  -0.740  -0.740
  682   2HG1  ILE  87          1HG1      ILE  87  -8.104  -2.420  -2.420
  683   1HG2  ILE  87          1HG2      ILE  87  -9.706  -1.177  -1.177
  684   2HG2  ILE  87          3HG2      ILE  87  -8.311  -0.491  -0.491
  685   3HG2  ILE  87          2HG2      ILE  87  -9.943  -0.053  -0.053
  686   1HD1  ILE  87          1HD1      ILE  87 -10.536  -0.700  -0.700
  687   2HD1  ILE  87          3HD1      ILE  87  -9.253  -0.645  -0.645
  688   3HD1  ILE  87          2HD1      ILE  87 -10.105  -2.157  -2.157
  689    H    GLU  88           H        GLU  88 -10.574  -4.787  -4.787
  690    HA   GLU  88           HA       GLU  88  -9.526  -6.636  -6.636
  691   1HB   GLU  88          2HB       GLU  88 -10.339  -7.339  -7.339
  692   2HB   GLU  88          1HB       GLU  88 -11.944  -7.199  -7.199
  693   1HG   GLU  88          2HG       GLU  88 -11.316  -8.810  -8.810
  694   2HG   GLU  88          1HG       GLU  88  -9.721  -8.965  -8.965
  695    H    HIS  89           H        HIS  89 -10.122  -4.967  -4.967
  696    HA   HIS  89           HA       HIS  89 -12.687  -4.080  -4.080
  697   1HB   HIS  89          2HB       HIS  89 -10.319  -3.651  -3.651
  698   2HB   HIS  89          1HB       HIS  89 -10.966  -4.799  -4.799
  699    HD1  HIS  89           HD1      HIS  89 -12.345  -3.810  -3.810
  700    HD2  HIS  89           HD2      HIS  89 -12.166  -1.354  -1.354
  701    HE1  HIS  89           HE1      HIS  89 -13.577  -1.712  -1.712
  702    HE2  HIS  89           HE2      HIS  89 -13.528  -0.274  -0.274
  703    HA   PRO  90           HA       PRO  90 -14.734  -7.833  -7.833
  704   1HB   PRO  90          2HB       PRO  90 -17.066  -6.773  -6.773
  705   2HB   PRO  90          1HB       PRO  90 -16.613  -6.824  -6.824
  706   1HG   PRO  90          2HG       PRO  90 -16.450  -4.546  -4.546
  707   2HG   PRO  90          1HG       PRO  90 -17.001  -4.544  -4.544
  708   1HD   PRO  90          2HD       PRO  90 -14.502  -3.747  -3.747
  709   2HD   PRO  90          1HD       PRO  90 -14.866  -4.411  -4.411
  710    H    GLU  91           H        GLU  91 -13.988  -5.183  -5.183
  711    HA   GLU  91           HA       GLU  91 -14.940  -6.425  -6.425
  712   1HB   GLU  91          2HB       GLU  91 -14.134  -3.832  -3.832
  713   2HB   GLU  91          1HB       GLU  91 -13.078  -4.317  -4.317
  714   1HG   GLU  91          2HG       GLU  91 -14.967  -3.119  -3.119
  715   2HG   GLU  91          1HG       GLU  91 -15.051  -4.805  -4.805
  716    H    TYR  92           H        TYR  92 -12.041  -6.386  -6.386
  717    HA   TYR  92           HA       TYR  92 -10.662  -7.876  -7.876
  718   1HB   TYR  92          2HB       TYR  92  -9.126  -6.351  -6.351
  719   2HB   TYR  92          1HB       TYR  92  -8.650  -6.805  -6.805
  720    HD1  TYR  92           HD2      TYR  92 -10.703  -5.780  -5.780
  721    HD2  TYR  92           HD1      TYR  92  -9.085  -4.043  -4.043
  722    HE1  TYR  92           HE2      TYR  92 -11.349  -3.553  -3.553
  723    HE2  TYR  92           HE1      TYR  92  -9.726  -1.809  -1.809
  724    HH   TYR  92           HH       TYR  92 -10.460  -1.096  -1.096
  725    H    GLY  93           H        GLY  93 -10.702  -7.328  -7.328
  726   1HA   GLY  93          2HA       GLY  93 -11.007  -9.095  -9.095
  727   2HA   GLY  93          1HA       GLY  93 -10.412 -10.228 -10.228
  728    H    GLU  94           H        GLU  94  -9.615  -8.223  -8.223
  729    HA   GLU  94           HA       GLU  94  -7.721  -7.950  -7.950
  730   1HB   GLU  94          2HB       GLU  94  -7.700 -10.557 -10.557
  731   2HB   GLU  94          1HB       GLU  94  -6.189 -10.029 -10.029
  732   1HG   GLU  94          2HG       GLU  94  -5.647 -10.831 -10.831
  733   2HG   GLU  94          1HG       GLU  94  -5.579  -9.073  -9.073
  734    H    VAL  95           H        VAL  95  -7.414  -5.911  -5.911
  735    HA   VAL  95           HA       VAL  95  -4.982  -5.882  -5.882
  736    HB   VAL  95           HB       VAL  95  -5.944  -3.879  -3.879
  737   1HG1  VAL  95          1HG1      VAL  95  -7.069  -6.641  -6.641
  738   2HG1  VAL  95          3HG1      VAL  95  -7.432  -5.331  -5.331
  739   3HG1  VAL  95          2HG1      VAL  95  -5.764  -5.858  -5.858
  740   1HG2  VAL  95          1HG2      VAL  95  -7.877  -3.890  -3.890
  741   2HG2  VAL  95          3HG2      VAL  95  -8.110  -3.235  -3.235
  742   3HG2  VAL  95          2HG2      VAL  95  -8.672  -4.862  -4.862
  743    H    ILE  96           H        ILE  96  -3.547  -4.246  -4.246
  744    HA   ILE  96           HA       ILE  96  -3.908  -2.883  -2.883
  745    HB   ILE  96           HB       ILE  96  -1.639  -3.317  -3.317
  746   1HG1  ILE  96          2HG1      ILE  96  -2.243  -4.633  -4.633
  747   2HG1  ILE  96          1HG1      ILE  96  -0.562  -4.161  -4.161
  748   1HG2  ILE  96          1HG2      ILE  96  -1.924  -0.884  -0.884
  749   2HG2  ILE  96          3HG2      ILE  96  -0.336  -1.619  -1.619
  750   3HG2  ILE  96          2HG2      ILE  96  -1.250  -1.045  -1.045
  751   1HD1  ILE  96          1HD1      ILE  96  -0.987  -2.217  -2.217
  752   2HD1  ILE  96          3HD1      ILE  96  -2.592  -2.874  -2.874
  753   3HD1  ILE  96          2HD1      ILE  96  -1.159  -3.788  -3.788
  754    H    GLN  97           H        GLN  97  -4.353  -0.753  -0.753
  755    HA   GLN  97           HA       GLN  97  -4.610   0.904   0.904
  756   1HB   GLN  97          2HB       GLN  97  -6.772   0.031   0.031
  757   2HB   GLN  97          1HB       GLN  97  -6.424   1.267   1.267
  758   1HG   GLN  97          2HG       GLN  97  -6.722   3.003   3.003
  759   2HG   GLN  97          1HG       GLN  97  -6.542   1.939   1.939
  760   1HE2  GLN  97          2HE2      GLN  97 -10.038   1.418   1.418
  761   2HE2  GLN  97          1HE2      GLN  97  -8.519   1.411   1.411
  762    H    LEU  98           H        LEU  98  -3.282   2.544   2.544
  763    HA   LEU  98           HA       LEU  98  -2.335   3.618   3.618
  764   1HB   LEU  98          2HB       LEU  98  -1.298   4.398   4.398
  765   2HB   LEU  98          1HB       LEU  98  -0.493   4.497   4.497
  766    HG   LEU  98           HG       LEU  98  -1.221   1.786   1.786
  767   1HD1  LEU  98          2HD1      LEU  98  -0.062   3.408   3.408
  768   2HD1  LEU  98          1HD1      LEU  98   1.356   2.757   2.757
  769   3HD1  LEU  98          3HD1      LEU  98   0.183   1.664   1.664
  770   1HD2  LEU  98          2HD2      LEU  98   0.103   2.683   2.683
  771   2HD2  LEU  98          1HD2      LEU  98   0.432   1.120   1.120
  772   3HD2  LEU  98          3HD2      LEU  98   1.454   2.509   2.509
  773    H    GLN  99           H        GLN  99  -2.186   5.945   5.945
  774    HA   GLN  99           HA       GLN  99  -4.583   7.243   7.243
  775   1HB   GLN  99          2HB       GLN  99  -2.984   7.436   7.436
  776   2HB   GLN  99          1HB       GLN  99  -3.019   9.019   9.019
  777   1HG   GLN  99          2HG       GLN  99  -5.617   7.668   7.668
  778   2HG   GLN  99          1HG       GLN  99  -4.888   8.098   8.098
  779   1HE2  GLN  99          2HE2      GLN  99  -6.788  10.852  10.852
  780   2HE2  GLN  99          1HE2      GLN  99  -6.916   9.145   9.145
  781    H    GLY 100           H        GLY 100  -4.677   9.002   9.002
  782   1HA   GLY 100          2HA       GLY 100  -3.913  10.741  10.741
  783   2HA   GLY 100          1HA       GLY 100  -2.279  10.413  10.413
  784    H    ASP 101           H        ASP 101  -2.317  10.984  10.984
  785    HA   ASP 101           HA       ASP 101  -2.818   8.691   8.691
  786   1HB   ASP 101          2HB       ASP 101  -1.764  10.146  10.146
  787   2HB   ASP 101          1HB       ASP 101  -3.198  10.821  10.821
  788    H    GLN 102           H        GLN 102  -1.448   7.155   7.155
  789    HA   GLN 102           HA       GLN 102   1.425   7.618   7.618
  790   1HB   GLN 102          2HB       GLN 102  -0.363   5.815   5.815
  791   2HB   GLN 102          1HB       GLN 102   1.152   5.090   5.090
  792   1HG   GLN 102          2HG       GLN 102   1.119   6.123   6.123
  793   2HG   GLN 102          1HG       GLN 102   2.431   6.621   6.621
  794   1HE2  GLN 102          2HE2      GLN 102  -0.575   9.363   9.363
  795   2HE2  GLN 102          1HE2      GLN 102  -0.914   7.714   7.714
  796    H    ARG 103           H        ARG 103  -0.669   6.867   6.867
  797    HA   ARG 103           HA       ARG 103  -0.129   4.400   4.400
  798   1HB   ARG 103          2HB       ARG 103  -0.606   5.416   5.416
  799   2HB   ARG 103          1HB       ARG 103  -1.781   5.855   5.855
  800   1HG   ARG 103          2HG       ARG 103  -0.710   8.021   8.021
  801   2HG   ARG 103          1HG       ARG 103   0.505   7.581   7.581
  802   1HD   ARG 103          2HD       ARG 103  -0.915   7.870   7.870
  803   2HD   ARG 103          1HD       ARG 103  -2.317   7.313   7.313
  804    HE   ARG 103           HE       ARG 103  -2.732   9.480   9.480
  805   1HH1  ARG 103          2HH1      ARG 103   0.441   9.294   9.294
  806   2HH1  ARG 103          1HH1      ARG 103   0.647  11.011  11.011
  807   1HH2  ARG 103          1HH2      ARG 103  -2.463  11.739  11.739
  808   2HH2  ARG 103          2HH2      ARG 103  -1.001  12.399  12.399
  809    H    LYS 104           H        LYS 104   1.972   7.148   7.148
  810    HA   LYS 104           HA       LYS 104   3.918   5.870   5.870
  811   1HB   LYS 104          2HB       LYS 104   3.234   8.319   8.319
  812   2HB   LYS 104          1HB       LYS 104   4.145   8.618   8.618
  813   1HG   LYS 104          2HG       LYS 104   5.524   9.136   9.136
  814   2HG   LYS 104          1HG       LYS 104   6.154   7.683   7.683
  815   1HD   LYS 104          2HD       LYS 104   6.155   7.453   7.453
  816   2HD   LYS 104          1HD       LYS 104   5.054   6.295   6.295
  817   1HE   LYS 104          2HE       LYS 104   4.216   7.510   7.510
  818   2HE   LYS 104          1HE       LYS 104   3.156   7.508   7.508
  819   1HZ   LYS 104          1HZ       LYS 104   5.003   9.736   9.736
  820   2HZ   LYS 104          3HZ       LYS 104   3.384   9.694   9.694
  821   3HZ   LYS 104          2HZ       LYS 104   3.768   9.728   9.728
  822    H    ASN 105           H        ASN 105   3.274   6.538   6.538
  823    HA   ASN 105           HA       ASN 105   6.049   6.154   6.154
  824   1HB   ASN 105          2HB       ASN 105   3.521   6.961   6.961
  825   2HB   ASN 105          1HB       ASN 105   4.781   6.216   6.216
  826   1HD2  ASN 105          2HD2      ASN 105   5.010  10.057  10.057
  827   2HD2  ASN 105          1HD2      ASN 105   3.601   9.073   9.073
  828    H    ILE 106           H        ILE 106   2.945   4.454   4.454
  829    HA   ILE 106           HA       ILE 106   3.825   2.332   2.332
  830    HB   ILE 106           HB       ILE 106   1.444   2.819   2.819
  831   1HG1  ILE 106          2HG1      ILE 106   0.721   0.508   0.508
  832   2HG1  ILE 106          1HG1      ILE 106   2.247  -0.008  -0.008
  833   1HG2  ILE 106          3HG2      ILE 106   1.850   3.111   3.111
  834   2HG2  ILE 106          2HG2      ILE 106   1.791   1.353   1.353
  835   3HG2  ILE 106          1HG2      ILE 106   0.388   2.250   2.250
  836   1HD1  ILE 106          3HD1      ILE 106   2.638   1.457   1.457
  837   2HD1  ILE 106          2HD1      ILE 106   1.599   0.049   0.049
  838   3HD1  ILE 106          1HD1      ILE 106   3.211  -0.143  -0.143
  839    H    CYS 107           H        CYS 107   3.630   2.549   2.549
  840    HA   CYS 107           HA       CYS 107   4.655  -0.006  -0.006
  841   1HB   CYS 107          2HB       CYS 107   5.315   0.953   0.953
  842   2HB   CYS 107          1HB       CYS 107   3.648   1.310   1.310
  843    HG   CYS 107           HG       CYS 107   4.564   3.750   3.750
  844    H    GLN 108           H        GLN 108   6.147   3.038   3.038
  845    HA   GLN 108           HA       GLN 108   8.843   2.256   2.256
  846   1HB   GLN 108          2HB       GLN 108   8.633   4.547   4.547
  847   2HB   GLN 108          1HB       GLN 108   7.431   4.564   4.564
  848   1HG   GLN 108          2HG       GLN 108   9.077   5.439   5.439
  849   2HG   GLN 108          1HG       GLN 108   9.625   3.772   3.772
  850   1HE2  GLN 108          2HE2      GLN 108  12.462   4.155   4.155
  851   2HE2  GLN 108          1HE2      GLN 108  11.350   3.047   3.047
  852    H    PHE 109           H        PHE 109   6.636   2.109   2.109
  853    HA   PHE 109           HA       PHE 109   8.579   1.409   1.409
  854   1HB   PHE 109          2HB       PHE 109   6.471   2.410   2.410
  855   2HB   PHE 109          1HB       PHE 109   5.571   1.087   1.087
  856    HD1  PHE 109           HD2      PHE 109   8.184   1.704   1.704
  857    HD2  PHE 109           HD1      PHE 109   4.869  -0.656  -0.656
  858    HE1  PHE 109           HE2      PHE 109   8.250   0.489   0.489
  859    HE2  PHE 109           HE1      PHE 109   4.929  -1.876  -1.876
  860    HZ   PHE 109           HZ       PHE 109   6.621  -1.303  -1.303
  861    H    LEU 110           H        LEU 110   6.286  -0.391  -0.391
  862    HA   LEU 110           HA       LEU 110   6.712  -2.938  -2.938
  863   1HB   LEU 110          2HB       LEU 110   5.690  -1.843  -1.843
  864   2HB   LEU 110          1HB       LEU 110   6.150  -3.533  -3.533
  865    HG   LEU 110           HG       LEU 110   4.476  -4.110  -4.110
  866   1HD1  LEU 110          1HD1      LEU 110   4.328  -1.179  -1.179
  867   2HD1  LEU 110          3HD1      LEU 110   3.105  -2.342  -2.342
  868   3HD1  LEU 110          2HD1      LEU 110   4.770  -2.514  -2.514
  869   1HD2  LEU 110          1HD2      LEU 110   3.695  -3.370  -3.370
  870   2HD2  LEU 110          3HD2      LEU 110   2.471  -3.444  -3.444
  871   3HD2  LEU 110          2HD2      LEU 110   3.143  -1.889  -1.889
  872    H    VAL 111           H        VAL 111   8.600  -1.038  -1.038
  873    HA   VAL 111           HA       VAL 111  10.320  -3.301  -3.301
  874    HB   VAL 111           HB       VAL 111  10.506  -0.427  -0.427
  875   1HG1  VAL 111          1HG1      VAL 111  12.102  -2.865  -2.865
  876   2HG1  VAL 111          3HG1      VAL 111  11.777  -1.787  -1.787
  877   3HG1  VAL 111          2HG1      VAL 111  12.603  -1.176  -1.176
  878   1HG2  VAL 111          3HG2      VAL 111   8.420  -1.643  -1.643
  879   2HG2  VAL 111          2HG2      VAL 111   9.425  -1.087  -1.087
  880   3HG2  VAL 111          1HG2      VAL 111   9.447  -2.787  -2.787
  881    H    GLU 112           H        GLU 112  10.258  -0.484  -0.484
  882    HA   GLU 112           HA       GLU 112  13.074  -0.386  -0.386
  883   1HB   GLU 112          2HB       GLU 112  10.682   0.866   0.866
  884   2HB   GLU 112          1HB       GLU 112  12.297   1.045   1.045
  885   1HG   GLU 112          2HG       GLU 112  12.132   1.653   1.653
  886   2HG   GLU 112          1HG       GLU 112  11.141   2.701   2.701
  887    H    ILE 113           H        ILE 113  10.337  -1.984  -1.984
  888    HA   ILE 113           HA       ILE 113  12.020  -2.969  -2.969
  889    HB   ILE 113           HB       ILE 113  10.034  -3.685  -3.685
  890   1HG1  ILE 113          2HG1      ILE 113   8.615  -3.111  -3.111
  891   2HG1  ILE 113          1HG1      ILE 113   8.839  -4.684  -4.684
  892   1HG2  ILE 113          1HG2      ILE 113  10.583  -1.126  -1.126
  893   2HG2  ILE 113          3HG2      ILE 113   9.010  -1.159  -1.159
  894   3HG2  ILE 113          2HG2      ILE 113   9.153  -1.645  -1.645
  895   1HD1  ILE 113          2HD1      ILE 113   7.525  -2.958  -2.958
  896   2HD1  ILE 113          1HD1      ILE 113   6.688  -2.900  -2.900
  897   3HD1  ILE 113          3HD1      ILE 113   6.942  -4.447  -4.447
  898    H    GLY 114           H        GLY 114  10.547  -3.993  -3.993
  899   1HA   GLY 114          2HA       GLY 114  11.259  -5.936  -5.936
  900   2HA   GLY 114          1HA       GLY 114  11.732  -6.650  -6.650
  901    H    LEU 115           H        LEU 115   8.672  -5.052  -5.052
  902    HA   LEU 115           HA       LEU 115   7.259  -7.433  -7.433
  903   1HB   LEU 115          2HB       LEU 115   6.827  -4.750  -4.750
  904   2HB   LEU 115          1HB       LEU 115   5.691  -5.140  -5.140
  905    HG   LEU 115           HG       LEU 115   4.541  -6.705  -6.705
  906   1HD1  LEU 115          1HD1      LEU 115   6.887  -6.375  -6.375
  907   2HD1  LEU 115          3HD1      LEU 115   5.325  -6.925  -6.925
  908   3HD1  LEU 115          2HD1      LEU 115   6.167  -7.855  -7.855
  909   1HD2  LEU 115          3HD2      LEU 115   4.506  -4.056  -4.056
  910   2HD2  LEU 115          2HD2      LEU 115   3.464  -5.194  -5.194
  911   3HD2  LEU 115          1HD2      LEU 115   4.946  -4.613  -4.613
  912    H    ALA 116           H        ALA 116   6.561  -5.189  -5.189
  913    HA   ALA 116           HA       ALA 116   5.581  -7.443  -7.443
  914   1HB   ALA 116          1HB       ALA 116   4.341  -5.196  -5.196
  915   2HB   ALA 116          3HB       ALA 116   5.457  -4.586  -4.586
  916   3HB   ALA 116          2HB       ALA 116   4.374  -5.922  -5.922
  917    H    LYS 117           H        LYS 117   6.152  -7.484  -7.484
  918    HA   LYS 117           HA       LYS 117   9.027  -7.123  -7.123
  919   1HB   LYS 117          2HB       LYS 117   7.118  -8.987  -8.987
  920   2HB   LYS 117          1HB       LYS 117   7.848  -8.178  -8.178
  921   1HG   LYS 117          2HG       LYS 117   9.232  -9.995  -9.995
  922   2HG   LYS 117          1HG       LYS 117  10.088  -8.708  -8.708
  923   1HD   LYS 117          2HD       LYS 117   8.283 -10.770 -10.770
  924   2HD   LYS 117          1HD       LYS 117  10.048 -10.776 -10.776
  925   1HE   LYS 117          2HE       LYS 117   9.854  -8.465  -8.465
  926   2HE   LYS 117          1HE       LYS 117   8.149  -8.847  -8.847
  927   1HZ   LYS 117          3HZ       LYS 117   9.262 -11.030 -11.030
  928   2HZ   LYS 117          2HZ       LYS 117  10.490  -9.918  -9.918
  929   3HZ   LYS 117          1HZ       LYS 117   8.926  -9.657  -9.657
  930    H    ASP 118           H        ASP 118   9.986  -6.005  -6.005
  931    HA   ASP 118           HA       ASP 118   8.854  -3.521  -3.521
  932   1HB   ASP 118          2HB       ASP 118  10.672  -3.220  -3.220
  933   2HB   ASP 118          1HB       ASP 118  11.279  -3.992  -3.992
  934    H    ASP 119           H        ASP 119   8.548  -6.599  -6.599
  935    HA   ASP 119           HA       ASP 119   7.392  -5.506  -5.506
  936   1HB   ASP 119          2HB       ASP 119   7.917  -8.280  -8.280
  937   2HB   ASP 119          1HB       ASP 119   6.851  -8.034  -8.034
  938    H    GLN 120           H        GLN 120   6.341  -6.612  -6.612
  939    HA   GLN 120           HA       GLN 120   3.596  -7.021  -7.021
  940   1HB   GLN 120          2HB       GLN 120   4.874  -6.852  -6.852
  941   2HB   GLN 120          1HB       GLN 120   3.205  -7.302  -7.302
  942   1HG   GLN 120          2HG       GLN 120   4.023  -9.238  -9.238
  943   2HG   GLN 120          1HG       GLN 120   5.667  -8.812  -8.812
  944   1HE2  GLN 120          2HE2      GLN 120   3.125  -9.938  -9.938
  945   2HE2  GLN 120          1HE2      GLN 120   2.580  -8.910  -8.910
  946    H    LEU 121           H        LEU 121   5.521  -4.347  -4.347
  947    HA   LEU 121           HA       LEU 121   3.916  -2.659  -2.659
  948   1HB   LEU 121          2HB       LEU 121   5.732  -2.014  -2.014
  949   2HB   LEU 121          1HB       LEU 121   5.019  -0.799  -0.799
  950    HG   LEU 121           HG       LEU 121   6.767  -3.004  -3.004
  951   1HD1  LEU 121          1HD1      LEU 121   7.510  -0.401  -0.401
  952   2HD1  LEU 121          3HD1      LEU 121   8.459  -1.019  -1.019
  953   3HD1  LEU 121          2HD1      LEU 121   8.298  -1.973  -1.973
  954   1HD2  LEU 121          1HD2      LEU 121   5.132  -1.176  -1.176
  955   2HD2  LEU 121          3HD2      LEU 121   6.475  -2.052  -2.052
  956   3HD2  LEU 121          2HD2      LEU 121   6.729  -0.430  -0.430
  957    H    LYS 122           H        LYS 122   1.742  -2.910  -2.910
  958    HA   LYS 122           HA       LYS 122   0.851  -1.978  -1.978
  959   1HB   LYS 122          2HB       LYS 122  -0.132  -4.038  -4.038
  960   2HB   LYS 122          1HB       LYS 122  -1.379  -3.053  -3.053
  961   1HG   LYS 122          2HG       LYS 122   0.764  -4.528  -4.528
  962   2HG   LYS 122          1HG       LYS 122  -0.869  -5.139  -5.139
  963   1HD   LYS 122          2HD       LYS 122  -1.740  -3.851  -3.851
  964   2HD   LYS 122          1HD       LYS 122  -0.816  -2.437  -2.437
  965   1HE   LYS 122          2HE       LYS 122   1.193  -3.534  -3.534
  966   2HE   LYS 122          1HE       LYS 122   0.057  -4.674  -4.674
  967   1HZ   LYS 122          1HZ       LYS 122  -0.272  -1.751  -1.751
  968   2HZ   LYS 122          3HZ       LYS 122   0.694  -2.652  -2.652
  969   3HZ   LYS 122          2HZ       LYS 122  -0.958  -2.987  -2.987
  970    H    VAL 123           H        VAL 123   1.068   0.233   0.233
  971    HA   VAL 123           HA       VAL 123  -0.599   1.235   1.235
  972    HB   VAL 123           HB       VAL 123   1.667   2.147   2.147
  973   1HG1  VAL 123          3HG1      VAL 123   1.207   2.060   2.060
  974   2HG1  VAL 123          2HG1      VAL 123   1.044   3.783   3.783
  975   3HG1  VAL 123          1HG1      VAL 123   2.528   2.935   2.935
  976   1HG2  VAL 123          1HG2      VAL 123  -0.309   3.491   3.491
  977   2HG2  VAL 123          3HG2      VAL 123   1.116   4.400   4.400
  978   3HG2  VAL 123          2HG2      VAL 123  -0.294   4.319   4.319
  979    H    HIS 124           H        HIS 124  -2.658   1.732   1.732
  980    HA   HIS 124           HA       HIS 124  -3.377   2.803   2.803
  981   1HB   HIS 124          2HB       HIS 124  -5.168   1.130   1.130
  982   2HB   HIS 124          1HB       HIS 124  -5.504   1.680   1.680
  983    HD1  HIS 124           HD1      HIS 124  -4.813   0.165   0.165
  984    HD2  HIS 124           HD2      HIS 124  -3.037  -0.853  -0.853
  985    HE1  HIS 124           HE1      HIS 124  -3.627  -2.010  -2.010
  986    HE2  HIS 124           HE2      HIS 124  -2.716  -2.688  -2.688
  987    H    GLY 125           H        GLY 125  -3.067   4.938   4.938
  988   1HA   GLY 125          2HA       GLY 125  -4.262   5.988   5.988
  989   2HA   GLY 125          1HA       GLY 125  -3.858   6.918   6.918
  990    H    PHE 126           HN       PHE 126  -6.318   6.135   6.135
  991    HA   PHE 126           HA       PHE 126  -8.512   5.471   5.471
  992   1HB   PHE 126          2HB       PHE 126  -9.814   6.240   6.240
  993   2HB   PHE 126          1HB       PHE 126  -8.254   6.029   6.029
  994    HD1  PHE 126           HD2      PHE 126  -6.731   8.331   8.331
  995    HD2  PHE 126           HD1      PHE 126 -10.940   8.044   8.044
  996    HE1  PHE 126           HE2      PHE 126  -6.789  10.679  10.679
  997    HE2  PHE 126           HE1      PHE 126 -11.006  10.392  10.392
  998    HZ   PHE 126           HZ       PHE 126  -8.929  11.712  11.712

  Start of MODEL    3
    1   1H    MET   1          2H        MET   1  36.994  17.600  17.600
    2   2H    MET   1          1H        MET   1  38.414  18.178  18.178
    3   3H    MET   1          3H        MET   1  37.035  19.187  19.187
    4    HA   MET   1           HA       MET   1  35.855  18.000  18.000
    5   1HB   MET   1          2HB       MET   1  38.769  18.277  18.277
    6   2HB   MET   1          1HB       MET   1  37.620  17.683  17.683
    7   1HG   MET   1          2HG       MET   1  36.517  19.701  19.701
    8   2HG   MET   1          1HG       MET   1  37.076  20.236  20.236
    9   1HE   MET   1          1HE       MET   1  38.384  18.908  18.908
   10   2HE   MET   1          3HE       MET   1  39.751  19.944  19.944
   11   3HE   MET   1          2HE       MET   1  39.918  18.720  18.720
   12    H    ARG   2           H        ARG   2  35.001  16.037  16.037
   13    HA   ARG   2           HA       ARG   2  36.705  13.689  13.689
   14   1HB   ARG   2          2HB       ARG   2  36.190  13.872  13.872
   15   2HB   ARG   2          1HB       ARG   2  34.470  13.935  13.935
   16   1HG   ARG   2          2HG       ARG   2  34.785  11.651  11.651
   17   2HG   ARG   2          1HG       ARG   2  36.354  11.618  11.618
   18   1HD   ARG   2          2HD       ARG   2  35.092  12.108  12.108
   19   2HD   ARG   2          1HD       ARG   2  33.619  11.755  11.755
   20    HE   ARG   2           HE       ARG   2  35.149   9.575   9.575
   21   1HH1  ARG   2          2HH1      ARG   2  34.187  11.239  11.239
   22   2HH1  ARG   2          1HH1      ARG   2  34.218   9.809   9.809
   23   1HH2  ARG   2          1HH2      ARG   2  35.190   7.694   7.694
   24   2HH2  ARG   2          2HH2      ARG   2  34.789   7.797   7.797
   25    H    GLY   3           H        GLY   3  36.094  12.721  12.721
   26   1HA   GLY   3          2HA       GLY   3  33.691  13.217  13.217
   27   2HA   GLY   3          1HA       GLY   3  34.779  11.875  11.875
   28    H    SER   4           H        SER   4  32.525  10.973  10.973
   29    HA   SER   4           HA       SER   4  31.810   9.260   9.260
   30   1HB   SER   4          2HB       SER   4  29.481   9.878   9.878
   31   2HB   SER   4          1HB       SER   4  30.452  11.326  11.326
   32    HG   SER   4           HG       SER   4  30.113  11.741  11.741
   33    H    HIS   5           H        HIS   5  31.644   7.322   7.322
   34    HA   HIS   5           HA       HIS   5  30.199   7.026   7.026
   35   1HB   HIS   5          2HB       HIS   5  31.934   5.438   5.438
   36   2HB   HIS   5          1HB       HIS   5  32.522   7.091   7.091
   37    HD1  HIS   5           HD1      HIS   5  32.863   3.691   3.691
   38    HD2  HIS   5           HD2      HIS   5  34.548   7.475   7.475
   39    HE1  HIS   5           HE1      HIS   5  34.906   3.393   3.393
   40    HE2  HIS   5           HE2      HIS   5  35.866   5.709   5.709
   41    H    HIS   6           H        HIS   6  28.532   5.783   5.783
   42    HA   HIS   6           HA       HIS   6  28.835   3.103   3.103
   43   1HB   HIS   6          2HB       HIS   6  27.612   3.428   3.428
   44   2HB   HIS   6          1HB       HIS   6  29.363   3.564   3.564
   45    HD1  HIS   6           HD1      HIS   6  29.899   5.284   5.284
   46    HD2  HIS   6           HD2      HIS   6  26.745   6.442   6.442
   47    HE1  HIS   6           HE1      HIS   6  29.380   7.656   7.656
   48    HE2  HIS   6           HE2      HIS   6  27.530   8.366   8.366
   49    H    HIS   7           H        HIS   7  27.362   2.873   2.873
   50    HA   HIS   7           HA       HIS   7  24.674   3.968   3.968
   51   1HB   HIS   7          2HB       HIS   7  26.281   3.265   3.265
   52   2HB   HIS   7          1HB       HIS   7  24.623   2.677   2.677
   53    HD1  HIS   7           HD1      HIS   7  24.587   4.494   4.494
   54    HD2  HIS   7           HD2      HIS   7  24.725   5.996   5.996
   55    HE1  HIS   7           HE1      HIS   7  23.860   6.893   6.893
   56    HE2  HIS   7           HE2      HIS   7  23.865   7.756   7.756
   57    H    HIS   8           H        HIS   8  23.126   2.723   2.723
   58    HA   HIS   8           HA       HIS   8  23.569  -0.152  -0.152
   59   1HB   HIS   8          2HB       HIS   8  22.753   1.466   1.466
   60   2HB   HIS   8          1HB       HIS   8  21.177   1.237   1.237
   61    HD1  HIS   8           HD1      HIS   8  21.297   0.229   0.229
   62    HD2  HIS   8           HD2      HIS   8  22.560  -2.096  -2.096
   63    HE1  HIS   8           HE1      HIS   8  21.184  -2.149  -2.149
   64    HE2  HIS   8           HE2      HIS   8  21.868  -3.543  -3.543
   65    H    HIS   9           H        HIS   9  23.218  -0.568  -0.568
   66    HA   HIS   9           HA       HIS   9  20.398  -1.008  -1.008
   67   1HB   HIS   9          2HB       HIS   9  21.570   1.219   1.219
   68   2HB   HIS   9          1HB       HIS   9  21.875   0.039   0.039
   69    HD1  HIS   9           HD1      HIS   9  19.183   2.040   2.040
   70    HD2  HIS   9           HD2      HIS   9  19.539  -0.979  -0.979
   71    HE1  HIS   9           HE1      HIS   9  16.963   1.960   1.960
   72    HE2  HIS   9           HE2      HIS   9  17.171   0.061   0.061
   73    H    HIS  10           H        HIS  10  22.621  -2.724  -2.724
   74    HA   HIS  10           HA       HIS  10  22.305  -4.665  -4.665
   75   1HB   HIS  10          2HB       HIS  10  24.114  -3.227  -3.227
   76   2HB   HIS  10          1HB       HIS  10  25.095  -3.597  -3.597
   77    HD1  HIS  10           HD1      HIS  10  24.920  -4.531  -4.531
   78    HD2  HIS  10           HD2      HIS  10  25.132  -6.715  -6.715
   79    HE1  HIS  10           HE1      HIS  10  25.796  -6.793  -6.793
   80    HE2  HIS  10           HE2      HIS  10  26.004  -8.066  -8.066
   81    H    THR  11           H        THR  11  24.528  -3.797  -3.797
   82    HA   THR  11           HA       THR  11  25.176  -4.907  -4.907
   83    HB   THR  11           HB       THR  11  22.603  -6.422  -6.422
   84    HG1  THR  11           HG1      THR  11  21.928  -4.491  -4.491
   85   1HG2  THR  11          1HG2      THR  11  24.649  -6.941  -6.941
   86   2HG2  THR  11          3HG2      THR  11  23.211  -6.333  -6.333
   87   3HG2  THR  11          2HG2      THR  11  23.098  -7.749  -7.749
   88    H    ASP  12           H        ASP  12  23.600  -7.702  -7.702
   89    HA   ASP  12           HA       ASP  12  25.754  -8.827  -8.827
   90   1HB   ASP  12          2HB       ASP  12  25.931  -9.077  -9.077
   91   2HB   ASP  12          1HB       ASP  12  26.001 -10.628 -10.628
   92    HA   PRO  13           HA       PRO  13  22.299 -11.356 -11.356
   93   1HB   PRO  13          2HB       PRO  13  24.447 -13.264 -13.264
   94   2HB   PRO  13          1HB       PRO  13  23.094 -12.639 -12.639
   95   1HG   PRO  13          2HG       PRO  13  25.566 -11.741 -11.741
   96   2HG   PRO  13          1HG       PRO  13  24.176 -10.642 -10.642
   97   1HD   PRO  13          2HD       PRO  13  26.216 -10.997 -10.997
   98   2HD   PRO  13          1HD       PRO  13  25.410  -9.517  -9.517
   99    H    MET  14           H        MET  14  24.962 -12.555 -12.555
  100    HA   MET  14           HA       MET  14  23.883 -15.035 -15.035
  101   1HB   MET  14          2HB       MET  14  25.636 -13.302 -13.302
  102   2HB   MET  14          1HB       MET  14  25.502 -15.056 -15.056
  103   1HG   MET  14          2HG       MET  14  26.414 -15.044 -15.044
  104   2HG   MET  14          1HG       MET  14  26.761 -13.331 -13.331
  105   1HE   MET  14          2HE       MET  14  27.926 -12.403 -12.403
  106   2HE   MET  14          1HE       MET  14  28.245 -13.374 -13.374
  107   3HE   MET  14          3HE       MET  14  29.564 -12.962 -12.962
  108    H    SER  15           H        SER  15  23.194 -11.805 -11.805
  109    HA   SER  15           HA       SER  15  21.928 -12.523 -12.523
  110   1HB   SER  15          2HB       SER  15  21.564 -10.014 -10.014
  111   2HB   SER  15          1HB       SER  15  21.131 -10.218 -10.218
  112    HG   SER  15           HG       SER  15  23.743 -10.334 -10.334
  113    H    ALA  16           H        ALA  16  20.818 -12.002 -12.002
  114    HA   ALA  16           HA       ALA  16  18.124 -12.868 -12.868
  115   1HB   ALA  16          2HB       ALA  16  18.576 -10.532 -10.532
  116   2HB   ALA  16          1HB       ALA  16  18.585 -11.476 -11.476
  117   3HB   ALA  16          3HB       ALA  16  17.161 -11.482 -11.482
  118    H    ILE  17           H        ILE  17  19.000 -15.074 -15.074
  119    HA   ILE  17           HA       ILE  17  19.360 -16.021 -16.021
  120    HB   ILE  17           HB       ILE  17  19.831 -17.620 -17.620
  121   1HG1  ILE  17          2HG1      ILE  17  21.933 -16.137 -16.137
  122   2HG1  ILE  17          1HG1      ILE  17  21.214 -15.501 -15.501
  123   1HG2  ILE  17          2HG2      ILE  17  20.334 -18.000 -18.000
  124   2HG2  ILE  17          1HG2      ILE  17  21.494 -18.677 -18.677
  125   3HG2  ILE  17          3HG2      ILE  17  19.799 -19.158 -19.158
  126   1HD1  ILE  17          2HD1      ILE  17  22.300 -18.224 -18.224
  127   2HD1  ILE  17          1HD1      ILE  17  23.480 -16.940 -16.940
  128   3HD1  ILE  17          3HD1      ILE  17  22.405 -16.869 -16.869
  129    H    GLN  18           H        GLN  18  18.330 -18.074 -18.074
  130    HA   GLN  18           HA       GLN  18  15.570 -18.034 -18.034
  131   1HB   GLN  18          2HB       GLN  18  15.569 -20.252 -20.252
  132   2HB   GLN  18          1HB       GLN  18  16.667 -19.157 -19.157
  133   1HG   GLN  18          2HG       GLN  18  18.282 -20.643 -20.643
  134   2HG   GLN  18          1HG       GLN  18  18.179 -20.465 -20.465
  135   1HE2  GLN  18          2HE2      GLN  18  17.014 -23.667 -23.667
  136   2HE2  GLN  18          1HE2      GLN  18  17.777 -22.242 -22.242
  137    H    ASN  19           H        ASN  19  14.313 -18.558 -18.558
  138    HA   ASN  19           HA       ASN  19  15.374 -20.382 -20.382
  139   1HB   ASN  19          2HB       ASN  19  13.573 -17.997 -17.997
  140   2HB   ASN  19          1HB       ASN  19  13.395 -19.260 -19.260
  141   1HD2  ASN  19          2HD2      ASN  19  16.602 -16.772 -16.772
  142   2HD2  ASN  19          1HD2      ASN  19  15.503 -16.826 -16.826
  143    H    LEU  20           H        LEU  20  14.316 -21.540 -21.540
  144    HA   LEU  20           HA       LEU  20  11.548 -22.146 -22.146
  145   1HB   LEU  20          2HB       LEU  20  13.795 -23.442 -23.442
  146   2HB   LEU  20          1HB       LEU  20  12.148 -24.041 -24.041
  147    HG   LEU  20           HG       LEU  20  12.956 -21.248 -21.248
  148   1HD1  LEU  20          3HD1      LEU  20  12.849 -23.804 -23.804
  149   2HD1  LEU  20          2HD1      LEU  20  12.267 -22.345 -22.345
  150   3HD1  LEU  20          1HD1      LEU  20  13.920 -22.417 -22.417
  151   1HD2  LEU  20          1HD2      LEU  20  10.389 -22.806 -22.806
  152   2HD2  LEU  20          3HD2      LEU  20  10.668 -21.304 -21.304
  153   3HD2  LEU  20          2HD2      LEU  20  10.708 -21.313 -21.313
  154    H    HIS  21           H        HIS  21  10.567 -24.079 -24.079
  155    HA   HIS  21           HA       HIS  21  12.176 -25.620 -25.620
  156   1HB   HIS  21          2HB       HIS  21  10.049 -26.054 -26.054
  157   2HB   HIS  21          1HB       HIS  21  10.425 -24.337 -24.337
  158    HD1  HIS  21           HD1      HIS  21   8.187 -23.257 -23.257
  159    HD2  HIS  21           HD2      HIS  21   8.465 -26.473 -26.473
  160    HE1  HIS  21           HE1      HIS  21   6.040 -23.247 -23.247
  161    HE2  HIS  21           HE2      HIS  21   6.270 -25.146 -25.146
  162    H    SER  22           H        SER  22  10.662 -27.768 -27.768
  163    HA   SER  22           HA       SER  22  10.051 -29.824 -29.824
  164   1HB   SER  22          2HB       SER  22   8.333 -28.503 -28.503
  165   2HB   SER  22          1HB       SER  22   9.446 -28.482 -28.482
  166    HG   SER  22           HG       SER  22   9.023 -30.522 -30.522
  167    H    PHE  23           H        PHE  23  11.683 -31.200 -31.200
  168    HA   PHE  23           HA       PHE  23  13.112 -31.430 -31.430
  169   1HB   PHE  23          2HB       PHE  23  14.255 -29.761 -29.761
  170   2HB   PHE  23          1HB       PHE  23  15.012 -31.296 -31.296
  171    HD1  PHE  23           HD2      PHE  23  15.251 -32.562 -32.562
  172    HD2  PHE  23           HD1      PHE  23  15.914 -28.531 -28.531
  173    HE1  PHE  23           HE2      PHE  23  16.828 -32.276 -32.276
  174    HE2  PHE  23           HE1      PHE  23  17.493 -28.237 -28.237
  175    HZ   PHE  23           HZ       PHE  23  17.953 -30.110 -30.110
  176    H    ASP  24           H        ASP  24  11.581 -33.332 -33.332
  177    HA   ASP  24           HA       ASP  24  13.056 -35.338 -35.338
  178   1HB   ASP  24          2HB       ASP  24  10.147 -35.465 -35.465
  179   2HB   ASP  24          1HB       ASP  24  10.981 -36.481 -36.481
  180    HA   PRO  25           HA       PRO  25  14.118 -37.587 -37.587
  181   1HB   PRO  25          2HB       PRO  25  13.435 -40.011 -40.011
  182   2HB   PRO  25          1HB       PRO  25  14.928 -39.609 -39.609
  183   1HG   PRO  25          2HG       PRO  25  14.806 -39.471 -39.471
  184   2HG   PRO  25          1HG       PRO  25  15.712 -38.267 -38.267
  185   1HD   PRO  25          2HD       PRO  25  13.035 -38.033 -38.033
  186   2HD   PRO  25          1HD       PRO  25  14.328 -36.825 -36.825
  187    H    PHE  26           H        PHE  26  11.168 -38.382 -38.382
  188    HA   PHE  26           HA       PHE  26   9.977 -39.362 -39.362
  189   1HB   PHE  26          2HB       PHE  26   8.810 -39.786 -39.786
  190   2HB   PHE  26          1HB       PHE  26   8.476 -40.677 -40.677
  191    HD1  PHE  26           HD1      PHE  26  11.064 -40.044 -40.044
  192    HD2  PHE  26           HD2      PHE  26   9.703 -42.593 -42.593
  193    HE1  PHE  26           HE1      PHE  26  12.747 -41.721 -41.721
  194    HE2  PHE  26           HE2      PHE  26  11.383 -44.275 -44.275
  195    HZ   PHE  26           HZ       PHE  26  12.908 -43.840 -43.840
  196    H    ALA  27           H        ALA  27  10.252 -36.612 -36.612
  197    HA   ALA  27           HA       ALA  27   7.598 -35.738 -35.738
  198   1HB   ALA  27          2HB       ALA  27   7.705 -36.021 -36.021
  199   2HB   ALA  27          1HB       ALA  27   8.751 -34.601 -34.601
  200   3HB   ALA  27          3HB       ALA  27   7.102 -34.487 -34.487
  201    H    ASP  28           H        ASP  28   8.516 -34.833 -34.833
  202    HA   ASP  28           HA       ASP  28   9.799 -32.263 -32.263
  203   1HB   ASP  28          2HB       ASP  28  11.611 -34.054 -34.054
  204   2HB   ASP  28          1HB       ASP  28  11.078 -34.203 -34.203
  205    H    ALA  29           H        ALA  29   9.240 -34.512 -34.512
  206    HA   ALA  29           HA       ALA  29   7.942 -32.316 -32.316
  207   1HB   ALA  29          2HB       ALA  29   9.915 -33.833 -33.833
  208   2HB   ALA  29          1HB       ALA  29   8.578 -34.897 -34.897
  209   3HB   ALA  29          3HB       ALA  29   8.641 -33.252 -33.252
  210    H    SER  30           H        SER  30   6.233 -33.268 -33.268
  211    HA   SER  30           HA       SER  30   4.620 -35.412 -35.412
  212   1HB   SER  30          2HB       SER  30   2.584 -33.781 -33.781
  213   2HB   SER  30          1HB       SER  30   3.686 -33.895 -33.895
  214    HG   SER  30           HG       SER  30   4.713 -32.015 -32.015
  215    H    LYS  31           H        LYS  31   3.730 -32.483 -32.483
  216    HA   LYS  31           HA       LYS  31   3.699 -33.972 -33.972
  217   1HB   LYS  31          2HB       LYS  31   1.375 -33.829 -33.829
  218   2HB   LYS  31          1HB       LYS  31   1.196 -32.502 -32.502
  219   1HG   LYS  31          2HG       LYS  31   1.875 -35.311 -35.311
  220   2HG   LYS  31          1HG       LYS  31   0.228 -34.685 -34.685
  221   1HD   LYS  31          2HD       LYS  31   1.435 -32.752 -32.752
  222   2HD   LYS  31          1HD       LYS  31   2.345 -34.176 -34.176
  223   1HE   LYS  31          2HE       LYS  31   0.615 -34.226 -34.226
  224   2HE   LYS  31          1HE       LYS  31  -0.044 -35.237 -35.237
  225   1HZ   LYS  31          2HZ       LYS  31  -0.825 -32.767 -32.767
  226   2HZ   LYS  31          1HZ       LYS  31  -0.919 -32.657 -32.657
  227   3HZ   LYS  31          3HZ       LYS  31  -1.781 -33.860 -33.860
  228    H    GLY  32           H        GLY  32   5.317 -31.834 -31.834
  229   1HA   GLY  32          2HA       GLY  32   6.206 -30.062 -30.062
  230   2HA   GLY  32          1HA       GLY  32   4.642 -29.871 -29.871
  231    H    ASP  33           H        ASP  33   6.595 -29.067 -29.067
  232    HA   ASP  33           HA       ASP  33   4.567 -27.084 -27.084
  233   1HB   ASP  33          2HB       ASP  33   5.681 -27.204 -27.204
  234   2HB   ASP  33          1HB       ASP  33   4.765 -28.629 -28.629
  235    H    ASP  34           H        ASP  34   6.640 -26.761 -26.761
  236    HA   ASP  34           HA       ASP  34   8.739 -25.178 -25.178
  237   1HB   ASP  34          2HB       ASP  34   7.879 -25.661 -25.661
  238   2HB   ASP  34          1HB       ASP  34   9.238 -24.630 -24.630
  239    H    LEU  35           H        LEU  35   5.631 -24.582 -24.582
  240    HA   LEU  35           HA       LEU  35   6.061 -21.688 -21.688
  241   1HB   LEU  35          2HB       LEU  35   4.985 -23.112 -23.112
  242   2HB   LEU  35          1HB       LEU  35   3.530 -22.792 -22.792
  243    HG   LEU  35           HG       LEU  35   3.723 -21.102 -21.102
  244   1HD1  LEU  35          3HD1      LEU  35   2.931 -20.353 -20.353
  245   2HD1  LEU  35          2HD1      LEU  35   4.586 -19.969 -19.969
  246   3HD1  LEU  35          1HD1      LEU  35   3.813 -19.076 -19.076
  247   1HD2  LEU  35          1HD2      LEU  35   6.247 -21.457 -21.457
  248   2HD2  LEU  35          3HD2      LEU  35   5.630 -19.819 -19.819
  249   3HD2  LEU  35          2HD2      LEU  35   6.398 -20.278 -20.278
  250    H    LEU  36           H        LEU  36   5.978 -21.854 -21.854
  251    HA   LEU  36           HA       LEU  36   3.758 -22.719 -22.719
  252   1HB   LEU  36          2HB       LEU  36   5.782 -20.564 -20.564
  253   2HB   LEU  36          1HB       LEU  36   4.560 -21.060 -21.060
  254    HG   LEU  36           HG       LEU  36   6.566 -22.975 -22.975
  255   1HD1  LEU  36          1HD1      LEU  36   6.724 -21.414 -21.414
  256   2HD1  LEU  36          3HD1      LEU  36   7.790 -22.745 -22.745
  257   3HD1  LEU  36          2HD1      LEU  36   7.790 -21.254 -21.254
  258   1HD2  LEU  36          1HD2      LEU  36   4.566 -23.089 -23.089
  259   2HD2  LEU  36          3HD2      LEU  36   4.770 -24.191 -24.191
  260   3HD2  LEU  36          2HD2      LEU  36   5.953 -24.175 -24.175
  261    HA   PRO  37           HA       PRO  37   0.593 -19.756 -19.756
  262   1HB   PRO  37          2HB       PRO  37  -0.686 -19.698 -19.698
  263   2HB   PRO  37          1HB       PRO  37  -0.821 -21.047 -21.047
  264   1HG   PRO  37          2HG       PRO  37   0.904 -20.781 -20.781
  265   2HG   PRO  37          1HG       PRO  37  -0.049 -22.173 -22.173
  266   1HD   PRO  37          2HD       PRO  37   2.620 -22.005 -22.005
  267   2HD   PRO  37          1HD       PRO  37   1.542 -22.808 -22.808
  268    H    ALA  38           H        ALA  38   1.362 -17.733 -17.733
  269    HA   ALA  38           HA       ALA  38   1.917 -16.119 -16.119
  270   1HB   ALA  38          2HB       ALA  38   3.933 -16.608 -16.608
  271   2HB   ALA  38          1HB       ALA  38   3.175 -15.696 -15.696
  272   3HB   ALA  38          3HB       ALA  38   3.583 -14.891 -14.891
  273    H    GLY  39           H        GLY  39  -0.555 -15.952 -15.952
  274   1HA   GLY  39          2HA       GLY  39  -1.576 -14.402 -14.402
  275   2HA   GLY  39          1HA       GLY  39  -2.368 -14.672 -14.672
  276    H    THR  40           H        THR  40  -1.187 -13.410 -13.410
  277    HA   THR  40           HA       THR  40  -0.571 -10.700 -10.700
  278    HB   THR  40           HB       THR  40  -1.901  -9.717  -9.717
  279    HG1  THR  40           HG1      THR  40  -2.055 -10.772 -10.772
  280   1HG2  THR  40          1HG2      THR  40  -3.129 -11.606 -11.606
  281   2HG2  THR  40          3HG2      THR  40  -4.073 -11.398 -11.398
  282   3HG2  THR  40          2HG2      THR  40  -3.659  -9.996  -9.996
  283    H    GLU  41           H        GLU  41   0.834 -13.223 -13.223
  284    HA   GLU  41           HA       GLU  41   2.563 -13.609 -13.609
  285   1HB   GLU  41          2HB       GLU  41   3.021 -11.018 -11.018
  286   2HB   GLU  41          1HB       GLU  41   3.856 -11.186 -11.186
  287   1HG   GLU  41          2HG       GLU  41   5.067 -13.061 -13.061
  288   2HG   GLU  41          1HG       GLU  41   4.037 -13.253 -13.253
  289    H    ASP  42           H        ASP  42  -0.015 -12.575 -12.575
  290    HA   ASP  42           HA       ASP  42  -0.892 -11.804 -11.804
  291   1HB   ASP  42          2HB       ASP  42   0.565 -13.970 -13.970
  292   2HB   ASP  42          1HB       ASP  42   1.508 -12.830 -12.830
  293    H    TYR  43           H        TYR  43  -0.345  -9.574  -9.574
  294    HA   TYR  43           HA       TYR  43   1.910  -8.246  -8.246
  295   1HB   TYR  43          2HB       TYR  43  -0.513  -7.095  -7.095
  296   2HB   TYR  43          1HB       TYR  43   0.945  -6.206  -6.206
  297    HD1  TYR  43           HD1      TYR  43   2.721  -8.754  -8.754
  298    HD2  TYR  43           HD2      TYR  43  -0.260  -6.409  -6.409
  299    HE1  TYR  43           HE1      TYR  43   3.696  -9.319  -9.319
  300    HE2  TYR  43           HE2      TYR  43   0.706  -6.976  -6.976
  301    HH   TYR  43           HH       TYR  43   3.760  -8.443  -8.443
  302    H    ILE  44           H        ILE  44   1.467  -6.129  -6.129
  303    HA   ILE  44           HA       ILE  44  -0.493  -6.707  -6.707
  304    HB   ILE  44           HB       ILE  44   1.976  -4.970  -4.970
  305   1HG1  ILE  44          2HG1      ILE  44   2.635  -7.269  -7.269
  306   2HG1  ILE  44          1HG1      ILE  44   2.718  -6.709  -6.709
  307   1HG2  ILE  44          3HG2      ILE  44   0.076  -4.184  -4.184
  308   2HG2  ILE  44          2HG2      ILE  44   0.097  -5.745  -5.745
  309   3HG2  ILE  44          1HG2      ILE  44   1.493  -4.671  -4.671
  310   1HD1  ILE  44          2HD1      ILE  44   0.398  -7.700  -7.700
  311   2HD1  ILE  44          1HD1      ILE  44   0.689  -8.512  -8.512
  312   3HD1  ILE  44          3HD1      ILE  44   1.747  -8.825  -8.825
  313    H    HIS  45           H        HIS  45  -2.316  -5.726  -5.726
  314    HA   HIS  45           HA       HIS  45  -2.371  -3.223  -3.223
  315   1HB   HIS  45          2HB       HIS  45  -4.185  -5.320  -5.320
  316   2HB   HIS  45          1HB       HIS  45  -4.902  -3.836  -3.836
  317    HD1  HIS  45           HD1      HIS  45  -3.885  -5.536  -5.536
  318    HD2  HIS  45           HD2      HIS  45  -5.654  -1.981  -1.981
  319    HE1  HIS  45           HE1      HIS  45  -4.830  -4.508  -4.508
  320    HE2  HIS  45           HE2      HIS  45  -5.992  -2.411  -2.411
  321    H    ILE  46           H        ILE  46  -2.017  -1.322  -1.322
  322    HA   ILE  46           HA       ILE  46  -2.172  -0.872  -0.872
  323    HB   ILE  46           HB       ILE  46  -1.783   1.135   1.135
  324   1HG1  ILE  46          2HG1      ILE  46  -0.049  -0.648  -0.648
  325   2HG1  ILE  46          1HG1      ILE  46   0.583   0.958   0.958
  326   1HG2  ILE  46          1HG2      ILE  46  -1.776   1.356   1.356
  327   2HG2  ILE  46          3HG2      ILE  46  -0.617   2.319   2.319
  328   3HG2  ILE  46          2HG2      ILE  46  -2.345   2.497   2.497
  329   1HD1  ILE  46          1HD1      ILE  46   0.141   0.264   0.264
  330   2HD1  ILE  46          3HD1      ILE  46   0.213  -1.367  -1.367
  331   3HD1  ILE  46          2HD1      ILE  46   1.590  -0.278  -0.278
  332    H    ARG  47           H        ARG  47  -3.544   1.591   1.591
  333    HA   ARG  47           HA       ARG  47  -5.687   2.318   2.318
  334   1HB   ARG  47          2HB       ARG  47  -6.306  -0.175  -0.175
  335   2HB   ARG  47          1HB       ARG  47  -6.785   0.421   0.421
  336   1HG   ARG  47          2HG       ARG  47  -8.768   0.583   0.583
  337   2HG   ARG  47          1HG       ARG  47  -8.110   2.187   2.187
  338   1HD   ARG  47          2HD       ARG  47  -7.115   1.088   1.088
  339   2HD   ARG  47          1HD       ARG  47  -8.293  -0.190  -0.190
  340    HE   ARG  47           HE       ARG  47  -9.656   2.233   2.233
  341   1HH1  ARG  47          2HH1      ARG  47  -7.881   0.322   0.322
  342   2HH1  ARG  47          1HH1      ARG  47  -8.785   0.902   0.902
  343   1HH2  ARG  47          1HH2      ARG  47 -10.845   2.999   2.999
  344   2HH2  ARG  47          2HH2      ARG  47 -10.467   2.422   2.422
  345    H    ILE  48           H        ILE  48  -6.454   4.123   4.123
  346    HA   ILE  48           HA       ILE  48  -6.071   4.652   4.652
  347    HB   ILE  48           HB       ILE  48  -5.651   6.347   6.347
  348   1HG1  ILE  48          2HG1      ILE  48  -4.353   6.259   6.259
  349   2HG1  ILE  48          1HG1      ILE  48  -3.774   5.417   5.417
  350   1HG2  ILE  48          3HG2      ILE  48  -6.645   7.460   7.460
  351   2HG2  ILE  48          2HG2      ILE  48  -5.868   8.419   8.419
  352   3HG2  ILE  48          1HG2      ILE  48  -7.404   7.617   7.617
  353   1HD1  ILE  48          1HD1      ILE  48  -3.416   7.569   7.569
  354   2HD1  ILE  48          3HD1      ILE  48  -3.969   8.398   8.398
  355   3HD1  ILE  48          2HD1      ILE  48  -2.495   7.430   7.430
  356    H    GLN  49           H        GLN  49  -7.687   6.003   6.003
  357    HA   GLN  49           HA       GLN  49 -10.246   6.210   6.210
  358   1HB   GLN  49          2HB       GLN  49 -11.469   5.234   5.234
  359   2HB   GLN  49          1HB       GLN  49 -10.311   4.080   4.080
  360   1HG   GLN  49          2HG       GLN  49  -8.782   5.087   5.087
  361   2HG   GLN  49          1HG       GLN  49 -10.345   5.470   5.470
  362   1HE2  GLN  49          2HE2      GLN  49 -11.286   2.034   2.034
  363   2HE2  GLN  49          1HE2      GLN  49 -11.928   3.565   3.565
  364    H    GLN  50           H        GLN  50 -10.392   8.379   8.379
  365    HA   GLN  50           HA       GLN  50  -9.938   9.833   9.833
  366   1HB   GLN  50          2HB       GLN  50  -9.143  10.377  10.377
  367   2HB   GLN  50          1HB       GLN  50 -10.501  11.465  11.465
  368   1HG   GLN  50          2HG       GLN  50  -9.426  12.397  12.397
  369   2HG   GLN  50          1HG       GLN  50  -8.098  11.253  11.253
  370   1HE2  GLN  50          1HE2      GLN  50  -6.397  12.465  12.465
  371   2HE2  GLN  50          2HE2      GLN  50  -6.313  13.593  13.593
  372    H    ARG  51           H        ARG  51 -11.704  10.074  10.074
  373    HA   ARG  51           HA       ARG  51 -14.335   9.763   9.763
  374   1HB   ARG  51          2HB       ARG  51 -12.994  10.549  10.549
  375   2HB   ARG  51          1HB       ARG  51 -14.544  11.351  11.351
  376   1HG   ARG  51          2HG       ARG  51 -15.351   9.512   9.512
  377   2HG   ARG  51          1HG       ARG  51 -15.214   8.812   8.812
  378   1HD   ARG  51          2HD       ARG  51 -13.824   7.286   7.286
  379   2HD   ARG  51          1HD       ARG  51 -12.678   8.569   8.569
  380    HE   ARG  51           HE       ARG  51 -14.477   8.557   8.557
  381   1HH1  ARG  51          1HH1      ARG  51 -12.044   5.375   5.375
  382   2HH1  ARG  51          2HH1      ARG  51 -12.299   6.237   6.237
  383   1HH2  ARG  51          1HH2      ARG  51 -14.142   7.423   7.423
  384   2HH2  ARG  51          2HH2      ARG  51 -13.090   6.048   6.048
  385    H    ASN  52           H        ASN  52 -13.291  12.827  12.827
  386    HA   ASN  52           HA       ASN  52 -14.980  14.236  14.236
  387   1HB   ASN  52          2HB       ASN  52 -13.725  15.882  15.882
  388   2HB   ASN  52          1HB       ASN  52 -15.422  15.728  15.728
  389   1HD2  ASN  52          2HD2      ASN  52 -16.138  14.050  14.050
  390   2HD2  ASN  52          1HD2      ASN  52 -16.584  15.179  15.179
  391    H    GLY  53           H        GLY  53 -12.656  13.253  13.253
  392   1HA   GLY  53          2HA       GLY  53 -10.897  13.918  13.918
  393   2HA   GLY  53          1HA       GLY  53 -11.540  15.550  15.550
  394    H    ARG  54           H        ARG  54 -10.797  13.924  13.924
  395    HA   ARG  54           HA       ARG  54  -8.129  15.078  15.078
  396   1HB   ARG  54          2HB       ARG  54  -8.556  16.359  16.359
  397   2HB   ARG  54          1HB       ARG  54  -9.802  16.788  16.788
  398   1HG   ARG  54          2HG       ARG  54 -11.394  15.352  15.352
  399   2HG   ARG  54          1HG       ARG  54 -10.147  14.865  14.865
  400   1HD   ARG  54          2HD       ARG  54 -11.894  17.098  17.098
  401   2HD   ARG  54          1HD       ARG  54 -10.666  16.598  16.598
  402    HE   ARG  54           HE       ARG  54  -9.274  18.243  18.243
  403   1HH1  ARG  54          2HH1      ARG  54 -11.982  17.867  17.867
  404   2HH1  ARG  54          1HH1      ARG  54 -11.609  19.289  19.289
  405   1HH2  ARG  54          1HH2      ARG  54  -8.782  20.114  20.114
  406   2HH2  ARG  54          2HH2      ARG  54  -9.792  20.566  20.566
  407    H    LYS  55           H        LYS  55 -10.671  13.245  13.245
  408    HA   LYS  55           HA       LYS  55  -8.880  11.962  11.962
  409   1HB   LYS  55          2HB       LYS  55 -11.704  12.061  12.061
  410   2HB   LYS  55          1HB       LYS  55 -11.215  10.375  10.375
  411   1HG   LYS  55          2HG       LYS  55 -11.862  11.199  11.199
  412   2HG   LYS  55          1HG       LYS  55 -10.146  10.789  10.789
  413   1HD   LYS  55          2HD       LYS  55 -10.562  13.546  13.546
  414   2HD   LYS  55          1HD       LYS  55 -11.298  13.201  13.201
  415   1HE   LYS  55          2HE       LYS  55  -8.649  12.028  12.028
  416   2HE   LYS  55          1HE       LYS  55  -8.643  13.783  13.783
  417   1HZ   LYS  55          2HZ       LYS  55 -10.271  13.023  13.023
  418   2HZ   LYS  55          1HZ       LYS  55  -8.744  12.315  12.315
  419   3HZ   LYS  55          3HZ       LYS  55  -8.885  13.992  13.992
  420    H    THR  56           H        THR  56  -7.378  11.514  11.514
  421    HA   THR  56           HA       THR  56  -8.034   9.311   9.311
  422    HB   THR  56           HB       THR  56  -5.186   9.904   9.904
  423    HG1  THR  56           HG1      THR  56  -5.622  11.968  11.968
  424   1HG2  THR  56          1HG2      THR  56  -7.017   9.331   9.331
  425   2HG2  THR  56          3HG2      THR  56  -5.886  10.631  10.631
  426   3HG2  THR  56          2HG2      THR  56  -5.280   9.053   9.053
  427    H    LEU  57           H        LEU  57  -7.333   7.192   7.192
  428    HA   LEU  57           HA       LEU  57  -5.784   6.350   6.350
  429   1HB   LEU  57          2HB       LEU  57  -8.651   5.903   5.903
  430   2HB   LEU  57          1HB       LEU  57  -7.754   4.422   4.422
  431    HG   LEU  57           HG       LEU  57  -7.417   6.794   6.794
  432   1HD1  LEU  57          2HD1      LEU  57  -9.716   4.966   4.966
  433   2HD1  LEU  57          1HD1      LEU  57  -9.071   5.202   5.202
  434   3HD1  LEU  57          3HD1      LEU  57  -9.612   6.590   6.590
  435   1HD2  LEU  57          3HD2      LEU  57  -6.507   4.023   4.023
  436   2HD2  LEU  57          2HD2      LEU  57  -5.860   5.398   5.398
  437   3HD2  LEU  57          1HD2      LEU  57  -7.208   4.476   4.476
  438    H    THR  58           H        THR  58  -4.150   5.755   5.755
  439    HA   THR  58           HA       THR  58  -4.541   4.157   4.157
  440    HB   THR  58           HB       THR  58  -1.993   4.175   4.175
  441    HG1  THR  58           HG1      THR  58  -2.613   6.220   6.220
  442   1HG2  THR  58          3HG2      THR  58  -2.608   4.097   4.097
  443   2HG2  THR  58          2HG2      THR  58  -0.995   4.378   4.378
  444   3HG2  THR  58          1HG2      THR  58  -1.826   2.857   2.857
  445    H    THR  59           H        THR  59  -5.025   2.057   2.057
  446    HA   THR  59           HA       THR  59  -4.574   0.362   0.362
  447    HB   THR  59           HB       THR  59  -6.149  -1.141  -1.141
  448    HG1  THR  59           HG1      THR  59  -6.981   1.558   1.558
  449   1HG2  THR  59          2HG2      THR  59  -6.702   0.611   0.611
  450   2HG2  THR  59          1HG2      THR  59  -8.085   0.055   0.055
  451   3HG2  THR  59          3HG2      THR  59  -6.984  -1.117  -1.117
  452    H    VAL  60           H        VAL  60  -3.977  -1.906  -1.906
  453    HA   VAL  60           HA       VAL  60  -2.324  -2.211  -2.211
  454    HB   VAL  60           HB       VAL  60  -1.526  -3.248  -3.248
  455   1HG1  VAL  60          3HG1      VAL  60  -0.716  -4.367  -4.367
  456   2HG1  VAL  60          2HG1      VAL  60   0.201  -2.888  -2.888
  457   3HG1  VAL  60          1HG1      VAL  60   0.516  -3.858  -3.858
  458   1HG2  VAL  60          3HG2      VAL  60  -0.891  -0.677  -0.677
  459   2HG2  VAL  60          2HG2      VAL  60  -1.318  -0.958  -0.958
  460   3HG2  VAL  60          1HG2      VAL  60   0.279  -1.413  -1.413
  461    H    GLN  61           H        GLN  61  -2.944  -3.871  -3.871
  462    HA   GLN  61           HA       GLN  61  -4.242  -6.163  -6.163
  463   1HB   GLN  61          2HB       GLN  61  -4.676  -4.881  -4.881
  464   2HB   GLN  61          1HB       GLN  61  -5.135  -6.555  -6.555
  465   1HG   GLN  61          2HG       GLN  61  -6.792  -5.989  -5.989
  466   2HG   GLN  61          1HG       GLN  61  -6.089  -4.407  -4.407
  467   1HE2  GLN  61          2HE2      GLN  61  -7.856  -4.741  -4.741
  468   2HE2  GLN  61          1HE2      GLN  61  -6.731  -5.929  -5.929
  469    H    GLY  62           H        GLY  62  -3.582  -8.236  -8.236
  470   1HA   GLY  62          2HA       GLY  62  -2.409  -9.759  -9.759
  471   2HA   GLY  62          1HA       GLY  62  -1.301  -8.447  -8.447
  472    H    ILE  63           H        ILE  63  -0.978  -7.580  -7.580
  473    HA   ILE  63           HA       ILE  63   1.267  -9.002  -9.002
  474    HB   ILE  63           HB       ILE  63  -0.572  -7.369  -7.369
  475   1HG1  ILE  63          2HG1      ILE  63   0.248  -5.908  -5.908
  476   2HG1  ILE  63          1HG1      ILE  63   1.421  -5.727  -5.727
  477   1HG2  ILE  63          1HG2      ILE  63   1.733  -8.951  -8.951
  478   2HG2  ILE  63          3HG2      ILE  63   2.006  -7.244  -7.244
  479   3HG2  ILE  63          2HG2      ILE  63   0.614  -8.077  -8.077
  480   1HD1  ILE  63          3HD1      ILE  63   2.864  -7.374  -7.374
  481   2HD1  ILE  63          2HD1      ILE  63   1.727  -7.273  -7.273
  482   3HD1  ILE  63          1HD1      ILE  63   2.615  -5.838  -5.838
  483    H    ALA  64           H        ALA  64   1.731 -10.634 -10.634
  484    HA   ALA  64           HA       ALA  64  -0.376 -12.541 -12.541
  485   1HB   ALA  64          1HB       ALA  64   1.978 -13.098 -13.098
  486   2HB   ALA  64          3HB       ALA  64   2.479 -12.776 -12.776
  487   3HB   ALA  64          2HB       ALA  64   1.327 -14.068 -14.068
  488    H    ASP  65           H        ASP  65  -1.274 -13.125 -13.125
  489    HA   ASP  65           HA       ASP  65  -1.261 -11.284 -11.284
  490   1HB   ASP  65          2HB       ASP  65  -2.940 -13.271 -13.271
  491   2HB   ASP  65          1HB       ASP  65  -2.177 -14.023 -14.023
  492    H    ASP  66           H        ASP  66   0.832 -13.854 -13.854
  493    HA   ASP  66           HA       ASP  66   1.643 -14.599 -14.599
  494   1HB   ASP  66          2HB       ASP  66   2.787 -14.995 -14.995
  495   2HB   ASP  66          1HB       ASP  66   3.722 -15.438 -15.438
  496    H    TYR  67           H        TYR  67   2.435 -11.989 -11.989
  497    HA   TYR  67           HA       TYR  67   4.965 -11.236 -11.236
  498   1HB   TYR  67          2HB       TYR  67   2.522  -9.572  -9.572
  499   2HB   TYR  67          1HB       TYR  67   4.100  -8.847  -8.847
  500    HD1  TYR  67           HD2      TYR  67   4.185 -12.045 -12.045
  501    HD2  TYR  67           HD1      TYR  67   3.751  -7.859  -7.859
  502    HE1  TYR  67           HE2      TYR  67   4.734 -12.334 -12.334
  503    HE2  TYR  67           HE1      TYR  67   4.295  -8.130  -8.130
  504    HH   TYR  67           HH       TYR  67   4.441 -11.208 -11.208
  505    H    ASP  68           H        ASP  68   5.729  -9.582  -9.582
  506    HA   ASP  68           HA       ASP  68   4.786 -10.061 -10.061
  507   1HB   ASP  68          2HB       ASP  68   7.055  -8.675  -8.675
  508   2HB   ASP  68          1HB       ASP  68   6.500  -7.931  -7.931
  509    H    LYS  69           H        LYS  69   2.594  -9.334  -9.334
  510    HA   LYS  69           HA       LYS  69   1.528  -7.017  -7.017
  511   1HB   LYS  69          2HB       LYS  69   0.253  -8.815  -8.815
  512   2HB   LYS  69          1HB       LYS  69   0.898  -8.321  -8.321
  513   1HG   LYS  69          2HG       LYS  69  -0.378  -6.401  -6.401
  514   2HG   LYS  69          1HG       LYS  69  -0.591  -6.354  -6.354
  515   1HD   LYS  69          2HD       LYS  69  -2.529  -7.425  -7.425
  516   2HD   LYS  69          1HD       LYS  69  -1.707  -8.787  -8.787
  517   1HE   LYS  69          2HE       LYS  69  -2.150  -8.026  -8.026
  518   2HE   LYS  69          1HE       LYS  69  -2.357  -6.356  -6.356
  519   1HZ   LYS  69          1HZ       LYS  69  -4.251  -8.428  -8.428
  520   2HZ   LYS  69          3HZ       LYS  69  -4.415  -7.738  -7.738
  521   3HZ   LYS  69          2HZ       LYS  69  -4.489  -6.761  -6.761
  522    H    LYS  70           H        LYS  70   3.262  -7.417  -7.417
  523    HA   LYS  70           HA       LYS  70   2.831  -4.827  -4.827
  524   1HB   LYS  70          2HB       LYS  70   4.984  -6.874  -6.874
  525   2HB   LYS  70          1HB       LYS  70   5.001  -5.310  -5.310
  526   1HG   LYS  70          2HG       LYS  70   2.685  -5.848  -5.848
  527   2HG   LYS  70          1HG       LYS  70   2.944  -7.487  -7.487
  528   1HD   LYS  70          2HD       LYS  70   4.370  -8.008  -8.008
  529   2HD   LYS  70          1HD       LYS  70   5.114  -6.408  -6.408
  530   1HE   LYS  70          2HE       LYS  70   2.555  -5.935  -5.935
  531   2HE   LYS  70          1HE       LYS  70   2.984  -7.477  -7.477
  532   1HZ   LYS  70          2HZ       LYS  70   5.011  -5.393  -5.393
  533   2HZ   LYS  70          1HZ       LYS  70   3.636  -5.135  -5.135
  534   3HZ   LYS  70          3HZ       LYS  70   4.569  -6.529  -6.529
  535    H    LYS  71           H        LYS  71   5.901  -6.073  -6.073
  536    HA   LYS  71           HA       LYS  71   7.034  -3.535  -3.535
  537   1HB   LYS  71          2HB       LYS  71   8.351  -5.605  -5.605
  538   2HB   LYS  71          1HB       LYS  71   7.703  -6.144  -6.144
  539   1HG   LYS  71          2HG       LYS  71   8.823  -4.392  -4.392
  540   2HG   LYS  71          1HG       LYS  71   9.310  -3.625  -3.625
  541   1HD   LYS  71          2HD       LYS  71  10.443  -5.949  -5.949
  542   2HD   LYS  71          1HD       LYS  71  10.365  -6.090  -6.090
  543   1HE   LYS  71          2HE       LYS  71  11.378  -3.523  -3.523
  544   2HE   LYS  71          1HE       LYS  71  12.400  -4.922  -4.922
  545   1HZ   LYS  71          3HZ       LYS  71  11.370  -4.697  -4.697
  546   2HZ   LYS  71          2HZ       LYS  71  12.507  -3.529  -3.529
  547   3HZ   LYS  71          1HZ       LYS  71  12.902  -5.171  -5.171
  548    H    LEU  72           H        LEU  72   4.652  -5.181  -5.181
  549    HA   LEU  72           HA       LEU  72   5.243  -4.214  -4.214
  550   1HB   LEU  72          2HB       LEU  72   3.645  -6.104  -6.104
  551   2HB   LEU  72          1HB       LEU  72   2.467  -4.826  -4.826
  552    HG   LEU  72           HG       LEU  72   3.825  -5.608  -5.608
  553   1HD1  LEU  72          2HD1      LEU  72   1.764  -6.851  -6.851
  554   2HD1  LEU  72          1HD1      LEU  72   0.888  -5.556  -5.556
  555   3HD1  LEU  72          3HD1      LEU  72   1.907  -6.653  -6.653
  556   1HD2  LEU  72          1HD2      LEU  72   1.990  -3.314  -3.314
  557   2HD2  LEU  72          3HD2      LEU  72   3.597  -3.250  -3.250
  558   3HD2  LEU  72          2HD2      LEU  72   2.241  -3.913  -3.913
  559    H    VAL  73           H        VAL  73   2.474  -3.228  -3.228
  560    HA   VAL  73           HA       VAL  73   2.351  -0.698  -0.698
  561    HB   VAL  73           HB       VAL  73   0.318  -2.016  -2.016
  562   1HG1  VAL  73          2HG1      VAL  73   1.137  -2.610  -2.610
  563   2HG1  VAL  73          1HG1      VAL  73   0.839  -0.942  -0.942
  564   3HG1  VAL  73          3HG1      VAL  73  -0.502  -1.961  -1.961
  565   1HG2  VAL  73          2HG2      VAL  73   0.651   0.651   0.651
  566   2HG2  VAL  73          1HG2      VAL  73  -0.913  -0.135  -0.135
  567   3HG2  VAL  73          3HG2      VAL  73  -0.082   0.575   0.575
  568    H    LYS  74           H        LYS  74   2.953  -1.758  -1.758
  569    HA   LYS  74           HA       LYS  74   3.145   0.672   0.672
  570   1HB   LYS  74          2HB       LYS  74   5.014  -1.655  -1.655
  571   2HB   LYS  74          1HB       LYS  74   4.638  -0.375  -0.375
  572   1HG   LYS  74          2HG       LYS  74   2.690  -2.420  -2.420
  573   2HG   LYS  74          1HG       LYS  74   3.454  -2.431  -2.431
  574   1HD   LYS  74          2HD       LYS  74   2.259   0.119   0.119
  575   2HD   LYS  74          1HD       LYS  74   1.071  -1.112  -1.112
  576   1HE   LYS  74          2HE       LYS  74   2.659  -1.281  -1.281
  577   2HE   LYS  74          1HE       LYS  74   1.171  -0.339  -0.339
  578   1HZ   LYS  74          2HZ       LYS  74   1.341  -3.211  -3.211
  579   2HZ   LYS  74          1HZ       LYS  74   0.885  -2.658  -2.658
  580   3HZ   LYS  74          3HZ       LYS  74  -0.059  -2.280  -2.280
  581    H    ALA  75           H        ALA  75   5.605  -0.947  -0.947
  582    HA   ALA  75           HA       ALA  75   7.688   0.894   0.894
  583   1HB   ALA  75          1HB       ALA  75   7.190  -0.922  -0.922
  584   2HB   ALA  75          3HB       ALA  75   8.688  -0.037  -0.037
  585   3HB   ALA  75          2HB       ALA  75   8.166  -1.277  -1.277
  586    H    PHE  76           H        PHE  76   4.970   0.888   0.888
  587    HA   PHE  76           HA       PHE  76   5.814   2.865   2.865
  588   1HB   PHE  76          2HB       PHE  76   3.701   1.318   1.318
  589   2HB   PHE  76          1HB       PHE  76   2.945   2.656   2.656
  590    HD1  PHE  76           HD2      PHE  76   4.399   1.556   1.556
  591    HD2  PHE  76           HD1      PHE  76   2.507   4.757   4.757
  592    HE1  PHE  76           HE2      PHE  76   3.988   2.694   2.694
  593    HE2  PHE  76           HE1      PHE  76   2.096   5.900   5.900
  594    HZ   PHE  76           HZ       PHE  76   2.837   4.866   4.866
  595    H    LYS  77           H        LYS  77   4.088   3.100   3.100
  596    HA   LYS  77           HA       LYS  77   3.796   5.930   5.930
  597   1HB   LYS  77          2HB       LYS  77   3.740   4.115   4.115
  598   2HB   LYS  77          1HB       LYS  77   3.069   5.737   5.737
  599   1HG   LYS  77          2HG       LYS  77   1.139   4.869   4.869
  600   2HG   LYS  77          1HG       LYS  77   1.916   4.247   4.247
  601   1HD   LYS  77          2HD       LYS  77   1.996   2.139   2.139
  602   2HD   LYS  77          1HD       LYS  77   2.389   2.665   2.665
  603   1HE   LYS  77          2HE       LYS  77  -0.091   3.488   3.488
  604   2HE   LYS  77          1HE       LYS  77  -0.279   2.328   2.328
  605   1HZ   LYS  77          2HZ       LYS  77   0.811   1.667   1.667
  606   2HZ   LYS  77          1HZ       LYS  77  -0.786   1.390   1.390
  607   3HZ   LYS  77          3HZ       LYS  77   0.482   0.577   0.577
  608    H    LYS  78           H        LYS  78   6.495   3.992   3.992
  609    HA   LYS  78           HA       LYS  78   7.826   5.991   5.991
  610   1HB   LYS  78          2HB       LYS  78   7.813   3.310   3.310
  611   2HB   LYS  78          1HB       LYS  78   9.234   3.494   3.494
  612   1HG   LYS  78          2HG       LYS  78   9.671   5.414   5.414
  613   2HG   LYS  78          1HG       LYS  78   8.828   4.183   4.183
  614   1HD   LYS  78          2HD       LYS  78  11.210   3.616   3.616
  615   2HD   LYS  78          1HD       LYS  78  11.322   3.955   3.955
  616   1HE   LYS  78          2HE       LYS  78  10.011   1.621   1.621
  617   2HE   LYS  78          1HE       LYS  78  11.331   1.604   1.604
  618   1HZ   LYS  78          1HZ       LYS  78   9.562   2.684   2.684
  619   2HZ   LYS  78          3HZ       LYS  78   8.453   1.998   1.998
  620   3HZ   LYS  78          2HZ       LYS  78   9.545   1.010   1.010
  621    H    LYS  79           H        LYS  79   7.678   4.765   4.765
  622    HA   LYS  79           HA       LYS  79  10.262   5.919   5.919
  623   1HB   LYS  79          2HB       LYS  79   9.710   3.701   3.701
  624   2HB   LYS  79          1HB       LYS  79   8.284   4.364   4.364
  625   1HG   LYS  79          2HG       LYS  79   9.599   5.639   5.639
  626   2HG   LYS  79          1HG       LYS  79  11.077   5.299   5.299
  627   1HD   LYS  79          2HD       LYS  79  10.572   2.828   2.828
  628   2HD   LYS  79          1HD       LYS  79   9.465   3.459   3.459
  629   1HE   LYS  79          2HE       LYS  79  11.296   3.371   3.371
  630   2HE   LYS  79          1HE       LYS  79  11.659   4.918   4.918
  631   1HZ   LYS  79          2HZ       LYS  79  12.586   2.438   2.438
  632   2HZ   LYS  79          1HZ       LYS  79  13.436   3.047   3.047
  633   3HZ   LYS  79          3HZ       LYS  79  13.254   3.990   3.990
  634    H    PHE  80           H        PHE  80   6.816   6.355   6.355
  635    HA   PHE  80           HA       PHE  80   7.480   8.858   8.858
  636   1HB   PHE  80          2HB       PHE  80   4.841   7.434   7.434
  637   2HB   PHE  80          1HB       PHE  80   5.545   8.628   8.628
  638    HD1  PHE  80           HD1      PHE  80   5.584   5.121   5.121
  639    HD2  PHE  80           HD2      PHE  80   7.166   7.997   7.997
  640    HE1  PHE  80           HE1      PHE  80   6.491   3.307   3.307
  641    HE2  PHE  80           HE2      PHE  80   8.076   6.187   6.187
  642    HZ   PHE  80           HZ       PHE  80   7.739   3.838   3.838
  643    H    ALA  81           H        ALA  81   5.940   7.518   7.518
  644    HA   ALA  81           HA       ALA  81   5.022   8.538   8.538
  645   1HB   ALA  81          2HB       ALA  81   6.551  10.525  10.525
  646   2HB   ALA  81          1HB       ALA  81   4.953  11.259  11.259
  647   3HB   ALA  81          3HB       ALA  81   5.533  10.689  10.689
  648    H    CYS  82           H        CYS  82   3.504   7.516   7.516
  649    HA   CYS  82           HA       CYS  82   1.137   9.259   9.259
  650   1HB   CYS  82          2HB       CYS  82   2.002   7.051   7.051
  651   2HB   CYS  82          1HB       CYS  82   0.366   7.701   7.701
  652    HG   CYS  82           HG       CYS  82   1.686  10.081  10.081
  653    H    ASN  83           H        ASN  83  -0.947   7.723   7.723
  654    HA   ASN  83           HA       ASN  83  -0.886   5.905   5.905
  655   1HB   ASN  83          2HB       ASN  83  -2.506   7.436   7.436
  656   2HB   ASN  83          1HB       ASN  83  -2.920   7.779   7.779
  657   1HD2  ASN  83          2HD2      ASN  83  -5.261   5.150   5.150
  658   2HD2  ASN  83          1HD2      ASN  83  -4.099   6.069   6.069
  659    H    GLY  84           H        GLY  84  -0.883   3.809   3.809
  660   1HA   GLY  84          2HA       GLY  84  -2.211   2.952   2.952
  661   2HA   GLY  84          1HA       GLY  84  -0.715   2.237   2.237
  662    H    THR  85           H        THR  85  -3.659   1.366   1.366
  663    HA   THR  85           HA       THR  85  -3.898  -0.121  -0.121
  664    HB   THR  85           HB       THR  85  -6.266   0.002   0.002
  665    HG1  THR  85           HG1      THR  85  -7.379   0.678   0.678
  666   1HG2  THR  85          1HG2      THR  85  -5.010   2.174   2.174
  667   2HG2  THR  85          3HG2      THR  85  -5.603   2.744   2.744
  668   3HG2  THR  85          2HG2      THR  85  -6.744   2.241   2.241
  669    H    VAL  86           H        VAL  86  -5.220  -2.168  -2.168
  670    HA   VAL  86           HA       VAL  86  -4.567  -3.448  -3.448
  671    HB   VAL  86           HB       VAL  86  -3.143  -4.271  -4.271
  672   1HG1  VAL  86          1HG1      VAL  86  -5.304  -3.964  -3.964
  673   2HG1  VAL  86          3HG1      VAL  86  -5.285  -5.712  -5.712
  674   3HG1  VAL  86          2HG1      VAL  86  -3.863  -4.892  -4.892
  675   1HG2  VAL  86          2HG2      VAL  86  -4.088  -5.737  -5.737
  676   2HG2  VAL  86          1HG2      VAL  86  -3.325  -6.536  -6.536
  677   3HG2  VAL  86          3HG2      VAL  86  -5.083  -6.466  -6.466
  678    H    ILE  87           H        ILE  87  -6.808  -2.611  -2.611
  679    HA   ILE  87           HA       ILE  87  -9.033  -3.885  -3.885
  680    HB   ILE  87           HB       ILE  87 -10.418  -2.812  -2.812
  681   1HG1  ILE  87          2HG1      ILE  87  -8.225  -1.255  -1.255
  682   2HG1  ILE  87          1HG1      ILE  87  -8.187  -2.965  -2.965
  683   1HG2  ILE  87          2HG2      ILE  87  -9.749  -1.563  -1.563
  684   2HG2  ILE  87          1HG2      ILE  87  -8.345  -0.941  -0.941
  685   3HG2  ILE  87          3HG2      ILE  87  -9.971  -0.508  -0.508
  686   1HD1  ILE  87          3HD1      ILE  87 -10.803  -1.639  -1.639
  687   2HD1  ILE  87          2HD1      ILE  87  -9.557  -1.124  -1.124
  688   3HD1  ILE  87          1HD1      ILE  87 -10.024  -2.822  -2.822
  689    H    GLU  88           H        GLU  88 -10.461  -5.398  -5.398
  690    HA   GLU  88           HA       GLU  88  -9.244  -7.099  -7.099
  691   1HB   GLU  88          2HB       GLU  88  -9.984  -7.913  -7.913
  692   2HB   GLU  88          1HB       GLU  88 -11.574  -7.985  -7.985
  693   1HG   GLU  88          2HG       GLU  88 -10.521  -9.402  -9.402
  694   2HG   GLU  88          1HG       GLU  88  -9.097  -9.496  -9.496
  695    H    HIS  89           H        HIS  89 -10.019  -5.513  -5.513
  696    HA   HIS  89           HA       HIS  89 -12.624  -4.782  -4.782
  697   1HB   HIS  89          2HB       HIS  89 -10.321  -4.302  -4.302
  698   2HB   HIS  89          1HB       HIS  89 -10.981  -5.500  -5.500
  699    HD1  HIS  89           HD1      HIS  89 -12.566  -4.650  -4.650
  700    HD2  HIS  89           HD2      HIS  89 -12.147  -2.020  -2.020
  701    HE1  HIS  89           HE1      HIS  89 -13.891  -2.611  -2.611
  702    HE2  HIS  89           HE2      HIS  89 -13.537  -0.991  -0.991
  703    HA   PRO  90           HA       PRO  90 -14.551  -8.687  -8.687
  704   1HB   PRO  90          2HB       PRO  90 -16.990  -7.751  -7.751
  705   2HB   PRO  90          1HB       PRO  90 -16.420  -7.796  -7.796
  706   1HG   PRO  90          2HG       PRO  90 -16.505  -5.493  -5.493
  707   2HG   PRO  90          1HG       PRO  90 -16.942  -5.537  -5.537
  708   1HD   PRO  90          2HD       PRO  90 -14.553  -4.591  -4.591
  709   2HD   PRO  90          1HD       PRO  90 -14.760  -5.333  -5.333
  710    H    GLU  91           H        GLU  91 -14.001  -6.082  -6.082
  711    HA   GLU  91           HA       GLU  91 -15.104  -7.421  -7.421
  712   1HB   GLU  91          2HB       GLU  91 -14.411  -4.761  -4.761
  713   2HB   GLU  91          1HB       GLU  91 -13.417  -5.221  -5.221
  714   1HG   GLU  91          2HG       GLU  91 -15.508  -4.148  -4.148
  715   2HG   GLU  91          1HG       GLU  91 -15.378  -5.802  -5.802
  716    H    TYR  92           H        TYR  92 -12.068  -7.135  -7.135
  717    HA   TYR  92           HA       TYR  92 -10.795  -8.672  -8.672
  718   1HB   TYR  92          2HB       TYR  92  -9.145  -6.919  -6.919
  719   2HB   TYR  92          1HB       TYR  92  -8.842  -7.436  -7.436
  720    HD1  TYR  92           HD1      TYR  92 -11.063  -6.612  -6.612
  721    HD2  TYR  92           HD2      TYR  92  -9.311  -4.622  -4.622
  722    HE1  TYR  92           HE1      TYR  92 -11.939  -4.470  -4.470
  723    HE2  TYR  92           HE2      TYR  92 -10.179  -2.473  -2.473
  724    HH   TYR  92           HH       TYR  92 -10.903  -1.479  -1.479
  725    H    GLY  93           H        GLY  93 -10.438  -7.818  -7.818
  726   1HA   GLY  93          2HA       GLY  93 -10.737 -10.050 -10.050
  727   2HA   GLY  93          1HA       GLY  93  -9.246 -10.448 -10.448
  728    H    GLU  94           H        GLU  94  -7.422 -10.005 -10.005
  729    HA   GLU  94           HA       GLU  94  -7.530  -8.217  -8.217
  730   1HB   GLU  94          2HB       GLU  94  -6.664 -10.643 -10.643
  731   2HB   GLU  94          1HB       GLU  94  -5.236 -10.032 -10.032
  732   1HG   GLU  94          2HG       GLU  94  -6.144  -8.599  -8.599
  733   2HG   GLU  94          1HG       GLU  94  -5.400 -10.185 -10.185
  734    H    VAL  95           H        VAL  95  -7.355  -6.215  -6.215
  735    HA   VAL  95           HA       VAL  95  -4.787  -5.719  -5.719
  736    HB   VAL  95           HB       VAL  95  -5.835  -3.927  -3.927
  737   1HG1  VAL  95          1HG1      VAL  95  -7.275  -6.566  -6.566
  738   2HG1  VAL  95          3HG1      VAL  95  -7.517  -5.293  -5.293
  739   3HG1  VAL  95          2HG1      VAL  95  -5.924  -6.021  -6.021
  740   1HG2  VAL  95          2HG2      VAL  95  -8.255  -4.606  -4.606
  741   2HG2  VAL  95          1HG2      VAL  95  -7.462  -3.043  -3.043
  742   3HG2  VAL  95          3HG2      VAL  95  -8.378  -3.744  -3.744
  743    H    ILE  96           H        ILE  96  -3.514  -4.098  -4.098
  744    HA   ILE  96           HA       ILE  96  -4.098  -2.986  -2.986
  745    HB   ILE  96           HB       ILE  96  -1.794  -2.790  -2.790
  746   1HG1  ILE  96          2HG1      ILE  96  -2.373  -4.529  -4.529
  747   2HG1  ILE  96          1HG1      ILE  96  -0.726  -4.121  -4.121
  748   1HG2  ILE  96          3HG2      ILE  96  -2.370  -0.900  -0.900
  749   2HG2  ILE  96          2HG2      ILE  96  -0.709  -1.315  -1.315
  750   3HG2  ILE  96          1HG2      ILE  96  -1.757  -0.559  -0.559
  751   1HD1  ILE  96          3HD1      ILE  96  -2.051  -2.487  -2.487
  752   2HD1  ILE  96          2HD1      ILE  96  -1.488  -4.107  -4.107
  753   3HD1  ILE  96          1HD1      ILE  96  -0.350  -2.908  -2.908
  754    H    GLN  97           H        GLN  97  -4.324  -0.755  -0.755
  755    HA   GLN  97           HA       GLN  97  -5.238   0.896   0.896
  756   1HB   GLN  97          2HB       GLN  97  -6.752  -0.058  -0.058
  757   2HB   GLN  97          1HB       GLN  97  -6.521   1.661   1.661
  758   1HG   GLN  97          2HG       GLN  97  -7.381   2.081   2.081
  759   2HG   GLN  97          1HG       GLN  97  -7.732   0.358   0.358
  760   1HE2  GLN  97          2HE2      GLN  97  -9.856   2.444   2.444
  761   2HE2  GLN  97          1HE2      GLN  97  -8.166   2.730   2.730
  762    H    LEU  98           H        LEU  98  -3.577   2.293   2.293
  763    HA   LEU  98           HA       LEU  98  -2.361   3.538   3.538
  764   1HB   LEU  98          2HB       LEU  98  -1.706   3.967   3.967
  765   2HB   LEU  98          1HB       LEU  98  -0.750   4.467   4.467
  766    HG   LEU  98           HG       LEU  98  -1.331   1.562   1.562
  767   1HD1  LEU  98          2HD1      LEU  98  -0.326   2.892   2.892
  768   2HD1  LEU  98          1HD1      LEU  98   1.159   2.651   2.651
  769   3HD1  LEU  98          3HD1      LEU  98   0.188   1.261   1.261
  770   1HD2  LEU  98          3HD2      LEU  98   0.526   3.248   3.248
  771   2HD2  LEU  98          2HD2      LEU  98  -0.198   1.690   1.690
  772   3HD2  LEU  98          1HD2      LEU  98   1.203   1.765   1.765
  773    H    GLN  99           H        GLN  99  -2.177   5.851   5.851
  774    HA   GLN  99           HA       GLN  99  -4.617   7.175   7.175
  775   1HB   GLN  99          2HB       GLN  99  -2.969   7.335   7.335
  776   2HB   GLN  99          1HB       GLN  99  -3.062   8.925   8.925
  777   1HG   GLN  99          2HG       GLN  99  -5.492   7.262   7.262
  778   2HG   GLN  99          1HG       GLN  99  -4.800   8.392   8.392
  779   1HE2  GLN  99          2HE2      GLN  99  -5.743  11.290  11.290
  780   2HE2  GLN  99          1HE2      GLN  99  -4.500  10.641  10.641
  781    H    GLY 100           H        GLY 100  -4.678   9.016   9.016
  782   1HA   GLY 100          2HA       GLY 100  -3.901  10.730  10.730
  783   2HA   GLY 100          1HA       GLY 100  -2.272  10.391  10.391
  784    H    ASP 101           H        ASP 101  -2.258  10.983  10.983
  785    HA   ASP 101           HA       ASP 101  -2.758   8.697   8.697
  786   1HB   ASP 101          2HB       ASP 101  -1.876  10.133  10.133
  787   2HB   ASP 101          1HB       ASP 101  -3.157  10.927  10.927
  788    H    GLN 102           H        GLN 102  -1.341   7.242   7.242
  789    HA   GLN 102           HA       GLN 102   1.517   7.710   7.710
  790   1HB   GLN 102          2HB       GLN 102  -0.239   5.848   5.848
  791   2HB   GLN 102          1HB       GLN 102   1.339   5.227   5.227
  792   1HG   GLN 102          2HG       GLN 102   1.061   6.339   6.339
  793   2HG   GLN 102          1HG       GLN 102   2.470   6.750   6.750
  794   1HE2  GLN 102          2HE2      GLN 102  -0.522   9.538   9.538
  795   2HE2  GLN 102          1HE2      GLN 102  -0.881   7.863   7.863
  796    H    ARG 103           H        ARG 103  -0.531   6.975   6.975
  797    HA   ARG 103           HA       ARG 103  -0.090   4.490   4.490
  798   1HB   ARG 103          2HB       ARG 103  -0.566   5.433   5.433
  799   2HB   ARG 103          1HB       ARG 103  -1.600   6.184   6.184
  800   1HG   ARG 103          2HG       ARG 103   0.087   8.072   8.072
  801   2HG   ARG 103          1HG       ARG 103   0.796   7.353   7.353
  802   1HD   ARG 103          2HD       ARG 103  -2.124   8.044   8.044
  803   2HD   ARG 103          1HD       ARG 103  -0.913   9.212   9.212
  804    HE   ARG 103           HE       ARG 103  -1.933   6.972   6.972
  805   1HH1  ARG 103          2HH1      ARG 103   0.737   9.188   9.188
  806   2HH1  ARG 103          1HH1      ARG 103   1.282   9.000   9.000
  807   1HH2  ARG 103          1HH2      ARG 103  -1.218   6.721   6.721
  808   2HH2  ARG 103          2HH2      ARG 103   0.172   7.599   7.599
  809    H    LYS 104           H        LYS 104   2.132   7.162   7.162
  810    HA   LYS 104           HA       LYS 104   4.074   5.714   5.714
  811   1HB   LYS 104          2HB       LYS 104   4.039   8.565   8.565
  812   2HB   LYS 104          1HB       LYS 104   5.372   7.855   7.855
  813   1HG   LYS 104          2HG       LYS 104   2.555   8.275   8.275
  814   2HG   LYS 104          1HG       LYS 104   4.002   9.146   9.146
  815   1HD   LYS 104          2HD       LYS 104   3.442   6.209   6.209
  816   2HD   LYS 104          1HD       LYS 104   3.379   7.469   7.469
  817   1HE   LYS 104          2HE       LYS 104   5.869   7.864   7.864
  818   2HE   LYS 104          1HE       LYS 104   5.706   6.137   6.137
  819   1HZ   LYS 104          1HZ       LYS 104   4.731   6.491   6.491
  820   2HZ   LYS 104          3HZ       LYS 104   6.105   7.478   7.478
  821   3HZ   LYS 104          2HZ       LYS 104   6.229   5.830   5.830
  822    H    ASN 105           H        ASN 105   3.353   6.573   6.573
  823    HA   ASN 105           HA       ASN 105   6.058   6.171   6.171
  824   1HB   ASN 105          2HB       ASN 105   3.446   6.935   6.935
  825   2HB   ASN 105          1HB       ASN 105   4.650   6.197   6.197
  826   1HD2  ASN 105          2HD2      ASN 105   4.902  10.044  10.044
  827   2HD2  ASN 105          1HD2      ASN 105   3.522   9.046   9.046
  828    H    ILE 106           H        ILE 106   3.019   4.366   4.366
  829    HA   ILE 106           HA       ILE 106   3.881   2.255   2.255
  830    HB   ILE 106           HB       ILE 106   1.503   2.676   2.676
  831   1HG1  ILE 106          2HG1      ILE 106   0.837   0.372   0.372
  832   2HG1  ILE 106          1HG1      ILE 106   2.322  -0.102  -0.102
  833   1HG2  ILE 106          2HG2      ILE 106   1.867   3.130   3.130
  834   2HG2  ILE 106          1HG2      ILE 106   2.008   1.388   1.388
  835   3HG2  ILE 106          3HG2      ILE 106   0.501   2.079   2.079
  836   1HD1  ILE 106          3HD1      ILE 106   2.206   1.030   1.030
  837   2HD1  ILE 106          2HD1      ILE 106   2.259  -0.690  -0.690
  838   3HD1  ILE 106          1HD1      ILE 106   3.612   0.353   0.353
  839    H    CYS 107           H        CYS 107   3.718   2.487   2.487
  840    HA   CYS 107           HA       CYS 107   4.857  -0.009  -0.009
  841   1HB   CYS 107          2HB       CYS 107   4.912   2.616   2.616
  842   2HB   CYS 107          1HB       CYS 107   5.665   1.159   1.159
  843    HG   CYS 107           HG       CYS 107   3.165   0.099   0.099
  844    H    GLN 108           H        GLN 108   6.201   3.047   3.047
  845    HA   GLN 108           HA       GLN 108   8.950   2.378   2.378
  846   1HB   GLN 108          2HB       GLN 108   8.603   4.668   4.668
  847   2HB   GLN 108          1HB       GLN 108   7.424   4.608   4.608
  848   1HG   GLN 108          2HG       GLN 108   9.145   5.622   5.622
  849   2HG   GLN 108          1HG       GLN 108   9.520   3.941   3.941
  850   1HE2  GLN 108          2HE2      GLN 108  12.375   3.795   3.795
  851   2HE2  GLN 108          1HE2      GLN 108  11.082   2.867   2.867
  852    H    PHE 109           H        PHE 109   6.650   2.180   2.180
  853    HA   PHE 109           HA       PHE 109   8.539   1.495   1.495
  854   1HB   PHE 109          2HB       PHE 109   6.373   2.453   2.453
  855   2HB   PHE 109          1HB       PHE 109   5.544   1.084   1.084
  856    HD1  PHE 109           HD2      PHE 109   8.098   1.816   1.816
  857    HD2  PHE 109           HD1      PHE 109   4.852  -0.633  -0.633
  858    HE1  PHE 109           HE2      PHE 109   8.160   0.634   0.634
  859    HE2  PHE 109           HE1      PHE 109   4.909  -1.819  -1.819
  860    HZ   PHE 109           HZ       PHE 109   6.563  -1.185  -1.185
  861    H    LEU 110           H        LEU 110   6.308  -0.348  -0.348
  862    HA   LEU 110           HA       LEU 110   6.779  -2.890  -2.890
  863   1HB   LEU 110          2HB       LEU 110   5.832  -1.831  -1.831
  864   2HB   LEU 110          1HB       LEU 110   6.273  -3.523  -3.523
  865    HG   LEU 110           HG       LEU 110   4.528  -4.040  -4.040
  866   1HD1  LEU 110          2HD1      LEU 110   4.428  -1.100  -1.100
  867   2HD1  LEU 110          1HD1      LEU 110   3.152  -2.222  -2.222
  868   3HD1  LEU 110          3HD1      LEU 110   4.789  -2.436  -2.436
  869   1HD2  LEU 110          2HD2      LEU 110   3.734  -3.493  -3.493
  870   2HD2  LEU 110          1HD2      LEU 110   2.519  -3.142  -3.142
  871   3HD2  LEU 110          3HD2      LEU 110   3.452  -1.829  -1.829
  872    H    VAL 111           H        VAL 111   8.655  -0.932  -0.932
  873    HA   VAL 111           HA       VAL 111  10.450  -3.139  -3.139
  874    HB   VAL 111           HB       VAL 111  10.588  -0.247  -0.247
  875   1HG1  VAL 111          2HG1      VAL 111  12.134  -2.699  -2.699
  876   2HG1  VAL 111          1HG1      VAL 111  12.026  -1.279  -1.279
  877   3HG1  VAL 111          3HG1      VAL 111  12.749  -1.144  -1.144
  878   1HG2  VAL 111          2HG2      VAL 111   8.561  -1.641  -1.641
  879   2HG2  VAL 111          1HG2      VAL 111   9.484  -0.826  -0.826
  880   3HG2  VAL 111          3HG2      VAL 111   9.703  -2.555  -2.555
  881    H    GLU 112           H        GLU 112  10.324  -0.249  -0.249
  882    HA   GLU 112           HA       GLU 112  13.102  -0.122  -0.122
  883   1HB   GLU 112          2HB       GLU 112  10.642   1.044   1.044
  884   2HB   GLU 112          1HB       GLU 112  12.231   1.248   1.248
  885   1HG   GLU 112          2HG       GLU 112  12.257   1.908   1.908
  886   2HG   GLU 112          1HG       GLU 112  11.054   2.848   2.848
  887    H    ILE 113           H        ILE 113  10.408  -1.895  -1.895
  888    HA   ILE 113           HA       ILE 113  12.088  -2.878  -2.878
  889    HB   ILE 113           HB       ILE 113  10.120  -3.575  -3.575
  890   1HG1  ILE 113          2HG1      ILE 113   8.664  -3.017  -3.017
  891   2HG1  ILE 113          1HG1      ILE 113   8.886  -4.582  -4.582
  892   1HG2  ILE 113          3HG2      ILE 113  10.650  -1.005  -1.005
  893   2HG2  ILE 113          2HG2      ILE 113   9.038  -1.063  -1.063
  894   3HG2  ILE 113          1HG2      ILE 113   9.276  -1.538  -1.538
  895   1HD1  ILE 113          1HD1      ILE 113   7.598  -2.793  -2.793
  896   2HD1  ILE 113          3HD1      ILE 113   6.739  -2.807  -2.807
  897   3HD1  ILE 113          2HD1      ILE 113   7.019  -4.316  -4.316
  898    H    GLY 114           H        GLY 114  10.537  -3.827  -3.827
  899   1HA   GLY 114          2HA       GLY 114  11.149  -5.747  -5.747
  900   2HA   GLY 114          1HA       GLY 114  11.752  -6.479  -6.479
  901    H    LEU 115           H        LEU 115   8.634  -4.931  -4.931
  902    HA   LEU 115           HA       LEU 115   7.304  -7.287  -7.287
  903   1HB   LEU 115          2HB       LEU 115   6.810  -4.636  -4.636
  904   2HB   LEU 115          1HB       LEU 115   5.699  -5.049  -5.049
  905    HG   LEU 115           HG       LEU 115   4.531  -6.603  -6.603
  906   1HD1  LEU 115          2HD1      LEU 115   6.849  -6.211  -6.211
  907   2HD1  LEU 115          1HD1      LEU 115   5.279  -6.719  -6.719
  908   3HD1  LEU 115          3HD1      LEU 115   6.117  -7.709  -7.709
  909   1HD2  LEU 115          2HD2      LEU 115   4.494  -3.925  -3.925
  910   2HD2  LEU 115          1HD2      LEU 115   3.400  -5.054  -5.054
  911   3HD2  LEU 115          3HD2      LEU 115   4.840  -4.480  -4.480
  912    H    ALA 116           H        ALA 116   6.499  -5.259  -5.259
  913    HA   ALA 116           HA       ALA 116   5.400  -7.591  -7.591
  914   1HB   ALA 116          1HB       ALA 116   4.187  -5.419  -5.419
  915   2HB   ALA 116          3HB       ALA 116   5.477  -4.733  -4.733
  916   3HB   ALA 116          2HB       ALA 116   4.484  -6.045  -6.045
  917    H    LYS 117           H        LYS 117   5.833  -7.045  -7.045
  918    HA   LYS 117           HA       LYS 117   8.765  -7.228  -7.228
  919   1HB   LYS 117          2HB       LYS 117   6.571  -8.815  -8.815
  920   2HB   LYS 117          1HB       LYS 117   8.068  -8.565  -8.565
  921   1HG   LYS 117          2HG       LYS 117   8.462  -9.439  -9.439
  922   2HG   LYS 117          1HG       LYS 117   7.590 -10.597 -10.597
  923   1HD   LYS 117          2HD       LYS 117   9.661 -11.262 -11.262
  924   2HD   LYS 117          1HD       LYS 117   9.585  -9.876  -9.876
  925   1HE   LYS 117          2HE       LYS 117  11.116  -8.719  -8.719
  926   2HE   LYS 117          1HE       LYS 117  10.464  -9.238  -9.238
  927   1HZ   LYS 117          1HZ       LYS 117  12.072 -11.020 -11.020
  928   2HZ   LYS 117          3HZ       LYS 117  12.764 -10.037 -10.037
  929   3HZ   LYS 117          2HZ       LYS 117  11.664 -11.246 -11.246
  930    H    ASP 118           H        ASP 118   9.743  -6.180  -6.180
  931    HA   ASP 118           HA       ASP 118   8.647  -3.772  -3.772
  932   1HB   ASP 118          2HB       ASP 118  10.716  -5.268  -5.268
  933   2HB   ASP 118          1HB       ASP 118  10.511  -3.525  -3.525
  934    H    ASP 119           H        ASP 119   8.408  -6.950  -6.950
  935    HA   ASP 119           HA       ASP 119   7.254  -5.980  -5.980
  936   1HB   ASP 119          2HB       ASP 119   6.946  -8.343  -8.343
  937   2HB   ASP 119          1HB       ASP 119   8.583  -8.051  -8.051
  938    H    GLN 120           H        GLN 120   6.149  -6.771  -6.771
  939    HA   GLN 120           HA       GLN 120   3.405  -7.225  -7.225
  940   1HB   GLN 120          2HB       GLN 120   4.733  -7.152  -7.152
  941   2HB   GLN 120          1HB       GLN 120   3.004  -7.359  -7.359
  942   1HG   GLN 120          2HG       GLN 120   3.462  -9.398  -9.398
  943   2HG   GLN 120          1HG       GLN 120   5.175  -9.208  -9.208
  944   1HE2  GLN 120          2HE2      GLN 120   2.668  -9.973  -9.973
  945   2HE2  GLN 120          1HE2      GLN 120   2.191  -8.898  -8.898
  946    H    LEU 121           H        LEU 121   5.375  -4.588  -4.588
  947    HA   LEU 121           HA       LEU 121   3.867  -2.823  -2.823
  948   1HB   LEU 121          2HB       LEU 121   5.670  -2.369  -2.369
  949   2HB   LEU 121          1HB       LEU 121   4.921  -1.038  -1.038
  950    HG   LEU 121           HG       LEU 121   6.628  -3.075  -3.075
  951   1HD1  LEU 121          2HD1      LEU 121   7.462  -0.634  -0.634
  952   2HD1  LEU 121          1HD1      LEU 121   8.404  -1.237  -1.237
  953   3HD1  LEU 121          3HD1      LEU 121   8.144  -2.260  -2.260
  954   1HD2  LEU 121          3HD2      LEU 121   5.057  -0.865  -0.865
  955   2HD2  LEU 121          2HD2      LEU 121   6.097  -1.896  -1.896
  956   3HD2  LEU 121          1HD2      LEU 121   6.750  -0.437  -0.437
  957    H    LYS 122           H        LYS 122   1.662  -3.006  -3.006
  958    HA   LYS 122           HA       LYS 122   0.688  -2.082  -2.082
  959   1HB   LYS 122          2HB       LYS 122  -0.217  -4.199  -4.199
  960   2HB   LYS 122          1HB       LYS 122  -1.500  -3.201  -3.201
  961   1HG   LYS 122          2HG       LYS 122   0.586  -4.622  -4.622
  962   2HG   LYS 122          1HG       LYS 122  -1.037  -5.238  -5.238
  963   1HD   LYS 122          2HD       LYS 122  -1.939  -3.930  -3.930
  964   2HD   LYS 122          1HD       LYS 122  -1.060  -2.510  -2.510
  965   1HE   LYS 122          2HE       LYS 122   0.980  -3.665  -3.665
  966   2HE   LYS 122          1HE       LYS 122  -0.260  -4.550  -4.550
  967   1HZ   LYS 122          1HZ       LYS 122  -1.185  -2.124  -2.124
  968   2HZ   LYS 122          3HZ       LYS 122   0.442  -1.714  -1.714
  969   3HZ   LYS 122          2HZ       LYS 122  -0.002  -2.768  -2.768
  970    H    VAL 123           H        VAL 123   0.895   0.125   0.125
  971    HA   VAL 123           HA       VAL 123  -0.759   1.037   1.037
  972    HB   VAL 123           HB       VAL 123   1.516   1.953   1.953
  973   1HG1  VAL 123          1HG1      VAL 123   1.071   1.999   1.999
  974   2HG1  VAL 123          3HG1      VAL 123   0.856   3.700   3.700
  975   3HG1  VAL 123          2HG1      VAL 123   2.364   2.878   2.878
  976   1HG2  VAL 123          1HG2      VAL 123  -0.923   3.588   3.588
  977   2HG2  VAL 123          3HG2      VAL 123   0.410   3.516   3.516
  978   3HG2  VAL 123          2HG2      VAL 123   0.567   4.476   4.476
  979    H    HIS 124           H        HIS 124  -2.754   1.792   1.792
  980    HA   HIS 124           HA       HIS 124  -3.481   2.885   2.885
  981   1HB   HIS 124          2HB       HIS 124  -5.314   1.177   1.177
  982   2HB   HIS 124          1HB       HIS 124  -5.601   1.765   1.765
  983    HD1  HIS 124           HD1      HIS 124  -4.995   0.207   0.207
  984    HD2  HIS 124           HD2      HIS 124  -3.077  -0.745  -0.745
  985    HE1  HIS 124           HE1      HIS 124  -3.770  -1.941  -1.941
  986    HE2  HIS 124           HE2      HIS 124  -2.767  -2.581  -2.581
  987    H    GLY 125           H        GLY 125  -3.197   4.984   4.984
  988   1HA   GLY 125          2HA       GLY 125  -4.499   5.899   5.899
  989   2HA   GLY 125          1HA       GLY 125  -3.875   6.913   6.913
  990    H    PHE 126           HN       PHE 126  -6.578   6.221   6.221
  991    HA   PHE 126           HA       PHE 126  -8.665   5.781   5.781
  992   1HB   PHE 126          2HB       PHE 126 -10.075   6.872   6.872
  993   2HB   PHE 126          1HB       PHE 126  -8.734   6.224   6.224
  994    HD1  PHE 126           HD2      PHE 126  -6.630   8.129   8.129
  995    HD2  PHE 126           HD1      PHE 126 -10.823   8.817   8.817
  996    HE1  PHE 126           HE2      PHE 126  -6.206  10.366  10.366
  997    HE2  PHE 126           HE1      PHE 126 -10.405  11.056  11.056
  998    HZ   PHE 126           HZ       PHE 126  -8.094  11.833  11.833

  Start of MODEL    4
    1   1H    MET   1          3H        MET   1  48.485 -41.027 -41.027
    2   2H    MET   1          2H        MET   1  48.741 -39.500 -39.500
    3   3H    MET   1          1H        MET   1  47.167 -39.956 -39.956
    4    HA   MET   1           HA       MET   1  47.261 -40.185 -40.185
    5   1HB   MET   1          2HB       MET   1  48.991 -41.803 -41.803
    6   2HB   MET   1          1HB       MET   1  49.589 -40.239 -40.239
    7   1HG   MET   1          2HG       MET   1  49.628 -42.479 -42.479
    8   2HG   MET   1          1HG       MET   1  50.800 -42.499 -42.499
    9   1HE   MET   1          3HE       MET   1  52.442 -42.737 -42.737
   10   2HE   MET   1          2HE       MET   1  53.447 -41.341 -41.341
   11   3HE   MET   1          1HE       MET   1  52.321 -41.981 -41.981
   12    H    ARG   2           H        ARG   2  45.301 -41.145 -41.145
   13    HA   ARG   2           HA       ARG   2  45.171 -43.962 -43.962
   14   1HB   ARG   2          2HB       ARG   2  45.431 -43.084 -43.084
   15   2HB   ARG   2          1HB       ARG   2  43.820 -43.750 -43.750
   16   1HG   ARG   2          2HG       ARG   2  44.580 -45.853 -45.853
   17   2HG   ARG   2          1HG       ARG   2  46.041 -45.328 -45.328
   18   1HD   ARG   2          2HD       ARG   2  47.055 -44.678 -44.678
   19   2HD   ARG   2          1HD       ARG   2  45.570 -45.055 -45.055
   20    HE   ARG   2           HE       ARG   2  46.426 -47.346 -47.346
   21   1HH1  ARG   2          2HH1      ARG   2  47.365 -45.339 -45.339
   22   2HH1  ARG   2          1HH1      ARG   2  48.155 -46.627 -46.627
   23   1HH2  ARG   2          1HH2      ARG   2  47.465 -49.042 -49.042
   24   2HH2  ARG   2          2HH2      ARG   2  48.214 -48.729 -48.729
   25    H    GLY   3           H        GLY   3  43.934 -42.683 -42.683
   26   1HA   GLY   3          2HA       GLY   3  41.476 -41.436 -41.436
   27   2HA   GLY   3          1HA       GLY   3  41.956 -41.926 -41.926
   28    H    SER   4           H        SER   4  39.971 -42.598 -42.598
   29    HA   SER   4           HA       SER   4  39.149 -45.152 -45.152
   30   1HB   SER   4          2HB       SER   4  38.353 -45.803 -45.803
   31   2HB   SER   4          1HB       SER   4  40.101 -45.598 -45.598
   32    HG   SER   4           HG       SER   4  39.953 -44.108 -44.108
   33    H    HIS   5           H        HIS   5  37.958 -42.444 -42.444
   34    HA   HIS   5           HA       HIS   5  35.226 -42.972 -42.972
   35   1HB   HIS   5          2HB       HIS   5  36.376 -41.818 -41.818
   36   2HB   HIS   5          1HB       HIS   5  35.746 -40.424 -40.424
   37    HD1  HIS   5           HD1      HIS   5  33.347 -39.918 -39.918
   38    HD2  HIS   5           HD2      HIS   5  34.276 -43.854 -43.854
   39    HE1  HIS   5           HE1      HIS   5  31.245 -40.884 -40.884
   40    HE2  HIS   5           HE2      HIS   5  31.856 -43.242 -43.242
   41    H    HIS   6           H        HIS   6  37.793 -40.734 -40.734
   42    HA   HIS   6           HA       HIS   6  36.256 -39.842 -39.842
   43   1HB   HIS   6          2HB       HIS   6  37.291 -37.990 -37.990
   44   2HB   HIS   6          1HB       HIS   6  36.940 -37.436 -37.436
   45    HD1  HIS   6           HD1      HIS   6  35.333 -38.349 -38.349
   46    HD2  HIS   6           HD2      HIS   6  34.171 -37.489 -37.489
   47    HE1  HIS   6           HE1      HIS   6  32.854 -37.940 -37.940
   48    HE2  HIS   6           HE2      HIS   6  32.189 -37.337 -37.337
   49    H    HIS   7           H        HIS   7  37.515 -39.139 -39.139
   50    HA   HIS   7           HA       HIS   7  40.249 -40.053 -40.053
   51   1HB   HIS   7          2HB       HIS   7  38.438 -38.968 -38.968
   52   2HB   HIS   7          1HB       HIS   7  40.155 -39.214 -39.214
   53    HD1  HIS   7           HD1      HIS   7  40.371 -41.921 -41.921
   54    HD2  HIS   7           HD2      HIS   7  37.531 -41.033 -41.033
   55    HE1  HIS   7           HE1      HIS   7  39.584 -44.144 -44.144
   56    HE2  HIS   7           HE2      HIS   7  37.928 -43.579 -43.579
   57    H    HIS   8           H        HIS   8  38.853 -37.010 -37.010
   58    HA   HIS   8           HA       HIS   8  40.822 -35.471 -35.471
   59   1HB   HIS   8          2HB       HIS   8  40.917 -35.886 -35.886
   60   2HB   HIS   8          1HB       HIS   8  41.221 -34.255 -34.255
   61    HD1  HIS   8           HD1      HIS   8  43.130 -36.853 -36.853
   62    HD2  HIS   8           HD2      HIS   8  43.169 -34.764 -34.764
   63    HE1  HIS   8           HE1      HIS   8  45.430 -37.199 -37.199
   64    HE2  HIS   8           HE2      HIS   8  45.459 -35.853 -35.853
   65    H    HIS   9           H        HIS   9  40.129 -33.446 -33.446
   66    HA   HIS   9           HA       HIS   9  37.482 -32.688 -32.688
   67   1HB   HIS   9          2HB       HIS   9  37.916 -33.093 -33.093
   68   2HB   HIS   9          1HB       HIS   9  38.730 -31.533 -31.533
   69    HD1  HIS   9           HD1      HIS   9  37.271 -29.443 -29.443
   70    HD2  HIS   9           HD2      HIS   9  35.113 -32.990 -32.990
   71    HE1  HIS   9           HE1      HIS   9  34.860 -28.772 -28.772
   72    HE2  HIS   9           HE2      HIS   9  33.579 -30.943 -30.943
   73    H    HIS  10           H        HIS  10  37.639 -31.255 -31.255
   74    HA   HIS  10           HA       HIS  10  38.179 -29.386 -29.386
   75   1HB   HIS  10          2HB       HIS  10  37.847 -28.493 -28.493
   76   2HB   HIS  10          1HB       HIS  10  39.545 -28.083 -28.083
   77    HD1  HIS  10           HD1      HIS  10  36.827 -27.830 -27.830
   78    HD2  HIS  10           HD2      HIS  10  39.338 -25.388 -25.388
   79    HE1  HIS  10           HE1      HIS  10  36.503 -25.512 -25.512
   80    HE2  HIS  10           HE2      HIS  10  37.971 -24.040 -24.040
   81    H    THR  11           H        THR  11  39.882 -28.542 -28.542
   82    HA   THR  11           HA       THR  11  42.477 -29.819 -29.819
   83    HB   THR  11           HB       THR  11  42.786 -28.992 -28.992
   84    HG1  THR  11           HG1      THR  11  40.819 -29.063 -29.063
   85   1HG2  THR  11          1HG2      THR  11  42.827 -31.343 -31.343
   86   2HG2  THR  11          3HG2      THR  11  41.065 -31.374 -31.374
   87   3HG2  THR  11          2HG2      THR  11  42.003 -31.107 -31.107
   88    H    ASP  12           H        ASP  12  41.811 -27.527 -27.527
   89    HA   ASP  12           HA       ASP  12  44.081 -25.924 -25.924
   90   1HB   ASP  12          2HB       ASP  12  42.561 -25.141 -25.141
   91   2HB   ASP  12          1HB       ASP  12  41.506 -24.482 -24.482
   92    HA   PRO  13           HA       PRO  13  41.891 -25.775 -25.775
   93   1HB   PRO  13          2HB       PRO  13  43.948 -26.808 -26.808
   94   2HB   PRO  13          1HB       PRO  13  42.705 -27.810 -27.810
   95   1HG   PRO  13          2HG       PRO  13  45.469 -27.176 -27.176
   96   2HG   PRO  13          1HG       PRO  13  44.612 -28.728 -28.728
   97   1HD   PRO  13          2HD       PRO  13  44.830 -27.182 -27.182
   98   2HD   PRO  13          1HD       PRO  13  43.409 -28.199 -28.199
   99    H    MET  14           H        MET  14  45.112 -24.914 -24.914
  100    HA   MET  14           HA       MET  14  45.825 -23.202 -23.202
  101   1HB   MET  14          2HB       MET  14  46.664 -23.132 -23.132
  102   2HB   MET  14          1HB       MET  14  47.444 -22.233 -22.233
  103   1HG   MET  14          2HG       MET  14  47.191 -25.139 -25.139
  104   2HG   MET  14          1HG       MET  14  48.279 -24.625 -24.625
  105   1HE   MET  14          1HE       MET  14  49.678 -26.121 -26.121
  106   2HE   MET  14          3HE       MET  14  51.045 -25.008 -25.008
  107   3HE   MET  14          2HE       MET  14  50.519 -25.709 -25.709
  108    H    SER  15           H        SER  15  43.795 -22.754 -22.754
  109    HA   SER  15           HA       SER  15  43.759 -19.915 -19.915
  110   1HB   SER  15          2HB       SER  15  42.057 -22.039 -22.039
  111   2HB   SER  15          1HB       SER  15  41.509 -20.362 -20.362
  112    HG   SER  15           HG       SER  15  44.013 -21.275 -21.275
  113    H    ALA  16           H        ALA  16  41.962 -22.386 -22.386
  114    HA   ALA  16           HA       ALA  16  40.473 -20.269 -20.269
  115   1HB   ALA  16          2HB       ALA  16  39.558 -22.886 -22.886
  116   2HB   ALA  16          1HB       ALA  16  38.833 -22.293 -22.293
  117   3HB   ALA  16          3HB       ALA  16  38.740 -21.324 -21.324
  118    H    ILE  17           H        ILE  17  42.270 -20.218 -20.218
  119    HA   ILE  17           HA       ILE  17  42.394 -22.553 -22.553
  120    HB   ILE  17           HB       ILE  17  44.387 -20.296 -20.296
  121   1HG1  ILE  17          2HG1      ILE  17  44.690 -22.998 -22.998
  122   2HG1  ILE  17          1HG1      ILE  17  44.177 -21.557 -21.557
  123   1HG2  ILE  17          1HG2      ILE  17  44.015 -22.145 -22.145
  124   2HG2  ILE  17          3HG2      ILE  17  45.143 -23.004 -23.004
  125   3HG2  ILE  17          2HG2      ILE  17  45.581 -21.430 -21.430
  126   1HD1  ILE  17          3HD1      ILE  17  46.625 -21.195 -21.195
  127   2HD1  ILE  17          2HD1      ILE  17  46.745 -22.401 -22.401
  128   3HD1  ILE  17          1HD1      ILE  17  46.253 -20.752 -20.752
  129    H    GLN  18           H        GLN  18  40.421 -21.865 -21.865
  130    HA   GLN  18           HA       GLN  18  40.817 -19.572 -19.572
  131   1HB   GLN  18          2HB       GLN  18  38.130 -20.705 -20.705
  132   2HB   GLN  18          1HB       GLN  18  38.494 -19.145 -19.145
  133   1HG   GLN  18          2HG       GLN  18  39.277 -19.947 -19.947
  134   2HG   GLN  18          1HG       GLN  18  37.823 -19.036 -19.036
  135   1HE2  GLN  18          2HE2      GLN  18  40.914 -16.939 -16.939
  136   2HE2  GLN  18          1HE2      GLN  18  40.385 -18.452 -18.452
  137    H    ASN  19           H        ASN  19  38.860 -20.002 -20.002
  138    HA   ASN  19           HA       ASN  19  39.480 -22.651 -22.651
  139   1HB   ASN  19          2HB       ASN  19  39.308 -20.008 -20.008
  140   2HB   ASN  19          1HB       ASN  19  39.448 -21.578 -21.578
  141   1HD2  ASN  19          2HD2      ASN  19  42.738 -19.698 -19.698
  142   2HD2  ASN  19          1HD2      ASN  19  41.181 -19.036 -19.036
  143    H    LEU  20           H        LEU  20  37.457 -23.325 -23.325
  144    HA   LEU  20           HA       LEU  20  34.992 -22.117 -22.117
  145   1HB   LEU  20          2HB       LEU  20  35.297 -23.400 -23.400
  146   2HB   LEU  20          1HB       LEU  20  35.477 -24.863 -24.863
  147    HG   LEU  20           HG       LEU  20  33.161 -24.500 -24.500
  148   1HD1  LEU  20          3HD1      LEU  20  33.013 -22.099 -22.099
  149   2HD1  LEU  20          2HD1      LEU  20  33.075 -22.380 -22.380
  150   3HD1  LEU  20          1HD1      LEU  20  31.700 -22.961 -22.961
  151   1HD2  LEU  20          3HD2      LEU  20  33.934 -25.820 -25.820
  152   2HD2  LEU  20          2HD2      LEU  20  32.231 -25.658 -25.658
  153   3HD2  LEU  20          1HD2      LEU  20  32.936 -24.608 -24.608
  154    H    HIS  21           H        HIS  21  34.180 -22.229 -22.229
  155    HA   HIS  21           HA       HIS  21  34.586 -24.704 -24.704
  156   1HB   HIS  21          2HB       HIS  21  34.805 -21.845 -21.845
  157   2HB   HIS  21          1HB       HIS  21  34.063 -22.921 -22.921
  158    HD1  HIS  21           HD1      HIS  21  35.745 -23.620 -23.620
  159    HD2  HIS  21           HD2      HIS  21  37.376 -23.318 -23.318
  160    HE1  HIS  21           HE1      HIS  21  38.154 -24.301 -24.301
  161    HE2  HIS  21           HE2      HIS  21  39.098 -24.192 -24.192
  162    H    SER  22           H        SER  22  32.873 -25.207 -25.207
  163    HA   SER  22           HA       SER  22  30.704 -25.644 -25.644
  164   1HB   SER  22          2HB       SER  22  30.212 -22.878 -22.878
  165   2HB   SER  22          1HB       SER  22  29.091 -23.793 -23.793
  166    HG   SER  22           HG       SER  22  30.211 -23.280 -23.280
  167    H    PHE  23           H        PHE  23  29.677 -27.168 -27.168
  168    HA   PHE  23           HA       PHE  23  29.266 -26.864 -26.864
  169   1HB   PHE  23          2HB       PHE  23  29.781 -29.062 -29.062
  170   2HB   PHE  23          1HB       PHE  23  28.233 -29.342 -29.342
  171    HD1  PHE  23           HD1      PHE  23  28.196 -29.006 -29.006
  172    HD2  PHE  23           HD2      PHE  23  31.735 -29.623 -29.623
  173    HE1  PHE  23           HE1      PHE  23  29.367 -29.757 -29.757
  174    HE2  PHE  23           HE2      PHE  23  32.913 -30.375 -30.375
  175    HZ   PHE  23           HZ       PHE  23  31.730 -30.442 -30.442
  176    H    ASP  24           H        ASP  24  27.305 -26.718 -26.718
  177    HA   ASP  24           HA       ASP  24  25.089 -26.288 -26.288
  178   1HB   ASP  24          2HB       ASP  24  25.189 -28.594 -28.594
  179   2HB   ASP  24          1HB       ASP  24  24.273 -27.584 -27.584
  180    HA   PRO  25           HA       PRO  25  25.577 -22.848 -22.848
  181   1HB   PRO  25          2HB       PRO  25  25.086 -21.256 -21.256
  182   2HB   PRO  25          1HB       PRO  25  26.303 -21.034 -21.034
  183   1HG   PRO  25          2HG       PRO  25  26.970 -21.961 -21.961
  184   2HG   PRO  25          1HG       PRO  25  27.758 -22.566 -22.566
  185   1HD   PRO  25          2HD       PRO  25  25.626 -23.835 -23.835
  186   2HD   PRO  25          1HD       PRO  25  27.025 -24.580 -24.580
  187    H    PHE  26           H        PHE  26  23.305 -23.581 -23.581
  188    HA   PHE  26           HA       PHE  26  21.187 -22.209 -22.209
  189   1HB   PHE  26          2HB       PHE  26  19.942 -22.389 -22.389
  190   2HB   PHE  26          1HB       PHE  26  21.192 -21.164 -21.164
  191    HD1  PHE  26           HD2      PHE  26  23.481 -21.622 -21.622
  192    HD2  PHE  26           HD1      PHE  26  20.097 -24.044 -24.044
  193    HE1  PHE  26           HE2      PHE  26  24.647 -22.515 -22.515
  194    HE2  PHE  26           HE1      PHE  26  21.257 -24.942 -24.942
  195    HZ   PHE  26           HZ       PHE  26  23.536 -24.177 -24.177
  196    H    ALA  27           H        ALA  27  21.912 -24.654 -24.654
  197    HA   ALA  27           HA       ALA  27  20.293 -26.728 -26.728
  198   1HB   ALA  27          2HB       ALA  27  22.293 -26.540 -26.540
  199   2HB   ALA  27          1HB       ALA  27  21.029 -27.744 -27.744
  200   3HB   ALA  27          3HB       ALA  27  22.028 -27.804 -27.804
  201    H    ASP  28           H        ASP  28  18.301 -25.360 -25.360
  202    HA   ASP  28           HA       ASP  28  16.636 -26.333 -26.333
  203   1HB   ASP  28          2HB       ASP  28  16.159 -24.147 -24.147
  204   2HB   ASP  28          1HB       ASP  28  17.732 -24.848 -24.848
  205    H    ALA  29           H        ALA  29  15.242 -26.741 -26.741
  206    HA   ALA  29           HA       ALA  29  13.833 -24.394 -24.394
  207   1HB   ALA  29          1HB       ALA  29  15.104 -26.575 -26.575
  208   2HB   ALA  29          3HB       ALA  29  13.663 -25.755 -25.755
  209   3HB   ALA  29          2HB       ALA  29  15.128 -24.832 -24.832
  210    H    SER  30           H        SER  30  11.826 -25.298 -25.298
  211    HA   SER  30           HA       SER  30  10.677 -27.736 -27.736
  212   1HB   SER  30          2HB       SER  30  10.486 -25.702 -25.702
  213   2HB   SER  30          1HB       SER  30   8.952 -25.581 -25.581
  214    HG   SER  30           HG       SER  30   8.849 -27.954 -27.954
  215    H    LYS  31           H        LYS  31   8.012 -27.252 -27.252
  216    HA   LYS  31           HA       LYS  31   7.686 -27.157 -27.157
  217   1HB   LYS  31          2HB       LYS  31   6.121 -27.896 -27.896
  218   2HB   LYS  31          1HB       LYS  31   5.303 -26.445 -26.445
  219   1HG   LYS  31          2HG       LYS  31   4.645 -27.394 -27.394
  220   2HG   LYS  31          1HG       LYS  31   6.069 -28.431 -28.431
  221   1HD   LYS  31          2HD       LYS  31   5.178 -29.922 -29.922
  222   2HD   LYS  31          1HD       LYS  31   3.828 -28.831 -28.831
  223   1HE   LYS  31          2HE       LYS  31   2.726 -30.167 -30.167
  224   2HE   LYS  31          1HE       LYS  31   3.550 -29.206 -29.206
  225   1HZ   LYS  31          3HZ       LYS  31   5.395 -30.978 -30.978
  226   2HZ   LYS  31          2HZ       LYS  31   4.151 -31.928 -31.928
  227   3HZ   LYS  31          1HZ       LYS  31   4.036 -31.340 -31.340
  228    H    GLY  32           H        GLY  32   6.286 -25.624 -25.624
  229   1HA   GLY  32          2HA       GLY  32   7.270 -22.954 -22.954
  230   2HA   GLY  32          1HA       GLY  32   6.148 -23.500 -23.500
  231    H    ASP  33           H        ASP  33   6.338 -22.690 -22.690
  232    HA   ASP  33           HA       ASP  33   3.862 -21.209 -21.209
  233   1HB   ASP  33          2HB       ASP  33   3.291 -23.662 -23.662
  234   2HB   ASP  33          1HB       ASP  33   4.004 -23.362 -23.362
  235    H    ASP  34           H        ASP  34   5.398 -19.521 -19.521
  236    HA   ASP  34           HA       ASP  34   6.961 -19.438 -19.438
  237   1HB   ASP  34          2HB       ASP  34   7.092 -17.971 -17.971
  238   2HB   ASP  34          1HB       ASP  34   5.881 -16.972 -16.972
  239    H    LEU  35           H        LEU  35   3.741 -18.154 -18.154
  240    HA   LEU  35           HA       LEU  35   3.329 -16.932 -16.932
  241   1HB   LEU  35          2HB       LEU  35   1.501 -17.785 -17.785
  242   2HB   LEU  35          1HB       LEU  35   0.857 -17.146 -17.146
  243    HG   LEU  35           HG       LEU  35   2.923 -15.572 -15.572
  244   1HD1  LEU  35          1HD1      LEU  35   0.143 -16.103 -16.103
  245   2HD1  LEU  35          3HD1      LEU  35   0.725 -14.441 -14.441
  246   3HD1  LEU  35          2HD1      LEU  35   1.580 -15.727 -15.727
  247   1HD2  LEU  35          3HD2      LEU  35   0.761 -15.076 -15.076
  248   2HD2  LEU  35          2HD2      LEU  35   2.440 -14.536 -14.536
  249   3HD2  LEU  35          1HD2      LEU  35   1.267 -13.767 -13.767
  250    H    LEU  36           H        LEU  36   3.400 -18.064 -18.064
  251    HA   LEU  36           HA       LEU  36   2.342 -20.779 -20.779
  252   1HB   LEU  36          2HB       LEU  36   4.153 -19.149 -19.149
  253   2HB   LEU  36          1HB       LEU  36   3.199 -20.376 -20.376
  254    HG   LEU  36           HG       LEU  36   4.151 -22.095 -22.095
  255   1HD1  LEU  36          1HD1      LEU  36   5.758 -19.801 -19.801
  256   2HD1  LEU  36          3HD1      LEU  36   6.087 -21.505 -21.505
  257   3HD1  LEU  36          2HD1      LEU  36   4.577 -20.783 -20.783
  258   1HD2  LEU  36          3HD2      LEU  36   5.274 -21.050 -21.050
  259   2HD2  LEU  36          2HD2      LEU  36   6.024 -22.353 -22.353
  260   3HD2  LEU  36          1HD2      LEU  36   6.549 -20.686 -20.686
  261    HA   PRO  37           HA       PRO  37  -1.463 -19.989 -19.989
  262   1HB   PRO  37          2HB       PRO  37  -0.659 -21.708 -21.708
  263   2HB   PRO  37          1HB       PRO  37  -2.031 -21.866 -21.866
  264   1HG   PRO  37          2HG       PRO  37   0.070 -23.504 -23.504
  265   2HG   PRO  37          1HG       PRO  37  -0.774 -22.928 -22.928
  266   1HD   PRO  37          2HD       PRO  37   1.826 -22.016 -22.016
  267   2HD   PRO  37          1HD       PRO  37   1.375 -22.249 -22.249
  268    H    ALA  38           H        ALA  38  -0.689 -17.768 -17.768
  269    HA   ALA  38           HA       ALA  38  -0.420 -15.972 -15.972
  270   1HB   ALA  38          1HB       ALA  38  -2.521 -17.011 -17.011
  271   2HB   ALA  38          3HB       ALA  38  -1.513 -17.716 -17.716
  272   3HB   ALA  38          2HB       ALA  38  -1.630 -15.964 -15.964
  273    H    GLY  39           H        GLY  39   1.948 -16.618 -16.618
  274   1HA   GLY  39          2HA       GLY  39   3.236 -17.589 -17.589
  275   2HA   GLY  39          1HA       GLY  39   4.023 -17.280 -17.280
  276    H    THR  40           H        THR  40   3.790 -14.821 -14.821
  277    HA   THR  40           HA       THR  40   4.821 -13.318 -13.318
  278    HB   THR  40           HB       THR  40   5.162 -11.907 -11.907
  279    HG1  THR  40           HG1      THR  40   6.069 -14.594 -14.594
  280   1HG2  THR  40          2HG2      THR  40   6.598 -11.995 -11.995
  281   2HG2  THR  40          1HG2      THR  40   7.374 -13.368 -13.368
  282   3HG2  THR  40          3HG2      THR  40   7.379 -11.784 -11.784
  283    H    GLU  41           H        GLU  41   2.236 -13.438 -13.438
  284    HA   GLU  41           HA       GLU  41   1.314 -10.857 -10.857
  285   1HB   GLU  41          2HB       GLU  41   0.245 -13.463 -13.463
  286   2HB   GLU  41          1HB       GLU  41  -0.966 -12.502 -12.502
  287   1HG   GLU  41          2HG       GLU  41   0.064 -10.808 -10.808
  288   2HG   GLU  41          1HG       GLU  41  -0.086 -12.378 -12.378
  289    H    ASP  42           H        ASP  42   1.278 -13.025 -13.025
  290    HA   ASP  42           HA       ASP  42  -0.721 -11.794 -11.794
  291   1HB   ASP  42          2HB       ASP  42   0.490 -14.045 -14.045
  292   2HB   ASP  42          1HB       ASP  42   1.723 -13.086 -13.086
  293    H    TYR  43           H        TYR  43  -0.312  -9.539  -9.539
  294    HA   TYR  43           HA       TYR  43   2.057  -8.370  -8.370
  295   1HB   TYR  43          2HB       TYR  43  -0.220  -6.929  -6.929
  296   2HB   TYR  43          1HB       TYR  43   1.396  -6.313  -6.313
  297    HD1  TYR  43           HD2      TYR  43   3.031  -8.640  -8.640
  298    HD2  TYR  43           HD1      TYR  43  -0.382  -6.775  -6.775
  299    HE1  TYR  43           HE2      TYR  43   3.760  -9.381  -9.381
  300    HE2  TYR  43           HE1      TYR  43   0.339  -7.513  -7.513
  301    HH   TYR  43           HH       TYR  43   2.660  -9.852  -9.852
  302    H    ILE  44           H        ILE  44   1.516  -6.180  -6.180
  303    HA   ILE  44           HA       ILE  44  -0.505  -6.804  -6.804
  304    HB   ILE  44           HB       ILE  44   2.035  -5.192  -5.192
  305   1HG1  ILE  44          2HG1      ILE  44   2.572  -7.513  -7.513
  306   2HG1  ILE  44          1HG1      ILE  44   2.560  -7.001  -7.001
  307   1HG2  ILE  44          2HG2      ILE  44  -0.235  -5.660  -5.660
  308   2HG2  ILE  44          1HG2      ILE  44   1.381  -5.220  -5.220
  309   3HG2  ILE  44          3HG2      ILE  44   0.481  -4.129  -4.129
  310   1HD1  ILE  44          3HD1      ILE  44   0.232  -7.897  -7.897
  311   2HD1  ILE  44          2HD1      ILE  44   0.459  -8.583  -8.583
  312   3HD1  ILE  44          1HD1      ILE  44   1.486  -9.106  -9.106
  313    H    HIS  45           H        HIS  45  -2.261  -5.766  -5.766
  314    HA   HIS  45           HA       HIS  45  -2.233  -3.219  -3.219
  315   1HB   HIS  45          2HB       HIS  45  -4.124  -5.274  -5.274
  316   2HB   HIS  45          1HB       HIS  45  -4.796  -3.763  -3.763
  317    HD1  HIS  45           HD1      HIS  45  -3.495  -5.325  -5.325
  318    HD2  HIS  45           HD2      HIS  45  -5.759  -2.075  -2.075
  319    HE1  HIS  45           HE1      HIS  45  -4.454  -4.326  -4.326
  320    HE2  HIS  45           HE2      HIS  45  -5.905  -2.424  -2.424
  321    H    ILE  46           H        ILE  46  -2.294  -1.245  -1.245
  322    HA   ILE  46           HA       ILE  46  -2.335  -0.899  -0.899
  323    HB   ILE  46           HB       ILE  46  -1.830   1.131   1.131
  324   1HG1  ILE  46          2HG1      ILE  46  -0.163  -0.758  -0.758
  325   2HG1  ILE  46          1HG1      ILE  46   0.494   0.865   0.865
  326   1HG2  ILE  46          1HG2      ILE  46  -2.062   1.349   1.349
  327   2HG2  ILE  46          3HG2      ILE  46  -0.707   2.201   2.201
  328   3HG2  ILE  46          2HG2      ILE  46  -2.358   2.550   2.550
  329   1HD1  ILE  46          2HD1      ILE  46   0.034   0.387   0.387
  330   2HD1  ILE  46          1HD1      ILE  46   0.142  -1.287  -1.287
  331   3HD1  ILE  46          3HD1      ILE  46   1.497  -0.187  -0.187
  332    H    ARG  47           H        ARG  47  -3.576   1.695   1.695
  333    HA   ARG  47           HA       ARG  47  -5.702   2.446   2.446
  334   1HB   ARG  47          2HB       ARG  47  -6.348  -0.078  -0.078
  335   2HB   ARG  47          1HB       ARG  47  -6.945   0.520   0.520
  336   1HG   ARG  47          2HG       ARG  47  -8.832   1.048   1.048
  337   2HG   ARG  47          1HG       ARG  47  -7.942   2.304   2.304
  338   1HD   ARG  47          2HD       ARG  47  -8.544   1.224   1.224
  339   2HD   ARG  47          1HD       ARG  47  -7.317   0.038   0.038
  340    HE   ARG  47           HE       ARG  47  -8.997  -1.452  -1.452
  341   1HH1  ARG  47          2HH1      ARG  47 -10.320   1.761   1.761
  342   2HH1  ARG  47          1HH1      ARG  47 -11.945   1.204   1.204
  343   1HH2  ARG  47          1HH2      ARG  47 -11.132  -2.187  -2.187
  344   2HH2  ARG  47          2HH2      ARG  47 -12.406  -1.037  -1.037
  345    H    ILE  48           H        ILE  48  -6.296   4.283   4.283
  346    HA   ILE  48           HA       ILE  48  -6.009   4.701   4.701
  347    HB   ILE  48           HB       ILE  48  -5.490   6.364   6.364
  348   1HG1  ILE  48          2HG1      ILE  48  -4.726   6.758   6.758
  349   2HG1  ILE  48          1HG1      ILE  48  -3.868   5.690   5.690
  350   1HG2  ILE  48          3HG2      ILE  48  -7.069   7.564   7.564
  351   2HG2  ILE  48          2HG2      ILE  48  -6.147   8.503   8.503
  352   3HG2  ILE  48          1HG2      ILE  48  -7.508   7.518   7.518
  353   1HD1  ILE  48          2HD1      ILE  48  -3.500   7.696   7.696
  354   2HD1  ILE  48          1HD1      ILE  48  -4.118   8.678   8.678
  355   3HD1  ILE  48          3HD1      ILE  48  -2.659   7.712   7.712
  356    H    GLN  49           H        GLN  49  -7.654   5.903   5.903
  357    HA   GLN  49           HA       GLN  49 -10.248   6.088   6.088
  358   1HB   GLN  49          2HB       GLN  49 -11.402   4.960   4.960
  359   2HB   GLN  49          1HB       GLN  49 -10.198   3.893   3.893
  360   1HG   GLN  49          2HG       GLN  49  -8.713   4.901   4.901
  361   2HG   GLN  49          1HG       GLN  49 -10.297   5.131   5.131
  362   1HE2  GLN  49          2HE2      GLN  49 -10.514   1.863   1.863
  363   2HE2  GLN  49          1HE2      GLN  49 -10.956   3.524   3.524
  364    H    GLN  50           H        GLN  50 -10.553   8.219   8.219
  365    HA   GLN  50           HA       GLN  50 -10.095   9.571   9.571
  366   1HB   GLN  50          2HB       GLN  50  -9.363  10.274  10.274
  367   2HB   GLN  50          1HB       GLN  50 -10.739  11.311  11.311
  368   1HG   GLN  50          2HG       GLN  50  -9.646  12.208  12.208
  369   2HG   GLN  50          1HG       GLN  50  -8.325  11.049  11.049
  370   1HE2  GLN  50          2HE2      GLN  50  -6.489  13.403  13.403
  371   2HE2  GLN  50          1HE2      GLN  50  -6.611  12.265  12.265
  372    H    ARG  51           H        ARG  51 -11.818   9.969   9.969
  373    HA   ARG  51           HA       ARG  51 -14.477   9.652   9.652
  374   1HB   ARG  51          2HB       ARG  51 -13.249   9.943   9.943
  375   2HB   ARG  51          1HB       ARG  51 -14.896  10.538  10.538
  376   1HG   ARG  51          2HG       ARG  51 -15.770   8.470   8.470
  377   2HG   ARG  51          1HG       ARG  51 -14.346   7.855   7.855
  378   1HD   ARG  51          2HD       ARG  51 -13.599   6.940   6.940
  379   2HD   ARG  51          1HD       ARG  51 -13.616   8.511   8.511
  380    HE   ARG  51           HE       ARG  51 -15.472   7.837   7.837
  381   1HH1  ARG  51          2HH1      ARG  51 -15.217   5.920   5.920
  382   2HH1  ARG  51          1HH1      ARG  51 -16.571   4.916   4.916
  383   1HH2  ARG  51          1HH2      ARG  51 -17.254   6.517   6.517
  384   2HH2  ARG  51          2HH2      ARG  51 -17.728   5.254   5.254
  385    H    ASN  52           H        ASN  52 -13.089  12.290  12.290
  386    HA   ASN  52           HA       ASN  52 -14.961  14.147  14.147
  387   1HB   ASN  52          2HB       ASN  52 -12.986  14.734  14.734
  388   2HB   ASN  52          1HB       ASN  52 -14.415  15.666  15.666
  389   1HD2  ASN  52          2HD2      ASN  52 -14.673  12.456  12.456
  390   2HD2  ASN  52          1HD2      ASN  52 -13.199  12.895  12.895
  391    H    GLY  53           H        GLY  53 -12.919  13.193  13.193
  392   1HA   GLY  53          2HA       GLY  53 -11.356  13.946  13.946
  393   2HA   GLY  53          1HA       GLY  53 -12.009  15.545  15.545
  394    H    ARG  54           H        ARG  54 -10.677  13.744  13.744
  395    HA   ARG  54           HA       ARG  54  -8.035  14.854  14.854
  396   1HB   ARG  54          2HB       ARG  54  -8.070  16.381  16.381
  397   2HB   ARG  54          1HB       ARG  54  -9.598  16.675  16.675
  398   1HG   ARG  54          2HG       ARG  54 -10.729  15.264  15.264
  399   2HG   ARG  54          1HG       ARG  54  -9.190  15.093  15.093
  400   1HD   ARG  54          2HD       ARG  54 -10.894  17.532  17.532
  401   2HD   ARG  54          1HD       ARG  54 -10.259  16.830  16.830
  402    HE   ARG  54           HE       ARG  54  -8.978  18.749  18.749
  403   1HH1  ARG  54          2HH1      ARG  54  -8.348  16.018  16.018
  404   2HH1  ARG  54          1HH1      ARG  54  -6.741  16.529  16.529
  405   1HH2  ARG  54          1HH2      ARG  54  -6.865  19.423  19.423
  406   2HH2  ARG  54          2HH2      ARG  54  -5.899  18.463  18.463
  407    H    LYS  55           H        LYS  55 -10.380  13.333  13.333
  408    HA   LYS  55           HA       LYS  55  -8.407  12.042  12.042
  409   1HB   LYS  55          2HB       LYS  55 -11.010  12.534  12.534
  410   2HB   LYS  55          1HB       LYS  55 -11.138  10.884  10.884
  411   1HG   LYS  55          2HG       LYS  55 -11.036  10.681  10.681
  412   2HG   LYS  55          1HG       LYS  55  -9.408  10.284  10.284
  413   1HD   LYS  55          2HD       LYS  55  -9.110  12.919  12.919
  414   2HD   LYS  55          1HD       LYS  55 -10.380  12.616  12.616
  415   1HE   LYS  55          2HE       LYS  55  -7.667  11.316  11.316
  416   2HE   LYS  55          1HE       LYS  55  -8.258  12.408  12.408
  417   1HZ   LYS  55          2HZ       LYS  55  -9.944  10.709  10.709
  418   2HZ   LYS  55          1HZ       LYS  55  -9.223   9.655   9.655
  419   3HZ   LYS  55          3HZ       LYS  55  -8.360  10.174  10.174
  420    H    THR  56           H        THR  56  -7.244  11.360  11.360
  421    HA   THR  56           HA       THR  56  -8.265   9.165   9.165
  422    HB   THR  56           HB       THR  56  -5.356   9.441   9.441
  423    HG1  THR  56           HG1      THR  56  -5.203  11.509  11.509
  424   1HG2  THR  56          1HG2      THR  56  -7.435   9.006   9.006
  425   2HG2  THR  56          3HG2      THR  56  -6.330  10.274  10.274
  426   3HG2  THR  56          2HG2      THR  56  -5.706   8.680   8.680
  427    H    LEU  57           H        LEU  57  -7.342   7.010   7.010
  428    HA   LEU  57           HA       LEU  57  -5.931   6.106   6.106
  429   1HB   LEU  57          2HB       LEU  57  -8.788   5.609   5.609
  430   2HB   LEU  57          1HB       LEU  57  -7.858   4.189   4.189
  431    HG   LEU  57           HG       LEU  57  -7.676   6.646   6.646
  432   1HD1  LEU  57          3HD1      LEU  57  -9.961   4.715   4.715
  433   2HD1  LEU  57          2HD1      LEU  57  -9.536   5.512   5.512
  434   3HD1  LEU  57          1HD1      LEU  57  -9.994   6.475   6.475
  435   1HD2  LEU  57          1HD2      LEU  57  -6.913   3.831   3.831
  436   2HD2  LEU  57          3HD2      LEU  57  -6.277   5.227   5.227
  437   3HD2  LEU  57          2HD2      LEU  57  -7.733   4.417   4.417
  438    H    THR  58           H        THR  58  -4.322   5.731   5.731
  439    HA   THR  58           HA       THR  58  -4.677   4.098   4.098
  440    HB   THR  58           HB       THR  58  -2.181   4.472   4.472
  441    HG1  THR  58           HG1      THR  58  -3.376   6.349   6.349
  442   1HG2  THR  58          1HG2      THR  58  -2.503   3.591   3.591
  443   2HG2  THR  58          3HG2      THR  58  -0.977   4.049   4.049
  444   3HG2  THR  58          2HG2      THR  58  -1.860   2.637   2.637
  445    H    THR  59           H        THR  59  -5.161   2.012   2.012
  446    HA   THR  59           HA       THR  59  -4.601   0.260   0.260
  447    HB   THR  59           HB       THR  59  -6.224  -1.194  -1.194
  448    HG1  THR  59           HG1      THR  59  -7.123   1.497   1.497
  449   1HG2  THR  59          3HG2      THR  59  -6.555   0.225   0.225
  450   2HG2  THR  59          2HG2      THR  59  -8.052   0.036   0.036
  451   3HG2  THR  59          1HG2      THR  59  -7.095  -1.382  -1.382
  452    H    VAL  60           H        VAL  60  -4.008  -1.994  -1.994
  453    HA   VAL  60           HA       VAL  60  -2.464  -2.235  -2.235
  454    HB   VAL  60           HB       VAL  60  -1.503  -3.212  -3.212
  455   1HG1  VAL  60          2HG1      VAL  60  -0.823  -4.384  -4.384
  456   2HG1  VAL  60          1HG1      VAL  60   0.134  -2.934  -2.934
  457   3HG1  VAL  60          3HG1      VAL  60   0.448  -3.916  -3.916
  458   1HG2  VAL  60          1HG2      VAL  60  -0.969  -0.690  -0.690
  459   2HG2  VAL  60          3HG2      VAL  60  -1.260  -0.925  -0.925
  460   3HG2  VAL  60          2HG2      VAL  60   0.288  -1.392  -1.392
  461    H    GLN  61           H        GLN  61  -3.426  -3.803  -3.803
  462    HA   GLN  61           HA       GLN  61  -4.487  -6.128  -6.128
  463   1HB   GLN  61          2HB       GLN  61  -5.105  -6.125  -6.125
  464   2HB   GLN  61          1HB       GLN  61  -6.190  -6.164  -6.164
  465   1HG   GLN  61          2HG       GLN  61  -5.833  -3.654  -3.654
  466   2HG   GLN  61          1HG       GLN  61  -5.097  -3.779  -3.779
  467   1HE2  GLN  61          2HE2      GLN  61  -8.406  -5.181  -5.181
  468   2HE2  GLN  61          1HE2      GLN  61  -6.874  -5.919  -5.919
  469    H    GLY  62           H        GLY  62  -3.809  -8.176  -8.176
  470   1HA   GLY  62          2HA       GLY  62  -2.712  -9.749  -9.749
  471   2HA   GLY  62          1HA       GLY  62  -1.602  -8.450  -8.450
  472    H    ILE  63           H        ILE  63  -1.474  -7.608  -7.608
  473    HA   ILE  63           HA       ILE  63   0.824  -9.072  -9.072
  474    HB   ILE  63           HB       ILE  63  -0.887  -7.169  -7.169
  475   1HG1  ILE  63          2HG1      ILE  63   0.088  -5.956  -5.956
  476   2HG1  ILE  63          1HG1      ILE  63   1.182  -5.691  -5.691
  477   1HG2  ILE  63          1HG2      ILE  63   1.370  -8.824  -8.824
  478   2HG2  ILE  63          3HG2      ILE  63   1.604  -7.108  -7.108
  479   3HG2  ILE  63          2HG2      ILE  63   0.195  -7.952  -7.952
  480   1HD1  ILE  63          2HD1      ILE  63   2.569  -7.584  -7.584
  481   2HD1  ILE  63          1HD1      ILE  63   1.566  -7.466  -7.466
  482   3HD1  ILE  63          3HD1      ILE  63   2.538  -6.087  -6.087
  483    H    ALA  64           H        ALA  64   1.175 -10.559 -10.559
  484    HA   ALA  64           HA       ALA  64  -1.092 -12.267 -12.267
  485   1HB   ALA  64          2HB       ALA  64   1.125 -13.152 -13.152
  486   2HB   ALA  64          1HB       ALA  64   1.778 -12.652 -12.652
  487   3HB   ALA  64          3HB       ALA  64   0.506 -13.872 -13.872
  488    H    ASP  65           H        ASP  65  -2.110 -12.469 -12.469
  489    HA   ASP  65           HA       ASP  65  -1.837 -10.531 -10.531
  490   1HB   ASP  65          2HB       ASP  65  -3.847 -12.074 -12.074
  491   2HB   ASP  65          1HB       ASP  65  -3.069 -13.223 -13.223
  492    H    ASP  66           H        ASP  66  -0.108 -13.430 -13.430
  493    HA   ASP  66           HA       ASP  66   0.661 -14.072 -14.072
  494   1HB   ASP  66          2HB       ASP  66   1.475 -14.847 -14.847
  495   2HB   ASP  66          1HB       ASP  66   2.753 -14.962 -14.962
  496    H    TYR  67           H        TYR  67   1.668 -11.628 -11.628
  497    HA   TYR  67           HA       TYR  67   4.259 -11.074 -11.074
  498   1HB   TYR  67          2HB       TYR  67   1.977  -9.241  -9.241
  499   2HB   TYR  67          1HB       TYR  67   3.607  -8.639  -8.639
  500    HD1  TYR  67           HD2      TYR  67   3.457 -11.917 -11.917
  501    HD2  TYR  67           HD1      TYR  67   3.369  -7.748  -7.748
  502    HE1  TYR  67           HE2      TYR  67   4.024 -12.379 -12.379
  503    HE2  TYR  67           HE1      TYR  67   3.931  -8.195  -8.195
  504    HH   TYR  67           HH       TYR  67   5.033  -9.982  -9.982
  505    H    ASP  68           H        ASP  68   5.157  -9.455  -9.455
  506    HA   ASP  68           HA       ASP  68   4.118  -9.706  -9.706
  507   1HB   ASP  68          2HB       ASP  68   6.324  -7.866  -7.866
  508   2HB   ASP  68          1HB       ASP  68   6.054  -8.453  -8.453
  509    H    LYS  69           H        LYS  69   2.004  -8.751  -8.751
  510    HA   LYS  69           HA       LYS  69   1.321  -6.294  -6.294
  511   1HB   LYS  69          2HB       LYS  69   0.279  -7.564  -7.564
  512   2HB   LYS  69          1HB       LYS  69  -0.523  -6.290  -6.290
  513   1HG   LYS  69          2HG       LYS  69  -0.757  -7.787  -7.787
  514   2HG   LYS  69          1HG       LYS  69   0.061  -9.066  -9.066
  515   1HD   LYS  69          2HD       LYS  69  -2.378  -7.743  -7.743
  516   2HD   LYS  69          1HD       LYS  69  -2.534  -9.022  -9.022
  517   1HE   LYS  69          2HE       LYS  69  -0.689  -9.628  -9.628
  518   2HE   LYS  69          1HE       LYS  69  -2.371  -9.427  -9.427
  519   1HZ   LYS  69          1HZ       LYS  69  -3.005 -11.083 -11.083
  520   2HZ   LYS  69          3HZ       LYS  69  -1.390 -11.275 -11.275
  521   3HZ   LYS  69          2HZ       LYS  69  -1.882 -11.724 -11.724
  522    H    LYS  70           H        LYS  70   2.838  -7.006  -7.006
  523    HA   LYS  70           HA       LYS  70   2.609  -4.452  -4.452
  524   1HB   LYS  70          2HB       LYS  70   4.703  -6.594  -6.594
  525   2HB   LYS  70          1HB       LYS  70   4.549  -5.162  -5.162
  526   1HG   LYS  70          2HG       LYS  70   3.107  -6.244  -6.244
  527   2HG   LYS  70          1HG       LYS  70   2.002  -6.357  -6.357
  528   1HD   LYS  70          2HD       LYS  70   3.669  -8.362  -8.362
  529   2HD   LYS  70          1HD       LYS  70   3.839  -8.381  -8.381
  530   1HE   LYS  70          2HE       LYS  70   1.962  -9.573  -9.573
  531   2HE   LYS  70          1HE       LYS  70   1.100  -8.133  -8.133
  532   1HZ   LYS  70          1HZ       LYS  70   1.736  -8.920  -8.920
  533   2HZ   LYS  70          3HZ       LYS  70   2.052 -10.417 -10.417
  534   3HZ   LYS  70          2HZ       LYS  70   0.499  -9.748  -9.748
  535    H    LYS  71           H        LYS  71   5.376  -5.932  -5.932
  536    HA   LYS  71           HA       LYS  71   6.692  -3.363  -3.363
  537   1HB   LYS  71          2HB       LYS  71   7.803  -5.674  -5.674
  538   2HB   LYS  71          1HB       LYS  71   7.593  -5.875  -5.875
  539   1HG   LYS  71          2HG       LYS  71   8.782  -3.561  -3.561
  540   2HG   LYS  71          1HG       LYS  71   9.346  -3.978  -3.978
  541   1HD   LYS  71          2HD       LYS  71   9.647  -5.813  -5.813
  542   2HD   LYS  71          1HD       LYS  71  10.872  -4.631  -4.631
  543   1HE   LYS  71          2HE       LYS  71  10.698  -5.737  -5.737
  544   2HE   LYS  71          1HE       LYS  71   9.950  -7.074  -7.074
  545   1HZ   LYS  71          3HZ       LYS  71  12.542  -5.959  -5.959
  546   2HZ   LYS  71          2HZ       LYS  71  12.466  -7.117  -7.117
  547   3HZ   LYS  71          1HZ       LYS  71  11.885  -7.487  -7.487
  548    H    LEU  72           H        LEU  72   4.162  -4.555  -4.555
  549    HA   LEU  72           HA       LEU  72   5.037  -3.989  -3.989
  550   1HB   LEU  72          2HB       LEU  72   3.297  -5.757  -5.757
  551   2HB   LEU  72          1HB       LEU  72   2.182  -4.404  -4.404
  552    HG   LEU  72           HG       LEU  72   3.677  -5.445  -5.445
  553   1HD1  LEU  72          2HD1      LEU  72   1.008  -5.891  -5.891
  554   2HD1  LEU  72          1HD1      LEU  72   1.027  -5.499  -5.499
  555   3HD1  LEU  72          3HD1      LEU  72   1.952  -6.876  -6.876
  556   1HD2  LEU  72          1HD2      LEU  72   2.017  -2.987  -2.987
  557   2HD2  LEU  72          3HD2      LEU  72   3.567  -3.154  -3.154
  558   3HD2  LEU  72          2HD2      LEU  72   2.094  -3.758  -3.758
  559    H    VAL  73           H        VAL  73   2.478  -2.682  -2.682
  560    HA   VAL  73           HA       VAL  73   2.394  -0.257  -0.257
  561    HB   VAL  73           HB       VAL  73   0.601   0.400   0.400
  562   1HG1  VAL  73          3HG1      VAL  73   0.449  -1.593  -1.593
  563   2HG1  VAL  73          2HG1      VAL  73  -0.972  -1.416  -1.416
  564   3HG1  VAL  73          1HG1      VAL  73  -0.334  -0.021  -0.021
  565   1HG2  VAL  73          1HG2      VAL  73   1.294  -1.394  -1.394
  566   2HG2  VAL  73          3HG2      VAL  73  -0.430  -1.353  -1.353
  567   3HG2  VAL  73          2HG2      VAL  73   0.604  -2.572  -2.572
  568    H    LYS  74           H        LYS  74   3.259  -1.251  -1.251
  569    HA   LYS  74           HA       LYS  74   3.674   1.232   1.232
  570   1HB   LYS  74          2HB       LYS  74   3.861  -1.048  -1.048
  571   2HB   LYS  74          1HB       LYS  74   5.486  -1.141  -1.141
  572   1HG   LYS  74          2HG       LYS  74   6.327   0.365   0.365
  573   2HG   LYS  74          1HG       LYS  74   4.825   1.287   1.287
  574   1HD   LYS  74          2HD       LYS  74   4.659   0.349   0.349
  575   2HD   LYS  74          1HD       LYS  74   4.052  -1.043  -1.043
  576   1HE   LYS  74          2HE       LYS  74   6.579  -1.672  -1.672
  577   2HE   LYS  74          1HE       LYS  74   6.744  -0.593  -0.593
  578   1HZ   LYS  74          3HZ       LYS  74   5.002  -1.938  -1.938
  579   2HZ   LYS  74          2HZ       LYS  74   5.064  -3.032  -3.032
  580   3HZ   LYS  74          1HZ       LYS  74   6.426  -2.796  -2.796
  581    H    ALA  75           H        ALA  75   5.795  -0.663  -0.663
  582    HA   ALA  75           HA       ALA  75   8.057   1.016   1.016
  583   1HB   ALA  75          3HB       ALA  75   7.178  -1.205  -1.205
  584   2HB   ALA  75          2HB       ALA  75   8.338  -0.096  -0.096
  585   3HB   ALA  75          1HB       ALA  75   8.733  -0.918  -0.918
  586    H    PHE  76           H        PHE  76   5.145   1.124   1.124
  587    HA   PHE  76           HA       PHE  76   6.019   2.993   2.993
  588   1HB   PHE  76          2HB       PHE  76   3.848   1.512   1.512
  589   2HB   PHE  76          1HB       PHE  76   3.170   2.920   2.920
  590    HD1  PHE  76           HD1      PHE  76   4.727   1.734   1.734
  591    HD2  PHE  76           HD2      PHE  76   2.576   4.868   4.868
  592    HE1  PHE  76           HE1      PHE  76   4.359   2.799   2.799
  593    HE2  PHE  76           HE2      PHE  76   2.204   5.941   5.941
  594    HZ   PHE  76           HZ       PHE  76   3.091   4.906   4.906
  595    H    LYS  77           H        LYS  77   4.006   3.449   3.449
  596    HA   LYS  77           HA       LYS  77   3.842   6.214   6.214
  597   1HB   LYS  77          2HB       LYS  77   3.971   4.451   4.451
  598   2HB   LYS  77          1HB       LYS  77   3.292   6.070   6.070
  599   1HG   LYS  77          2HG       LYS  77   1.324   5.237   5.237
  600   2HG   LYS  77          1HG       LYS  77   2.034   4.483   4.483
  601   1HD   LYS  77          2HD       LYS  77   1.830   2.462   2.462
  602   2HD   LYS  77          1HD       LYS  77   2.725   2.973   2.973
  603   1HE   LYS  77          2HE       LYS  77   0.825   3.468   3.468
  604   2HE   LYS  77          1HE       LYS  77  -0.115   3.817   3.817
  605   1HZ   LYS  77          2HZ       LYS  77   0.320   1.237   1.237
  606   2HZ   LYS  77          1HZ       LYS  77   0.368   1.272   1.272
  607   3HZ   LYS  77          3HZ       LYS  77  -1.007   1.822   1.822
  608    H    LYS  78           H        LYS  78   6.535   4.213   4.213
  609    HA   LYS  78           HA       LYS  78   7.920   6.369   6.369
  610   1HB   LYS  78          2HB       LYS  78   7.975   3.838   3.838
  611   2HB   LYS  78          1HB       LYS  78   9.152   3.724   3.724
  612   1HG   LYS  78          2HG       LYS  78  10.063   5.859   5.859
  613   2HG   LYS  78          1HG       LYS  78   9.445   4.752   4.752
  614   1HD   LYS  78          2HD       LYS  78  11.106   3.587   3.587
  615   2HD   LYS  78          1HD       LYS  78  11.928   4.592   4.592
  616   1HE   LYS  78          2HE       LYS  78  12.072   2.621   2.621
  617   2HE   LYS  78          1HE       LYS  78  10.461   3.086   3.086
  618   1HZ   LYS  78          2HZ       LYS  78   9.703   1.816   1.816
  619   2HZ   LYS  78          1HZ       LYS  78  11.227   1.087   1.087
  620   3HZ   LYS  78          3HZ       LYS  78  10.152   0.937   0.937
  621    H    LYS  79           H        LYS  79   7.689   5.017   5.017
  622    HA   LYS  79           HA       LYS  79  10.223   6.235   6.235
  623   1HB   LYS  79          2HB       LYS  79   9.333   3.813   3.813
  624   2HB   LYS  79          1HB       LYS  79   8.522   4.693   4.693
  625   1HG   LYS  79          2HG       LYS  79  10.977   5.701   5.701
  626   2HG   LYS  79          1HG       LYS  79  11.392   4.130   4.130
  627   1HD   LYS  79          2HD       LYS  79  10.854   3.047   3.047
  628   2HD   LYS  79          1HD       LYS  79   9.364   3.969   3.969
  629   1HE   LYS  79          2HE       LYS  79  12.134   4.927   4.927
  630   2HE   LYS  79          1HE       LYS  79  10.936   4.320   4.320
  631   1HZ   LYS  79          3HZ       LYS  79   9.462   6.165   6.165
  632   2HZ   LYS  79          2HZ       LYS  79  10.885   6.825   6.825
  633   3HZ   LYS  79          1HZ       LYS  79  10.721   6.616   6.616
  634    H    PHE  80           H        PHE  80   6.759   6.522   6.522
  635    HA   PHE  80           HA       PHE  80   7.237   8.805   8.805
  636   1HB   PHE  80          2HB       PHE  80   4.708   7.164   7.164
  637   2HB   PHE  80          1HB       PHE  80   5.123   8.384   8.384
  638    HD1  PHE  80           HD2      PHE  80   5.739   4.964   4.964
  639    HD2  PHE  80           HD1      PHE  80   6.623   7.892   7.892
  640    HE1  PHE  80           HE2      PHE  80   6.718   3.217   3.217
  641    HE2  PHE  80           HE1      PHE  80   7.604   6.152   6.152
  642    HZ   PHE  80           HZ       PHE  80   7.654   3.811   3.811
  643    H    ALA  81           H        ALA  81   6.006   7.861   7.861
  644    HA   ALA  81           HA       ALA  81   5.164   9.118   9.118
  645   1HB   ALA  81          1HB       ALA  81   6.534  10.968  10.968
  646   2HB   ALA  81          3HB       ALA  81   4.921  11.575  11.575
  647   3HB   ALA  81          2HB       ALA  81   5.428  11.388  11.388
  648    H    CYS  82           H        CYS  82   3.586   7.802   7.802
  649    HA   CYS  82           HA       CYS  82   1.093   9.340   9.340
  650   1HB   CYS  82          2HB       CYS  82   1.581   6.873   6.873
  651   2HB   CYS  82          1HB       CYS  82   0.314   8.080   8.080
  652    HG   CYS  82           HG       CYS  82   3.294   8.622   8.622
  653    H    ASN  83           H        ASN  83  -0.685   7.185   7.185
  654    HA   ASN  83           HA       ASN  83  -0.364   5.695   5.695
  655   1HB   ASN  83          2HB       ASN  83  -2.124   7.013   7.013
  656   2HB   ASN  83          1HB       ASN  83  -2.635   7.303   7.303
  657   1HD2  ASN  83          2HD2      ASN  83  -4.769   4.506   4.506
  658   2HD2  ASN  83          1HD2      ASN  83  -3.761   5.557   5.557
  659    H    GLY  84           H        GLY  84  -0.088   3.609   3.609
  660   1HA   GLY  84          2HA       GLY  84  -1.265   2.457   2.457
  661   2HA   GLY  84          1HA       GLY  84   0.134   1.815   1.815
  662    H    THR  85           H        THR  85  -3.013   1.253   1.253
  663    HA   THR  85           HA       THR  85  -3.382  -0.233  -0.233
  664    HB   THR  85           HB       THR  85  -5.748   0.121   0.121
  665    HG1  THR  85           HG1      THR  85  -6.744   0.830   0.830
  666   1HG2  THR  85          2HG2      THR  85  -3.990   2.448   2.448
  667   2HG2  THR  85          1HG2      THR  85  -5.671   2.787   2.787
  668   3HG2  THR  85          3HG2      THR  85  -5.275   2.037   2.037
  669    H    VAL  86           H        VAL  86  -4.473  -2.256  -2.256
  670    HA   VAL  86           HA       VAL  86  -4.179  -3.545  -3.545
  671    HB   VAL  86           HB       VAL  86  -2.783  -4.504  -4.504
  672   1HG1  VAL  86          1HG1      VAL  86  -4.888  -4.003  -4.003
  673   2HG1  VAL  86          3HG1      VAL  86  -5.002  -5.748  -5.748
  674   3HG1  VAL  86          2HG1      VAL  86  -3.510  -5.031  -5.031
  675   1HG2  VAL  86          2HG2      VAL  86  -3.847  -5.877  -5.877
  676   2HG2  VAL  86          1HG2      VAL  86  -3.238  -6.762  -6.762
  677   3HG2  VAL  86          3HG2      VAL  86  -4.968  -6.466  -6.466
  678    H    ILE  87           H        ILE  87  -5.985  -4.138  -4.138
  679    HA   ILE  87           HA       ILE  87  -8.387  -4.755  -4.755
  680    HB   ILE  87           HB       ILE  87  -9.801  -3.562  -3.562
  681   1HG1  ILE  87          2HG1      ILE  87  -7.338  -2.208  -2.208
  682   2HG1  ILE  87          1HG1      ILE  87  -7.942  -3.687  -3.687
  683   1HG2  ILE  87          2HG2      ILE  87  -7.696  -1.864  -1.864
  684   2HG2  ILE  87          1HG2      ILE  87  -9.243  -1.270  -1.270
  685   3HG2  ILE  87          3HG2      ILE  87  -9.202  -2.434  -2.434
  686   1HD1  ILE  87          2HD1      ILE  87  -9.616  -1.222  -1.222
  687   2HD1  ILE  87          1HD1      ILE  87  -8.690  -1.570  -1.570
  688   3HD1  ILE  87          3HD1      ILE  87  -9.992  -2.651  -2.651
  689    H    GLU  88           H        GLU  88  -9.973  -6.035  -6.035
  690    HA   GLU  88           HA       GLU  88  -8.793  -7.668  -7.668
  691   1HB   GLU  88          2HB       GLU  88  -9.480  -8.637  -8.637
  692   2HB   GLU  88          1HB       GLU  88 -11.093  -8.621  -8.621
  693   1HG   GLU  88          2HG       GLU  88 -10.099  -9.906  -9.906
  694   2HG   GLU  88          1HG       GLU  88  -8.681 -10.137 -10.137
  695    H    HIS  89           H        HIS  89  -9.577  -5.955  -5.955
  696    HA   HIS  89           HA       HIS  89 -12.235  -5.230  -5.230
  697   1HB   HIS  89          2HB       HIS  89  -9.964  -4.472  -4.472
  698   2HB   HIS  89          1HB       HIS  89 -10.561  -5.544  -5.544
  699    HD1  HIS  89           HD1      HIS  89 -12.280  -4.613  -4.613
  700    HD2  HIS  89           HD2      HIS  89 -11.820  -2.307  -2.307
  701    HE1  HIS  89           HE1      HIS  89 -13.692  -2.567  -2.567
  702    HE2  HIS  89           HE2      HIS  89 -13.352  -1.155  -1.155
  703    HA   PRO  90           HA       PRO  90 -14.041  -8.905  -8.905
  704   1HB   PRO  90          2HB       PRO  90 -16.417  -7.927  -7.927
  705   2HB   PRO  90          1HB       PRO  90 -15.960  -8.034  -8.034
  706   1HG   PRO  90          2HG       PRO  90 -15.955  -5.661  -5.661
  707   2HG   PRO  90          1HG       PRO  90 -16.459  -5.771  -5.771
  708   1HD   PRO  90          2HD       PRO  90 -14.005  -4.828  -4.828
  709   2HD   PRO  90          1HD       PRO  90 -14.331  -5.472  -5.472
  710    H    GLU  91           H        GLU  91 -13.735  -5.968  -5.968
  711    HA   GLU  91           HA       GLU  91 -14.434  -7.216  -7.216
  712   1HB   GLU  91          2HB       GLU  91 -13.793  -4.518  -4.518
  713   2HB   GLU  91          1HB       GLU  91 -13.152  -4.875  -4.875
  714   1HG   GLU  91          2HG       GLU  91 -16.006  -5.466  -5.466
  715   2HG   GLU  91          1HG       GLU  91 -15.500  -3.832  -3.832
  716    H    TYR  92           H        TYR  92 -11.563  -6.742  -6.742
  717    HA   TYR  92           HA       TYR  92  -9.950  -7.747  -7.747
  718   1HB   TYR  92          2HB       TYR  92  -8.712  -6.332  -6.332
  719   2HB   TYR  92          1HB       TYR  92  -8.132  -6.470  -6.470
  720    HD1  TYR  92           HD2      TYR  92 -10.585  -5.597  -5.597
  721    HD2  TYR  92           HD1      TYR  92  -8.698  -4.011  -4.011
  722    HE1  TYR  92           HE2      TYR  92 -11.518  -3.383  -3.383
  723    HE2  TYR  92           HE1      TYR  92  -9.626  -1.790  -1.790
  724    HH   TYR  92           HH       TYR  92 -12.039  -1.307  -1.307
  725    H    GLY  93           H        GLY  93 -10.213  -7.777  -7.777
  726   1HA   GLY  93          2HA       GLY  93 -10.215  -9.758  -9.758
  727   2HA   GLY  93          1HA       GLY  93  -9.468 -10.610 -10.610
  728    H    GLU  94           H        GLU  94  -8.952  -8.840  -8.840
  729    HA   GLU  94           HA       GLU  94  -7.109  -8.505  -8.505
  730   1HB   GLU  94          2HB       GLU  94  -6.551 -10.884 -10.884
  731   2HB   GLU  94          1HB       GLU  94  -5.066  -9.976  -9.976
  732   1HG   GLU  94          2HG       GLU  94  -4.975 -10.497 -10.497
  733   2HG   GLU  94          1HG       GLU  94  -6.691 -10.176 -10.176
  734    H    VAL  95           H        VAL  95  -6.788  -6.347  -6.347
  735    HA   VAL  95           HA       VAL  95  -4.489  -5.798  -5.798
  736    HB   VAL  95           HB       VAL  95  -5.593  -3.850  -3.850
  737   1HG1  VAL  95          1HG1      VAL  95  -5.739  -6.416  -6.416
  738   2HG1  VAL  95          3HG1      VAL  95  -7.456  -6.025  -6.025
  739   3HG1  VAL  95          2HG1      VAL  95  -6.387  -5.069  -5.069
  740   1HG2  VAL  95          2HG2      VAL  95  -8.031  -4.902  -4.902
  741   2HG2  VAL  95          1HG2      VAL  95  -7.270  -3.323  -3.323
  742   3HG2  VAL  95          3HG2      VAL  95  -8.089  -3.727  -3.727
  743    H    ILE  96           H        ILE  96  -3.281  -4.014  -4.014
  744    HA   ILE  96           HA       ILE  96  -3.779  -3.079  -3.079
  745    HB   ILE  96           HB       ILE  96  -1.435  -3.180  -3.180
  746   1HG1  ILE  96          2HG1      ILE  96  -2.010  -4.682  -4.682
  747   2HG1  ILE  96          1HG1      ILE  96  -0.363  -4.069  -4.069
  748   1HG2  ILE  96          3HG2      ILE  96  -1.808  -0.957  -0.957
  749   2HG2  ILE  96          2HG2      ILE  96  -0.218  -1.505  -1.505
  750   3HG2  ILE  96          1HG2      ILE  96  -1.359  -0.837  -0.837
  751   1HD1  ILE  96          2HD1      ILE  96  -1.878  -2.213  -2.213
  752   2HD1  ILE  96          1HD1      ILE  96  -2.237  -3.826  -3.826
  753   3HD1  ILE  96          3HD1      ILE  96  -0.569  -3.263  -3.263
  754    H    GLN  97           H        GLN  97  -4.679  -1.199  -1.199
  755    HA   GLN  97           HA       GLN  97  -5.193   0.687   0.687
  756   1HB   GLN  97          2HB       GLN  97  -6.752  -0.283  -0.283
  757   2HB   GLN  97          1HB       GLN  97  -6.454   1.415   1.415
  758   1HG   GLN  97          2HG       GLN  97  -7.205   1.863   1.863
  759   2HG   GLN  97          1HG       GLN  97  -7.816   0.210   0.210
  760   1HE2  GLN  97          2HE2      GLN  97 -10.819   1.349   1.349
  761   2HE2  GLN  97          1HE2      GLN  97  -9.949   0.439   0.439
  762    H    LEU  98           H        LEU  98  -3.772   2.243   2.243
  763    HA   LEU  98           HA       LEU  98  -2.298   3.311   3.311
  764   1HB   LEU  98          2HB       LEU  98  -1.883   3.136   3.136
  765   2HB   LEU  98          1HB       LEU  98  -1.455   4.695   4.695
  766    HG   LEU  98           HG       LEU  98   0.223   3.773   3.773
  767   1HD1  LEU  98          3HD1      LEU  98  -1.423   1.431   1.431
  768   2HD1  LEU  98          2HD1      LEU  98   0.229   1.005   1.005
  769   3HD1  LEU  98          1HD1      LEU  98  -0.088   1.837   1.837
  770   1HD2  LEU  98          3HD2      LEU  98   0.217   2.350   2.350
  771   2HD2  LEU  98          2HD2      LEU  98   0.890   3.942   3.942
  772   3HD2  LEU  98          1HD2      LEU  98   1.618   2.502   2.502
  773    H    GLN  99           H        GLN  99  -2.019   5.757   5.757
  774    HA   GLN  99           HA       GLN  99  -4.652   6.979   6.979
  775   1HB   GLN  99          2HB       GLN  99  -2.783   7.084   7.084
  776   2HB   GLN  99          1HB       GLN  99  -3.089   8.704   8.704
  777   1HG   GLN  99          2HG       GLN  99  -5.398   6.899   6.899
  778   2HG   GLN  99          1HG       GLN  99  -4.585   7.653   7.653
  779   1HE2  GLN  99          2HE2      GLN  99  -6.801   9.881   9.881
  780   2HE2  GLN  99          1HE2      GLN  99  -6.276   8.289   8.289
  781    H    GLY 100           H        GLY 100  -4.886   8.801   8.801
  782   1HA   GLY 100          2HA       GLY 100  -4.339  10.538  10.538
  783   2HA   GLY 100          1HA       GLY 100  -2.702  10.466  10.466
  784    H    ASP 101           H        ASP 101  -2.852  11.020  11.020
  785    HA   ASP 101           HA       ASP 101  -2.963   8.753   8.753
  786   1HB   ASP 101          2HB       ASP 101  -1.828  10.283  10.283
  787   2HB   ASP 101          1HB       ASP 101  -3.338  10.894  10.894
  788    H    GLN 102           H        GLN 102  -1.637   7.115   7.115
  789    HA   GLN 102           HA       GLN 102   1.246   7.691   7.691
  790   1HB   GLN 102          2HB       GLN 102  -0.540   5.968   5.968
  791   2HB   GLN 102          1HB       GLN 102   0.955   5.190   5.190
  792   1HG   GLN 102          2HG       GLN 102   0.908   6.359   6.359
  793   2HG   GLN 102          1HG       GLN 102   2.275   6.690   6.690
  794   1HE2  GLN 102          2HE2      GLN 102  -0.584   9.609   9.609
  795   2HE2  GLN 102          1HE2      GLN 102  -1.030   7.946   7.946
  796    H    ARG 103           H        ARG 103  -0.972   6.582   6.582
  797    HA   ARG 103           HA       ARG 103  -0.235   4.129   4.129
  798   1HB   ARG 103          2HB       ARG 103  -1.251   4.663   4.663
  799   2HB   ARG 103          1HB       ARG 103  -2.006   5.777   5.777
  800   1HG   ARG 103          2HG       ARG 103   0.334   6.538   6.538
  801   2HG   ARG 103          1HG       ARG 103  -1.345   6.733   6.733
  802   1HD   ARG 103          2HD       ARG 103  -1.090   7.835   7.835
  803   2HD   ARG 103          1HD       ARG 103   0.251   8.444   8.444
  804    HE   ARG 103           HE       ARG 103  -2.471   9.197   9.197
  805   1HH1  ARG 103          2HH1      ARG 103   0.369   8.587   8.587
  806   2HH1  ARG 103          1HH1      ARG 103  -0.118   9.652   9.652
  807   1HH2  ARG 103          1HH2      ARG 103  -3.114  10.598  10.598
  808   2HH2  ARG 103          2HH2      ARG 103  -2.095  10.794  10.794
  809    H    LYS 104           H        LYS 104   1.609   7.067   7.067
  810    HA   LYS 104           HA       LYS 104   3.532   5.853   5.853
  811   1HB   LYS 104          2HB       LYS 104   2.810   8.190   8.190
  812   2HB   LYS 104          1HB       LYS 104   3.485   8.632   8.632
  813   1HG   LYS 104          2HG       LYS 104   5.616   7.433   7.433
  814   2HG   LYS 104          1HG       LYS 104   4.808   8.199   8.199
  815   1HD   LYS 104          2HD       LYS 104   6.381   9.764   9.764
  816   2HD   LYS 104          1HD       LYS 104   4.768  10.324  10.324
  817   1HE   LYS 104          2HE       LYS 104   5.043   9.393   9.393
  818   2HE   LYS 104          1HE       LYS 104   6.632   8.769   8.769
  819   1HZ   LYS 104          3HZ       LYS 104   6.036  11.649  11.649
  820   2HZ   LYS 104          2HZ       LYS 104   6.486  10.977  10.977
  821   3HZ   LYS 104          1HZ       LYS 104   7.537  10.883  10.883
  822    H    ASN 105           H        ASN 105   3.114   6.553   6.553
  823    HA   ASN 105           HA       ASN 105   5.954   6.216   6.216
  824   1HB   ASN 105          2HB       ASN 105   3.563   6.931   6.931
  825   2HB   ASN 105          1HB       ASN 105   5.110   6.513   6.513
  826   1HD2  ASN 105          2HD2      ASN 105   4.455  10.176  10.176
  827   2HD2  ASN 105          1HD2      ASN 105   3.238   8.957   8.957
  828    H    ILE 106           H        ILE 106   2.932   4.465   4.465
  829    HA   ILE 106           HA       ILE 106   3.842   2.452   2.452
  830    HB   ILE 106           HB       ILE 106   1.457   2.872   2.872
  831   1HG1  ILE 106          2HG1      ILE 106   0.769   0.522   0.522
  832   2HG1  ILE 106          1HG1      ILE 106   2.347   0.051   0.051
  833   1HG2  ILE 106          1HG2      ILE 106   1.707   3.203   3.203
  834   2HG2  ILE 106          3HG2      ILE 106   1.919   1.462   1.462
  835   3HG2  ILE 106          2HG2      ILE 106   0.397   2.110   2.110
  836   1HD1  ILE 106          1HD1      ILE 106   2.641   1.594   1.594
  837   2HD1  ILE 106          3HD1      ILE 106   1.545   0.239   0.239
  838   3HD1  ILE 106          2HD1      ILE 106   3.173  -0.048  -0.048
  839    H    CYS 107           H        CYS 107   3.657   2.556   2.556
  840    HA   CYS 107           HA       CYS 107   4.615  -0.001  -0.001
  841   1HB   CYS 107          2HB       CYS 107   5.518   1.054   1.054
  842   2HB   CYS 107          1HB       CYS 107   3.803   1.306   1.306
  843    HG   CYS 107           HG       CYS 107   4.890   3.723   3.723
  844    H    GLN 108           H        GLN 108   6.257   2.931   2.931
  845    HA   GLN 108           HA       GLN 108   8.924   2.065   2.065
  846   1HB   GLN 108          2HB       GLN 108   7.597   4.281   4.281
  847   2HB   GLN 108          1HB       GLN 108   9.258   3.899   3.899
  848   1HG   GLN 108          2HG       GLN 108   8.694   4.188   4.188
  849   2HG   GLN 108          1HG       GLN 108   8.567   5.650   5.650
  850   1HE2  GLN 108          2HE2      GLN 108  12.200   3.809   3.809
  851   2HE2  GLN 108          1HE2      GLN 108  10.735   2.930   2.930
  852    H    PHE 109           H        PHE 109   6.801   2.119   2.119
  853    HA   PHE 109           HA       PHE 109   8.610   1.107   1.107
  854   1HB   PHE 109          2HB       PHE 109   6.474   2.232   2.232
  855   2HB   PHE 109          1HB       PHE 109   5.602   0.829   0.829
  856    HD1  PHE 109           HD2      PHE 109   8.212   1.749   1.749
  857    HD2  PHE 109           HD1      PHE 109   4.979  -0.821  -0.821
  858    HE1  PHE 109           HE2      PHE 109   8.327   0.730   0.730
  859    HE2  PHE 109           HE1      PHE 109   5.086  -1.845  -1.845
  860    HZ   PHE 109           HZ       PHE 109   6.760  -1.066  -1.066
  861    H    LEU 110           H        LEU 110   6.127  -0.546  -0.546
  862    HA   LEU 110           HA       LEU 110   6.477  -3.117  -3.117
  863   1HB   LEU 110          2HB       LEU 110   5.462  -1.939  -1.939
  864   2HB   LEU 110          1HB       LEU 110   5.857  -3.646  -3.646
  865    HG   LEU 110           HG       LEU 110   4.233  -4.155  -4.155
  866   1HD1  LEU 110          2HD1      LEU 110   4.679  -2.231  -2.231
  867   2HD1  LEU 110          1HD1      LEU 110   3.801  -1.192  -1.192
  868   3HD1  LEU 110          3HD1      LEU 110   2.955  -2.483  -2.483
  869   1HD2  LEU 110          1HD2      LEU 110   3.555  -3.275  -3.275
  870   2HD2  LEU 110          3HD2      LEU 110   2.380  -3.862  -3.862
  871   3HD2  LEU 110          2HD2      LEU 110   2.647  -2.129  -2.129
  872    H    VAL 111           H        VAL 111   8.408  -1.295  -1.295
  873    HA   VAL 111           HA       VAL 111  10.034  -3.640  -3.640
  874    HB   VAL 111           HB       VAL 111  10.188  -0.811  -0.811
  875   1HG1  VAL 111          2HG1      VAL 111  11.782  -3.279  -3.279
  876   2HG1  VAL 111          1HG1      VAL 111  11.578  -2.014  -2.014
  877   3HG1  VAL 111          3HG1      VAL 111  12.348  -1.642  -1.642
  878   1HG2  VAL 111          2HG2      VAL 111   8.583  -3.126  -3.126
  879   2HG2  VAL 111          1HG2      VAL 111   8.410  -1.434  -1.434
  880   3HG2  VAL 111          3HG2      VAL 111   9.517  -2.482  -2.482
  881    H    GLU 112           H        GLU 112  10.063  -0.777  -0.777
  882    HA   GLU 112           HA       GLU 112  12.896  -0.685  -0.685
  883   1HB   GLU 112          2HB       GLU 112  10.544   0.638   0.638
  884   2HB   GLU 112          1HB       GLU 112  12.163   0.799   0.799
  885   1HG   GLU 112          2HG       GLU 112  12.069   1.344   1.344
  886   2HG   GLU 112          1HG       GLU 112  11.015   2.403   2.403
  887    H    ILE 113           H        ILE 113  10.150  -2.053  -2.053
  888    HA   ILE 113           HA       ILE 113  11.919  -3.049  -3.049
  889    HB   ILE 113           HB       ILE 113   9.986  -3.660  -3.660
  890   1HG1  ILE 113          2HG1      ILE 113   8.389  -3.186  -3.186
  891   2HG1  ILE 113          1HG1      ILE 113   8.722  -4.750  -4.750
  892   1HG2  ILE 113          1HG2      ILE 113  10.518  -1.139  -1.139
  893   2HG2  ILE 113          3HG2      ILE 113   8.927  -1.199  -1.199
  894   3HG2  ILE 113          2HG2      ILE 113   9.105  -1.593  -1.593
  895   1HD1  ILE 113          1HD1      ILE 113   7.460  -2.881  -2.881
  896   2HD1  ILE 113          3HD1      ILE 113   6.487  -3.226  -3.226
  897   3HD1  ILE 113          2HD1      ILE 113   7.037  -4.546  -4.546
  898    H    GLY 114           H        GLY 114  10.309  -4.144  -4.144
  899   1HA   GLY 114          2HA       GLY 114  10.955  -6.140  -6.140
  900   2HA   GLY 114          1HA       GLY 114  11.441  -6.817  -6.817
  901    H    LEU 115           H        LEU 115   8.415  -5.146  -5.146
  902    HA   LEU 115           HA       LEU 115   6.956  -7.449  -7.449
  903   1HB   LEU 115          2HB       LEU 115   6.569  -4.752  -4.752
  904   2HB   LEU 115          1HB       LEU 115   5.433  -5.178  -5.178
  905    HG   LEU 115           HG       LEU 115   4.234  -6.645  -6.645
  906   1HD1  LEU 115          1HD1      LEU 115   6.608  -6.329  -6.329
  907   2HD1  LEU 115          3HD1      LEU 115   5.032  -6.735  -6.735
  908   3HD1  LEU 115          2HD1      LEU 115   5.778  -7.799  -7.799
  909   1HD2  LEU 115          2HD2      LEU 115   4.283  -3.972  -3.972
  910   2HD2  LEU 115          1HD2      LEU 115   3.187  -5.050  -5.050
  911   3HD2  LEU 115          3HD2      LEU 115   4.674  -4.496  -4.496
  912    H    ALA 116           H        ALA 116   6.345  -5.363  -5.363
  913    HA   ALA 116           HA       ALA 116   5.231  -7.652  -7.652
  914   1HB   ALA 116          3HB       ALA 116   4.193  -5.296  -5.296
  915   2HB   ALA 116          2HB       ALA 116   5.412  -4.873  -4.873
  916   3HB   ALA 116          1HB       ALA 116   4.233  -6.135  -6.135
  917    H    LYS 117           H        LYS 117   5.789  -6.929  -6.929
  918    HA   LYS 117           HA       LYS 117   8.719  -7.197  -7.197
  919   1HB   LYS 117          2HB       LYS 117   6.608  -8.904  -8.904
  920   2HB   LYS 117          1HB       LYS 117   7.778  -8.403  -8.403
  921   1HG   LYS 117          2HG       LYS 117   8.773  -9.457  -9.457
  922   2HG   LYS 117          1HG       LYS 117   8.133 -10.585 -10.585
  923   1HD   LYS 117          2HD       LYS 117  10.242 -10.565 -10.565
  924   2HD   LYS 117          1HD       LYS 117   9.744  -9.051  -9.051
  925   1HE   LYS 117          2HE       LYS 117  10.818  -7.751  -7.751
  926   2HE   LYS 117          1HE       LYS 117  10.854  -9.058  -9.058
  927   1HZ   LYS 117          2HZ       LYS 117  12.385 -10.183 -10.183
  928   2HZ   LYS 117          1HZ       LYS 117  12.603  -8.616  -8.616
  929   3HZ   LYS 117          3HZ       LYS 117  13.021  -8.978  -8.978
  930    H    ASP 118           H        ASP 118   9.775  -6.138  -6.138
  931    HA   ASP 118           HA       ASP 118   8.733  -3.703  -3.703
  932   1HB   ASP 118          2HB       ASP 118  10.624  -3.580  -3.580
  933   2HB   ASP 118          1HB       ASP 118  11.139  -4.199  -4.199
  934    H    ASP 119           H        ASP 119   8.542  -6.862  -6.862
  935    HA   ASP 119           HA       ASP 119   7.486  -5.896  -5.896
  936   1HB   ASP 119          2HB       ASP 119   8.760  -8.162  -8.162
  937   2HB   ASP 119          1HB       ASP 119   7.110  -8.730  -8.730
  938    H    GLN 120           H        GLN 120   6.264  -6.848  -6.848
  939    HA   GLN 120           HA       GLN 120   3.544  -7.183  -7.183
  940   1HB   GLN 120          2HB       GLN 120   4.757  -7.175  -7.175
  941   2HB   GLN 120          1HB       GLN 120   3.051  -7.445  -7.445
  942   1HG   GLN 120          2HG       GLN 120   3.754  -9.387  -9.387
  943   2HG   GLN 120          1HG       GLN 120   5.375  -9.176  -9.176
  944   1HE2  GLN 120          2HE2      GLN 120   2.430 -10.202 -10.202
  945   2HE2  GLN 120          1HE2      GLN 120   2.123  -9.045  -9.045
  946    H    LEU 121           H        LEU 121   5.504  -4.572  -4.572
  947    HA   LEU 121           HA       LEU 121   3.974  -2.834  -2.834
  948   1HB   LEU 121          2HB       LEU 121   5.834  -2.344  -2.344
  949   2HB   LEU 121          1HB       LEU 121   5.064  -1.025  -1.025
  950    HG   LEU 121           HG       LEU 121   6.759  -3.083  -3.083
  951   1HD1  LEU 121          3HD1      LEU 121   7.570  -0.567  -0.567
  952   2HD1  LEU 121          2HD1      LEU 121   8.490  -1.191  -1.191
  953   3HD1  LEU 121          1HD1      LEU 121   8.298  -2.172  -2.172
  954   1HD2  LEU 121          2HD2      LEU 121   5.176  -0.825  -0.825
  955   2HD2  LEU 121          1HD2      LEU 121   6.020  -2.020  -2.020
  956   3HD2  LEU 121          3HD2      LEU 121   6.870  -0.580  -0.580
  957    H    LYS 122           H        LYS 122   1.776  -2.999  -2.999
  958    HA   LYS 122           HA       LYS 122   0.875  -2.005  -2.005
  959   1HB   LYS 122          2HB       LYS 122  -0.116  -4.156  -4.156
  960   2HB   LYS 122          1HB       LYS 122  -1.358  -3.131  -3.131
  961   1HG   LYS 122          2HG       LYS 122   0.784  -4.543  -4.543
  962   2HG   LYS 122          1HG       LYS 122  -0.855  -5.151  -5.151
  963   1HD   LYS 122          2HD       LYS 122  -1.760  -3.665  -3.665
  964   2HD   LYS 122          1HD       LYS 122  -0.621  -2.388  -2.388
  965   1HE   LYS 122          2HE       LYS 122   1.138  -3.694  -3.694
  966   2HE   LYS 122          1HE       LYS 122  -0.159  -4.730  -4.730
  967   1HZ   LYS 122          2HZ       LYS 122   0.021  -1.796  -1.796
  968   2HZ   LYS 122          1HZ       LYS 122   0.398  -2.977  -2.977
  969   3HZ   LYS 122          3HZ       LYS 122  -1.193  -2.813  -2.813
  970    H    VAL 123           H        VAL 123   1.123   0.181   0.181
  971    HA   VAL 123           HA       VAL 123  -0.630   1.027   1.027
  972    HB   VAL 123           HB       VAL 123   1.661   1.919   1.919
  973   1HG1  VAL 123          3HG1      VAL 123   1.337   2.084   2.084
  974   2HG1  VAL 123          2HG1      VAL 123   1.167   3.770   3.770
  975   3HG1  VAL 123          1HG1      VAL 123   2.622   2.871   2.871
  976   1HG2  VAL 123          3HG2      VAL 123  -0.574   3.897   3.897
  977   2HG2  VAL 123          2HG2      VAL 123   0.057   3.261   3.261
  978   3HG2  VAL 123          1HG2      VAL 123   1.040   4.353   4.353
  979    H    HIS 124           H        HIS 124  -2.609   1.795   1.795
  980    HA   HIS 124           HA       HIS 124  -3.199   2.978   2.978
  981   1HB   HIS 124          2HB       HIS 124  -5.117   1.292   1.292
  982   2HB   HIS 124          1HB       HIS 124  -5.384   1.952   1.952
  983    HD1  HIS 124           HD1      HIS 124  -4.830   0.446   0.446
  984    HD2  HIS 124           HD2      HIS 124  -2.945  -0.707  -0.707
  985    HE1  HIS 124           HE1      HIS 124  -3.677  -1.725  -1.725
  986    HE2  HIS 124           HE2      HIS 124  -2.635  -2.455  -2.455
  987    H    GLY 125           H        GLY 125  -2.770   5.028   5.028
  988   1HA   GLY 125          2HA       GLY 125  -4.222   5.946   5.946
  989   2HA   GLY 125          1HA       GLY 125  -3.391   6.959   6.959
  990    H    PHE 126           HN       PHE 126  -6.302   6.401   6.401
  991    HA   PHE 126           HA       PHE 126  -8.180   6.266   6.266
  992   1HB   PHE 126          2HB       PHE 126  -9.741   7.113   7.113
  993   2HB   PHE 126          1HB       PHE 126  -8.509   6.370   6.370
  994    HD1  PHE 126           HD1      PHE 126  -6.447   8.604   8.604
  995    HD2  PHE 126           HD2      PHE 126 -10.626   8.632   8.632
  996    HE1  PHE 126           HE1      PHE 126  -6.191  10.720  10.720
  997    HE2  PHE 126           HE2      PHE 126 -10.377  10.748  10.748
  998    HZ   PHE 126           HZ       PHE 126  -8.159  11.796  11.796

  Start of MODEL    5
    1   1H    MET   1          3H        MET   1 -32.029  -0.582  -0.582
    2   2H    MET   1          2H        MET   1 -31.027  -1.881  -1.881
    3   3H    MET   1          1H        MET   1 -30.429  -0.272  -0.272
    4    HA   MET   1           HA       MET   1 -29.495  -1.238  -1.238
    5   1HB   MET   1          2HB       MET   1 -31.447  -3.049  -3.049
    6   2HB   MET   1          1HB       MET   1 -32.121  -2.081  -2.081
    7   1HG   MET   1          2HG       MET   1 -30.463  -2.648  -2.648
    8   2HG   MET   1          1HG       MET   1 -29.289  -2.963  -2.963
    9   1HE   MET   1          3HE       MET   1 -29.311  -4.646  -4.646
   10   2HE   MET   1          2HE       MET   1 -30.612  -5.813  -5.813
   11   3HE   MET   1          1HE       MET   1 -29.196  -6.255  -6.255
   12    H    ARG   2           H        ARG   2 -29.119   0.013   0.013
   13    HA   ARG   2           HA       ARG   2 -31.114   2.103   2.103
   14   1HB   ARG   2          2HB       ARG   2 -28.152   2.352   2.352
   15   2HB   ARG   2          1HB       ARG   2 -29.357   3.631   3.631
   16   1HG   ARG   2          2HG       ARG   2 -28.239   3.887   3.887
   17   2HG   ARG   2          1HG       ARG   2 -29.683   2.981   2.981
   18   1HD   ARG   2          2HD       ARG   2 -28.498   1.189   1.189
   19   2HD   ARG   2          1HD       ARG   2 -27.438   1.283   1.283
   20    HE   ARG   2           HE       ARG   2 -25.908   2.406   2.406
   21   1HH1  ARG   2          2HH1      ARG   2 -28.990   2.465   2.465
   22   2HH1  ARG   2          1HH1      ARG   2 -28.347   3.162   3.162
   23   1HH2  ARG   2          1HH2      ARG   2 -25.062   3.323   3.323
   24   2HH2  ARG   2          2HH2      ARG   2 -26.118   3.650   3.650
   25    H    GLY   3           H        GLY   3 -31.143  -0.451  -0.451
   26   1HA   GLY   3          2HA       GLY   3 -31.644  -1.129  -1.129
   27   2HA   GLY   3          1HA       GLY   3 -31.031   0.408   0.408
   28    H    SER   4           H        SER   4 -30.432  -2.894  -2.894
   29    HA   SER   4           HA       SER   4 -27.556  -2.570  -2.570
   30   1HB   SER   4          2HB       SER   4 -27.859  -5.244  -5.244
   31   2HB   SER   4          1HB       SER   4 -27.620  -4.220  -4.220
   32    HG   SER   4           HG       SER   4 -29.755  -4.329  -4.329
   33    H    HIS   5           H        HIS   5 -28.510  -1.678  -1.678
   34    HA   HIS   5           HA       HIS   5 -27.866  -3.537  -3.537
   35   1HB   HIS   5          2HB       HIS   5 -30.026  -3.731  -3.731
   36   2HB   HIS   5          1HB       HIS   5 -30.120  -4.394  -4.394
   37    HD1  HIS   5           HD1      HIS   5 -31.398  -2.901  -2.901
   38    HD2  HIS   5           HD2      HIS   5 -31.772  -1.679  -1.679
   39    HE1  HIS   5           HE1      HIS   5 -33.344  -1.309  -1.309
   40    HE2  HIS   5           HE2      HIS   5 -33.504  -0.525  -0.525
   41    H    HIS   6           H        HIS   6 -27.450  -2.532  -2.532
   42    HA   HIS   6           HA       HIS   6 -28.327   0.230   0.230
   43   1HB   HIS   6          2HB       HIS   6 -25.869  -0.219  -0.219
   44   2HB   HIS   6          1HB       HIS   6 -25.479  -0.207  -0.207
   45    HD1  HIS   6           HD1      HIS   6 -25.124   2.006   2.006
   46    HD2  HIS   6           HD2      HIS   6 -27.285   2.270   2.270
   47    HE1  HIS   6           HE1      HIS   6 -25.409   4.467   4.467
   48    HE2  HIS   6           HE2      HIS   6 -26.658   4.604   4.604
   49    H    HIS   7           H        HIS   7 -26.450  -2.463  -2.463
   50    HA   HIS   7           HA       HIS   7 -27.952  -2.403  -2.403
   51   1HB   HIS   7          2HB       HIS   7 -25.459  -0.910  -0.910
   52   2HB   HIS   7          1HB       HIS   7 -25.402  -2.153  -2.153
   53    HD1  HIS   7           HD1      HIS   7 -28.040  -2.060  -2.060
   54    HD2  HIS   7           HD2      HIS   7 -26.160   1.392   1.392
   55    HE1  HIS   7           HE1      HIS   7 -29.058  -0.179  -0.179
   56    HE2  HIS   7           HE2      HIS   7 -27.955   1.907   1.907
   57    H    HIS   8           H        HIS   8 -24.794  -3.401  -3.401
   58    HA   HIS   8           HA       HIS   8 -24.864  -5.905  -5.905
   59   1HB   HIS   8          2HB       HIS   8 -22.911  -4.361  -4.361
   60   2HB   HIS   8          1HB       HIS   8 -22.936  -5.982  -5.982
   61    HD1  HIS   8           HD1      HIS   8 -22.438  -4.225  -4.225
   62    HD2  HIS   8           HD2      HIS   8 -21.707  -7.903  -7.903
   63    HE1  HIS   8           HE1      HIS   8 -21.010  -5.497  -5.497
   64    HE2  HIS   8           HE2      HIS   8 -20.511  -7.686  -7.686
   65    H    HIS   9           H        HIS   9 -25.312  -7.918  -7.918
   66    HA   HIS   9           HA       HIS   9 -26.400  -8.041  -8.041
   67   1HB   HIS   9          2HB       HIS   9 -27.440  -9.106  -9.106
   68   2HB   HIS   9          1HB       HIS   9 -27.708 -10.066 -10.066
   69    HD1  HIS   9           HD1      HIS   9 -27.738  -6.547  -6.547
   70    HD2  HIS   9           HD2      HIS   9 -30.483  -9.289  -9.289
   71    HE1  HIS   9           HE1      HIS   9 -29.997  -5.507  -5.507
   72    HE2  HIS   9           HE2      HIS   9 -31.646  -7.223  -7.223
   73    H    HIS  10           H        HIS  10 -26.175 -10.065 -10.065
   74    HA   HIS  10           HA       HIS  10 -24.488 -12.122 -12.122
   75   1HB   HIS  10          2HB       HIS  10 -22.800 -11.830 -11.830
   76   2HB   HIS  10          1HB       HIS  10 -22.661 -10.754 -10.754
   77    HD1  HIS  10           HD1      HIS  10 -25.292 -10.089 -10.089
   78    HD2  HIS  10           HD2      HIS  10 -21.472  -8.768  -8.768
   79    HE1  HIS  10           HE1      HIS  10 -24.938  -8.003  -8.003
   80    HE2  HIS  10           HE2      HIS  10 -22.655  -7.172  -7.172
   81    H    THR  11           H        THR  11 -26.967 -12.501 -12.501
   82    HA   THR  11           HA       THR  11 -26.742 -13.704 -13.704
   83    HB   THR  11           HB       THR  11 -29.424 -13.535 -13.535
   84    HG1  THR  11           HG1      THR  11 -29.103 -12.344 -12.344
   85   1HG2  THR  11          2HG2      THR  11 -27.980 -12.664 -12.664
   86   2HG2  THR  11          1HG2      THR  11 -27.955 -11.141 -11.141
   87   3HG2  THR  11          3HG2      THR  11 -29.489 -11.821 -11.821
   88    H    ASP  12           H        ASP  12 -26.089 -15.733 -15.733
   89    HA   ASP  12           HA       ASP  12 -27.740 -17.179 -17.179
   90   1HB   ASP  12          2HB       ASP  12 -25.157 -18.105 -18.105
   91   2HB   ASP  12          1HB       ASP  12 -25.952 -18.770 -18.770
   92    HA   PRO  13           HA       PRO  13 -30.024 -19.197 -19.197
   93   1HB   PRO  13          2HB       PRO  13 -30.113 -21.430 -21.430
   94   2HB   PRO  13          1HB       PRO  13 -31.434 -20.640 -20.640
   95   1HG   PRO  13          2HG       PRO  13 -31.012 -20.142 -20.142
   96   2HG   PRO  13          1HG       PRO  13 -31.503 -18.849 -18.849
   97   1HD   PRO  13          2HD       PRO  13 -28.817 -19.429 -19.429
   98   2HD   PRO  13          1HD       PRO  13 -29.585 -17.866 -17.866
   99    H    MET  14           H        MET  14 -27.448 -20.847 -20.847
  100    HA   MET  14           HA       MET  14 -27.110 -23.059 -23.059
  101   1HB   MET  14          2HB       MET  14 -25.182 -21.526 -21.526
  102   2HB   MET  14          1HB       MET  14 -24.688 -22.954 -22.954
  103   1HG   MET  14          2HG       MET  14 -26.832 -23.962 -23.962
  104   2HG   MET  14          1HG       MET  14 -26.414 -22.713 -22.713
  105   1HE   MET  14          3HE       MET  14 -26.536 -25.986 -25.986
  106   2HE   MET  14          2HE       MET  14 -26.164 -25.432 -25.432
  107   3HE   MET  14          1HE       MET  14 -25.118 -26.613 -26.613
  108    H    SER  15           H        SER  15 -26.205 -19.739 -19.739
  109    HA   SER  15           HA       SER  15 -24.281 -20.201 -20.201
  110   1HB   SER  15          2HB       SER  15 -24.232 -17.840 -17.840
  111   2HB   SER  15          1HB       SER  15 -24.483 -18.113 -18.113
  112    HG   SER  15           HG       SER  15 -25.998 -16.724 -16.724
  113    H    ALA  16           H        ALA  16 -27.741 -19.880 -19.880
  114    HA   ALA  16           HA       ALA  16 -27.955 -19.559 -19.559
  115   1HB   ALA  16          2HB       ALA  16 -30.014 -19.644 -19.644
  116   2HB   ALA  16          1HB       ALA  16 -30.418 -19.530 -19.530
  117   3HB   ALA  16          3HB       ALA  16 -29.489 -18.246 -18.246
  118    H    ILE  17           H        ILE  17 -26.697 -21.883 -21.883
  119    HA   ILE  17           HA       ILE  17 -28.778 -23.923 -23.923
  120    HB   ILE  17           HB       ILE  17 -26.028 -24.421 -24.421
  121   1HG1  ILE  17          2HG1      ILE  17 -28.701 -24.360 -24.360
  122   2HG1  ILE  17          1HG1      ILE  17 -27.451 -23.129 -23.129
  123   1HG2  ILE  17          2HG2      ILE  17 -27.638 -26.172 -26.172
  124   2HG2  ILE  17          1HG2      ILE  17 -28.176 -26.388 -26.388
  125   3HG2  ILE  17          3HG2      ILE  17 -26.479 -26.621 -26.621
  126   1HD1  ILE  17          1HD1      ILE  17 -26.887 -25.985 -25.985
  127   2HD1  ILE  17          3HD1      ILE  17 -27.645 -24.892 -24.892
  128   3HD1  ILE  17          2HD1      ILE  17 -26.043 -24.527 -24.527
  129    H    GLN  18           H        GLN  18 -28.868 -24.235 -24.235
  130    HA   GLN  18           HA       GLN  18 -28.264 -24.766 -24.766
  131   1HB   GLN  18          2HB       GLN  18 -26.974 -26.538 -26.538
  132   2HB   GLN  18          1HB       GLN  18 -25.553 -25.611 -25.611
  133   1HG   GLN  18          2HG       GLN  18 -26.086 -25.956 -25.956
  134   2HG   GLN  18          1HG       GLN  18 -27.518 -26.877 -26.877
  135   1HE2  GLN  18          2HE2      GLN  18 -23.799 -28.523 -28.523
  136   2HE2  GLN  18          1HE2      GLN  18 -24.013 -26.818 -26.818
  137    H    ASN  19           H        ASN  19 -27.743 -22.111 -22.111
  138    HA   ASN  19           HA       ASN  19 -25.328 -21.361 -21.361
  139   1HB   ASN  19          2HB       ASN  19 -26.023 -20.616 -20.616
  140   2HB   ASN  19          1HB       ASN  19 -26.764 -19.310 -19.310
  141   1HD2  ASN  19          2HD2      ASN  19 -23.465 -18.464 -18.464
  142   2HD2  ASN  19          1HD2      ASN  19 -24.979 -19.012 -19.012
  143    H    LEU  20           H        LEU  20 -27.896 -22.075 -22.075
  144    HA   LEU  20           HA       LEU  20 -28.268 -19.610 -19.610
  145   1HB   LEU  20          2HB       LEU  20 -30.146 -20.512 -20.512
  146   2HB   LEU  20          1HB       LEU  20 -30.754 -21.097 -21.097
  147    HG   LEU  20           HG       LEU  20 -30.559 -18.741 -18.741
  148   1HD1  LEU  20          1HD1      LEU  20 -29.008 -18.240 -18.240
  149   2HD1  LEU  20          3HD1      LEU  20 -30.558 -17.739 -17.739
  150   3HD1  LEU  20          2HD1      LEU  20 -29.957 -16.989 -16.989
  151   1HD2  LEU  20          3HD2      LEU  20 -32.386 -19.222 -19.222
  152   2HD2  LEU  20          2HD2      LEU  20 -32.696 -19.678 -19.678
  153   3HD2  LEU  20          1HD2      LEU  20 -32.601 -17.975 -17.975
  154    H    HIS  21           H        HIS  21 -26.793 -22.035 -22.035
  155    HA   HIS  21           HA       HIS  21 -28.281 -22.977 -22.977
  156   1HB   HIS  21          2HB       HIS  21 -28.147 -24.731 -24.731
  157   2HB   HIS  21          1HB       HIS  21 -26.391 -24.619 -24.619
  158    HD1  HIS  21           HD1      HIS  21 -28.779 -24.803 -24.803
  159    HD2  HIS  21           HD2      HIS  21 -25.708 -26.971 -26.971
  160    HE1  HIS  21           HE1      HIS  21 -28.330 -26.727 -26.727
  161    HE2  HIS  21           HE2      HIS  21 -26.421 -27.987 -27.987
  162    H    SER  22           H        SER  22 -26.158 -20.854 -20.854
  163    HA   SER  22           HA       SER  22 -24.292 -20.028 -20.028
  164   1HB   SER  22          2HB       SER  22 -24.141 -20.316 -20.316
  165   2HB   SER  22          1HB       SER  22 -25.853 -20.540 -20.540
  166    HG   SER  22           HG       SER  22 -24.415 -22.176 -22.176
  167    H    PHE  23           H        PHE  23 -22.332 -21.043 -21.043
  168    HA   PHE  23           HA       PHE  23 -20.376 -22.201 -22.201
  169   1HB   PHE  23          2HB       PHE  23 -21.791 -24.110 -24.110
  170   2HB   PHE  23          1HB       PHE  23 -22.158 -24.368 -24.368
  171    HD1  PHE  23           HD2      PHE  23 -19.361 -24.328 -24.328
  172    HD2  PHE  23           HD1      PHE  23 -20.807 -25.740 -25.740
  173    HE1  PHE  23           HE2      PHE  23 -17.409 -25.815 -25.815
  174    HE2  PHE  23           HE1      PHE  23 -18.859 -27.230 -27.230
  175    HZ   PHE  23           HZ       PHE  23 -17.156 -27.268 -27.268
  176    H    ASP  24           H        ASP  24 -19.114 -21.132 -21.132
  177    HA   ASP  24           HA       ASP  24 -18.413 -22.344 -22.344
  178   1HB   ASP  24          2HB       ASP  24 -20.547 -20.317 -20.317
  179   2HB   ASP  24          1HB       ASP  24 -19.212 -20.060 -20.060
  180    HA   PRO  25           HA       PRO  25 -14.732 -19.984 -19.984
  181   1HB   PRO  25          2HB       PRO  25 -14.983 -19.201 -19.201
  182   2HB   PRO  25          1HB       PRO  25 -13.628 -19.955 -19.955
  183   1HG   PRO  25          2HG       PRO  25 -15.185 -21.383 -21.383
  184   2HG   PRO  25          1HG       PRO  25 -14.564 -22.073 -22.073
  185   1HD   PRO  25          2HD       PRO  25 -17.301 -21.077 -21.077
  186   2HD   PRO  25          1HD       PRO  25 -16.808 -22.435 -22.435
  187    H    PHE  26           H        PHE  26 -17.510 -18.500 -18.500
  188    HA   PHE  26           HA       PHE  26 -16.513 -15.844 -15.844
  189   1HB   PHE  26          2HB       PHE  26 -18.533 -15.170 -15.170
  190   2HB   PHE  26          1HB       PHE  26 -16.935 -15.535 -15.535
  191    HD1  PHE  26           HD1      PHE  26 -16.501 -17.874 -17.874
  192    HD2  PHE  26           HD2      PHE  26 -20.403 -16.398 -16.398
  193    HE1  PHE  26           HE1      PHE  26 -17.468 -19.631 -19.631
  194    HE2  PHE  26           HE2      PHE  26 -21.378 -18.153 -18.153
  195    HZ   PHE  26           HZ       PHE  26 -19.910 -19.773 -19.773
  196    H    ALA  27           H        ALA  27 -17.513 -17.396 -17.396
  197    HA   ALA  27           HA       ALA  27 -19.544 -15.769 -15.769
  198   1HB   ALA  27          3HB       ALA  27 -20.819 -17.178 -17.178
  199   2HB   ALA  27          2HB       ALA  27 -20.568 -18.525 -18.525
  200   3HB   ALA  27          1HB       ALA  27 -21.465 -17.101 -17.101
  201    H    ASP  28           H        ASP  28 -17.693 -15.922 -15.922
  202    HA   ASP  28           HA       ASP  28 -18.204 -17.972 -17.972
  203   1HB   ASP  28          2HB       ASP  28 -15.874 -17.993 -17.993
  204   2HB   ASP  28          1HB       ASP  28 -15.410 -17.848 -17.848
  205    H    ALA  29           H        ALA  29 -16.648 -17.531 -17.531
  206    HA   ALA  29           HA       ALA  29 -15.967 -14.734 -14.734
  207   1HB   ALA  29          1HB       ALA  29 -18.285 -16.009 -16.009
  208   2HB   ALA  29          3HB       ALA  29 -17.378 -14.704 -14.704
  209   3HB   ALA  29          2HB       ALA  29 -18.183 -14.432 -14.432
  210    H    SER  30           H        SER  30 -14.973 -14.323 -14.323
  211    HA   SER  30           HA       SER  30 -14.224 -16.398 -16.398
  212   1HB   SER  30          2HB       SER  30 -12.880 -16.728 -16.728
  213   2HB   SER  30          1HB       SER  30 -11.785 -15.613 -15.613
  214    HG   SER  30           HG       SER  30 -11.782 -18.127 -18.127
  215    H    LYS  31           H        LYS  31 -11.837 -15.588 -15.588
  216    HA   LYS  31           HA       LYS  31 -11.777 -12.710 -12.710
  217   1HB   LYS  31          2HB       LYS  31 -11.949 -12.893 -12.893
  218   2HB   LYS  31          1HB       LYS  31 -13.447 -13.062 -13.062
  219   1HG   LYS  31          2HG       LYS  31 -13.290 -15.499 -15.499
  220   2HG   LYS  31          1HG       LYS  31 -11.804 -15.311 -15.311
  221   1HD   LYS  31          2HD       LYS  31 -14.407 -14.035 -14.035
  222   2HD   LYS  31          1HD       LYS  31 -13.939 -15.657 -15.657
  223   1HE   LYS  31          2HE       LYS  31 -11.699 -14.276 -14.276
  224   2HE   LYS  31          1HE       LYS  31 -12.919 -13.025 -13.025
  225   1HZ   LYS  31          2HZ       LYS  31 -13.874 -15.354 -15.354
  226   2HZ   LYS  31          1HZ       LYS  31 -12.267 -15.177 -15.177
  227   3HZ   LYS  31          3HZ       LYS  31 -13.377 -13.928 -13.928
  228    H    GLY  32           H        GLY  32  -9.712 -12.129 -12.129
  229   1HA   GLY  32          2HA       GLY  32  -7.493 -12.108 -12.108
  230   2HA   GLY  32          1HA       GLY  32  -7.814 -13.518 -13.518
  231    H    ASP  33           H        ASP  33  -6.118 -14.785 -14.785
  232    HA   ASP  33           HA       ASP  33  -6.312 -16.309 -16.309
  233   1HB   ASP  33          2HB       ASP  33  -5.271 -13.911 -13.911
  234   2HB   ASP  33          1HB       ASP  33  -3.795 -14.756 -14.756
  235    H    ASP  34           H        ASP  34  -5.987 -18.046 -18.046
  236    HA   ASP  34           HA       ASP  34  -4.851 -19.630 -19.630
  237   1HB   ASP  34          2HB       ASP  34  -3.234 -19.194 -19.194
  238   2HB   ASP  34          1HB       ASP  34  -2.298 -18.242 -18.242
  239    H    LEU  35           H        LEU  35  -5.768 -18.555 -18.555
  240    HA   LEU  35           HA       LEU  35  -4.091 -16.786 -16.786
  241   1HB   LEU  35          2HB       LEU  35  -6.822 -17.738 -17.738
  242   2HB   LEU  35          1HB       LEU  35  -6.084 -17.802 -17.802
  243    HG   LEU  35           HG       LEU  35  -5.542 -15.424 -15.424
  244   1HD1  LEU  35          1HD1      LEU  35  -5.334 -15.466 -15.466
  245   2HD1  LEU  35          3HD1      LEU  35  -7.089 -15.302 -15.302
  246   3HD1  LEU  35          2HD1      LEU  35  -6.104 -14.049 -14.049
  247   1HD2  LEU  35          1HD2      LEU  35  -7.911 -16.452 -16.452
  248   2HD2  LEU  35          3HD2      LEU  35  -7.623 -14.712 -14.712
  249   3HD2  LEU  35          2HD2      LEU  35  -8.401 -15.486 -15.486
  250    H    LEU  36           H        LEU  36  -2.444 -17.419 -17.419
  251    HA   LEU  36           HA       LEU  36  -2.001 -20.189 -20.189
  252   1HB   LEU  36          2HB       LEU  36  -0.462 -17.837 -17.837
  253   2HB   LEU  36          1HB       LEU  36   0.090 -19.492 -19.492
  254    HG   LEU  36           HG       LEU  36  -0.642 -17.820 -17.820
  255   1HD1  LEU  36          1HD1      LEU  36   1.248 -16.943 -16.943
  256   2HD1  LEU  36          3HD1      LEU  36   2.198 -18.147 -18.147
  257   3HD1  LEU  36          2HD1      LEU  36   1.404 -16.843 -16.843
  258   1HD2  LEU  36          3HD2      LEU  36  -0.230 -20.453 -20.453
  259   2HD2  LEU  36          2HD2      LEU  36   0.255 -19.486 -19.486
  260   3HD2  LEU  36          1HD2      LEU  36   1.444 -19.919 -19.919
  261    HA   PRO  37           HA       PRO  37  -3.802 -20.410 -20.410
  262   1HB   PRO  37          2HB       PRO  37  -2.123 -22.127 -22.127
  263   2HB   PRO  37          1HB       PRO  37  -3.260 -22.643 -22.643
  264   1HG   PRO  37          2HG       PRO  37  -0.331 -22.065 -22.065
  265   2HG   PRO  37          1HG       PRO  37  -1.264 -23.400 -23.400
  266   1HD   PRO  37          2HD       PRO  37  -0.538 -21.223 -21.223
  267   2HD   PRO  37          1HD       PRO  37  -2.047 -22.107 -22.107
  268    H    ALA  38           H        ALA  38  -0.375 -19.654 -19.654
  269    HA   ALA  38           HA       ALA  38  -0.669 -17.901 -17.901
  270   1HB   ALA  38          1HB       ALA  38   0.716 -20.301 -20.301
  271   2HB   ALA  38          3HB       ALA  38   1.975 -19.082 -19.082
  272   3HB   ALA  38          2HB       ALA  38   0.835 -18.960 -18.960
  273    H    GLY  39           H        GLY  39  -0.885 -16.403 -16.403
  274   1HA   GLY  39          2HA       GLY  39   1.795 -15.567 -15.567
  275   2HA   GLY  39          1HA       GLY  39   0.381 -15.498 -15.498
  276    H    THR  40           H        THR  40   0.061 -14.700 -14.700
  277    HA   THR  40           HA       THR  40  -0.250 -11.870 -11.870
  278    HB   THR  40           HB       THR  40  -1.561 -11.981 -11.981
  279    HG1  THR  40           HG1      THR  40  -1.478 -14.065 -14.065
  280   1HG2  THR  40          2HG2      THR  40  -2.731 -12.868 -12.868
  281   2HG2  THR  40          1HG2      THR  40  -3.652 -12.346 -12.346
  282   3HG2  THR  40          3HG2      THR  40  -2.590 -11.209 -11.209
  283    H    GLU  41           H        GLU  41   1.514 -14.071 -14.071
  284    HA   GLU  41           HA       GLU  41   3.248 -13.803 -13.803
  285   1HB   GLU  41          2HB       GLU  41   3.265 -11.418 -11.418
  286   2HB   GLU  41          1HB       GLU  41   3.843 -11.069 -11.069
  287   1HG   GLU  41          2HG       GLU  41   5.002 -13.508 -13.508
  288   2HG   GLU  41          1HG       GLU  41   5.284 -12.166 -12.166
  289    H    ASP  42           H        ASP  42   0.299 -12.925 -12.925
  290    HA   ASP  42           HA       ASP  42  -0.880 -12.117 -12.117
  291   1HB   ASP  42          2HB       ASP  42   0.843 -13.996 -13.996
  292   2HB   ASP  42          1HB       ASP  42   1.333 -12.625 -12.625
  293    H    TYR  43           H        TYR  43  -0.111 -10.003 -10.003
  294    HA   TYR  43           HA       TYR  43   1.732  -8.276  -8.276
  295   1HB   TYR  43          2HB       TYR  43  -0.855  -7.577  -7.577
  296   2HB   TYR  43          1HB       TYR  43   0.465  -6.455  -6.455
  297    HD1  TYR  43           HD2      TYR  43   2.551  -8.827  -8.827
  298    HD2  TYR  43           HD1      TYR  43  -0.682  -7.028  -7.028
  299    HE1  TYR  43           HE2      TYR  43   3.589  -9.466  -9.466
  300    HE2  TYR  43           HE1      TYR  43   0.352  -7.661  -7.661
  301    HH   TYR  43           HH       TYR  43   1.951  -9.331  -9.331
  302    H    ILE  44           H        ILE  44   1.197  -6.206  -6.206
  303    HA   ILE  44           HA       ILE  44  -0.755  -6.758  -6.758
  304    HB   ILE  44           HB       ILE  44   1.814  -5.178  -5.178
  305   1HG1  ILE  44          2HG1      ILE  44   2.224  -7.566  -7.566
  306   2HG1  ILE  44          1HG1      ILE  44   2.481  -6.975  -6.975
  307   1HG2  ILE  44          1HG2      ILE  44  -0.258  -5.774  -5.774
  308   2HG2  ILE  44          3HG2      ILE  44   1.306  -5.011  -5.011
  309   3HG2  ILE  44          2HG2      ILE  44   0.097  -4.194  -4.194
  310   1HD1  ILE  44          1HD1      ILE  44   0.008  -7.700  -7.700
  311   2HD1  ILE  44          3HD1      ILE  44   0.313  -8.707  -8.707
  312   3HD1  ILE  44          2HD1      ILE  44   1.301  -8.899  -8.899
  313    H    HIS  45           H        HIS  45  -2.482  -5.730  -5.730
  314    HA   HIS  45           HA       HIS  45  -2.443  -3.206  -3.206
  315   1HB   HIS  45          2HB       HIS  45  -4.360  -5.206  -5.206
  316   2HB   HIS  45          1HB       HIS  45  -4.989  -3.674  -3.674
  317    HD1  HIS  45           HD1      HIS  45  -3.783  -5.299  -5.299
  318    HD2  HIS  45           HD2      HIS  45  -5.973  -2.000  -2.000
  319    HE1  HIS  45           HE1      HIS  45  -4.764  -4.306  -4.306
  320    HE2  HIS  45           HE2      HIS  45  -6.149  -2.356  -2.356
  321    H    ILE  46           H        ILE  46  -2.587  -1.195  -1.195
  322    HA   ILE  46           HA       ILE  46  -2.512  -0.758  -0.758
  323    HB   ILE  46           HB       ILE  46  -2.005   1.192   1.192
  324   1HG1  ILE  46          2HG1      ILE  46  -0.365  -0.708  -0.708
  325   2HG1  ILE  46          1HG1      ILE  46   0.328   0.901   0.901
  326   1HG2  ILE  46          2HG2      ILE  46  -2.281   1.527   1.527
  327   2HG2  ILE  46          1HG2      ILE  46  -0.798   2.213   2.213
  328   3HG2  ILE  46          3HG2      ILE  46  -2.363   2.721   2.721
  329   1HD1  ILE  46          2HD1      ILE  46  -0.265   0.295   0.295
  330   2HD1  ILE  46          1HD1      ILE  46   0.142  -1.290  -1.290
  331   3HD1  ILE  46          3HD1      ILE  46   1.300   0.035   0.035
  332    H    ARG  47           H        ARG  47  -3.711   1.826   1.826
  333    HA   ARG  47           HA       ARG  47  -5.808   2.646   2.646
  334   1HB   ARG  47          2HB       ARG  47  -6.499   0.117   0.117
  335   2HB   ARG  47          1HB       ARG  47  -7.132   0.706   0.706
  336   1HG   ARG  47          2HG       ARG  47  -8.975   0.946   0.946
  337   2HG   ARG  47          1HG       ARG  47  -8.234   2.532   2.532
  338   1HD   ARG  47          2HD       ARG  47  -8.515   2.050   2.050
  339   2HD   ARG  47          1HD       ARG  47  -7.009   1.159   1.159
  340    HE   ARG  47           HE       ARG  47  -9.340  -0.414  -0.414
  341   1HH1  ARG  47          2HH1      ARG  47  -7.227   0.732   0.732
  342   2HH1  ARG  47          1HH1      ARG  47  -7.598  -0.576  -0.576
  343   1HH2  ARG  47          1HH2      ARG  47  -9.829  -2.133  -2.133
  344   2HH2  ARG  47          2HH2      ARG  47  -9.076  -2.202  -2.202
  345    H    ILE  48           H        ILE  48  -6.204   4.507   4.507
  346    HA   ILE  48           HA       ILE  48  -6.024   4.809   4.809
  347    HB   ILE  48           HB       ILE  48  -5.662   6.671   6.671
  348   1HG1  ILE  48          2HG1      ILE  48  -4.210   6.302   6.302
  349   2HG1  ILE  48          1HG1      ILE  48  -3.725   5.617   5.617
  350   1HG2  ILE  48          1HG2      ILE  48  -6.532   7.533   7.533
  351   2HG2  ILE  48          3HG2      ILE  48  -5.751   8.606   8.606
  352   3HG2  ILE  48          2HG2      ILE  48  -7.315   7.884   7.884
  353   1HD1  ILE  48          3HD1      ILE  48  -3.950   8.567   8.567
  354   2HD1  ILE  48          2HD1      ILE  48  -2.456   7.639   7.639
  355   3HD1  ILE  48          1HD1      ILE  48  -3.257   7.782   7.782
  356    H    GLN  49           H        GLN  49  -7.647   6.059   6.059
  357    HA   GLN  49           HA       GLN  49 -10.204   6.330   6.330
  358   1HB   GLN  49          2HB       GLN  49 -11.417   5.296   5.296
  359   2HB   GLN  49          1HB       GLN  49 -10.260   4.169   4.169
  360   1HG   GLN  49          2HG       GLN  49  -8.747   5.190   5.190
  361   2HG   GLN  49          1HG       GLN  49 -10.338   5.406   5.406
  362   1HE2  GLN  49          2HE2      GLN  49 -10.820   2.052   2.052
  363   2HE2  GLN  49          1HE2      GLN  49 -11.445   3.663   3.663
  364    H    GLN  50           H        GLN  50 -10.234   8.518   8.518
  365    HA   GLN  50           HA       GLN  50  -9.934   9.882   9.882
  366   1HB   GLN  50          2HB       GLN  50  -8.904  10.479  10.479
  367   2HB   GLN  50          1HB       GLN  50 -10.242  11.606  11.606
  368   1HG   GLN  50          2HG       GLN  50  -9.300  12.436  12.436
  369   2HG   GLN  50          1HG       GLN  50  -8.000  11.254  11.254
  370   1HE2  GLN  50          2HE2      GLN  50  -5.993  13.544  13.544
  371   2HE2  GLN  50          1HE2      GLN  50  -6.210  12.352  12.352
  372    H    ARG  51           H        ARG  51 -11.833   9.987   9.987
  373    HA   ARG  51           HA       ARG  51 -14.362   9.784   9.784
  374   1HB   ARG  51          2HB       ARG  51 -13.248  10.793  10.793
  375   2HB   ARG  51          1HB       ARG  51 -14.891  11.291  11.291
  376   1HG   ARG  51          2HG       ARG  51 -15.466   9.376   9.376
  377   2HG   ARG  51          1HG       ARG  51 -15.011   8.634   8.634
  378   1HD   ARG  51          2HD       ARG  51 -12.621   8.609   8.609
  379   2HD   ARG  51          1HD       ARG  51 -13.519   8.730   8.730
  380    HE   ARG  51           HE       ARG  51 -14.156   6.550   6.550
  381   1HH1  ARG  51          2HH1      ARG  51 -12.992   7.729   7.729
  382   2HH1  ARG  51          1HH1      ARG  51 -13.053   6.177   6.177
  383   1HH2  ARG  51          1HH2      ARG  51 -14.239   4.505   4.505
  384   2HH2  ARG  51          2HH2      ARG  51 -13.762   4.346   4.346
  385    H    ASN  52           H        ASN  52 -13.464  12.878  12.878
  386    HA   ASN  52           HA       ASN  52 -15.033  14.239  14.239
  387   1HB   ASN  52          2HB       ASN  52 -13.775  15.451  15.451
  388   2HB   ASN  52          1HB       ASN  52 -15.066  16.127  16.127
  389   1HD2  ASN  52          2HD2      ASN  52 -15.855  13.515  13.515
  390   2HD2  ASN  52          1HD2      ASN  52 -14.247  13.993  13.993
  391    H    GLY  53           H        GLY  53 -12.257  13.166  13.166
  392   1HA   GLY  53          2HA       GLY  53 -10.595  13.857  13.857
  393   2HA   GLY  53          1HA       GLY  53 -11.271  15.479  15.479
  394    H    ARG  54           H        ARG  54 -10.630  13.942  13.942
  395    HA   ARG  54           HA       ARG  54  -7.985  15.109  15.109
  396   1HB   ARG  54          2HB       ARG  54  -8.585  16.354  16.354
  397   2HB   ARG  54          1HB       ARG  54  -9.369  16.978  16.978
  398   1HG   ARG  54          2HG       ARG  54 -11.303  16.849  16.849
  399   2HG   ARG  54          1HG       ARG  54 -11.142  15.094  15.094
  400   1HD   ARG  54          2HD       ARG  54 -11.543  16.120  16.120
  401   2HD   ARG  54          1HD       ARG  54 -10.097  15.118  15.118
  402    HE   ARG  54           HE       ARG  54  -8.849  16.961  16.961
  403   1HH1  ARG  54          2HH1      ARG  54 -11.964  18.025  18.025
  404   2HH1  ARG  54          1HH1      ARG  54 -11.653  19.697  19.697
  405   1HH2  ARG  54          1HH2      ARG  54  -8.437  19.161  19.161
  406   2HH2  ARG  54          2HH2      ARG  54  -9.650  20.342  20.342
  407    H    LYS  55           H        LYS  55 -10.602  13.293  13.293
  408    HA   LYS  55           HA       LYS  55  -8.846  12.142  12.142
  409   1HB   LYS  55          2HB       LYS  55 -11.668  11.393  11.393
  410   2HB   LYS  55          1HB       LYS  55 -10.806  10.770  10.770
  411   1HG   LYS  55          2HG       LYS  55 -11.601  13.636  13.636
  412   2HG   LYS  55          1HG       LYS  55 -12.358  12.508  12.508
  413   1HD   LYS  55          2HD       LYS  55  -9.487  13.430  13.430
  414   2HD   LYS  55          1HD       LYS  55 -10.801  14.056  14.056
  415   1HE   LYS  55          2HE       LYS  55  -9.854  11.193  11.193
  416   2HE   LYS  55          1HE       LYS  55  -9.454  12.378  12.378
  417   1HZ   LYS  55          1HZ       LYS  55 -11.868  12.571  12.571
  418   2HZ   LYS  55          3HZ       LYS  55 -12.144  11.296  11.296
  419   3HZ   LYS  55          2HZ       LYS  55 -11.244  11.034  11.034
  420    H    THR  56           H        THR  56  -7.430  11.583  11.583
  421    HA   THR  56           HA       THR  56  -8.116   9.380   9.380
  422    HB   THR  56           HB       THR  56  -5.260   9.730   9.730
  423    HG1  THR  56           HG1      THR  56  -5.187  11.805  11.805
  424   1HG2  THR  56          3HG2      THR  56  -6.981   9.262   9.262
  425   2HG2  THR  56          2HG2      THR  56  -5.809  10.538  10.538
  426   3HG2  THR  56          1HG2      THR  56  -5.257   8.946   8.946
  427    H    LEU  57           H        LEU  57  -7.284   7.231   7.231
  428    HA   LEU  57           HA       LEU  57  -6.085   6.257   6.257
  429   1HB   LEU  57          2HB       LEU  57  -8.945   5.940   5.940
  430   2HB   LEU  57          1HB       LEU  57  -8.125   4.459   4.459
  431    HG   LEU  57           HG       LEU  57  -7.885   6.914   6.914
  432   1HD1  LEU  57          2HD1      LEU  57 -10.228   5.130   5.130
  433   2HD1  LEU  57          1HD1      LEU  57  -9.765   5.575   5.575
  434   3HD1  LEU  57          3HD1      LEU  57 -10.149   6.830   6.830
  435   1HD2  LEU  57          1HD2      LEU  57  -7.282   4.027   4.027
  436   2HD2  LEU  57          3HD2      LEU  57  -6.431   5.421   5.421
  437   3HD2  LEU  57          2HD2      LEU  57  -7.897   4.827   4.827
  438    H    THR  58           H        THR  58  -4.487   5.874   5.874
  439    HA   THR  58           HA       THR  58  -4.839   4.219   4.219
  440    HB   THR  58           HB       THR  58  -2.394   4.438   4.438
  441    HG1  THR  58           HG1      THR  58  -3.324   6.396   6.396
  442   1HG2  THR  58          3HG2      THR  58  -2.723   3.397   3.397
  443   2HG2  THR  58          2HG2      THR  58  -1.180   3.968   3.968
  444   3HG2  THR  58          1HG2      THR  58  -1.994   2.596   2.596
  445    H    THR  59           H        THR  59  -4.722   2.020   2.020
  446    HA   THR  59           HA       THR  59  -4.545   0.279   0.279
  447    HB   THR  59           HB       THR  59  -6.307  -1.047  -1.047
  448    HG1  THR  59           HG1      THR  59  -6.960   0.588   0.588
  449   1HG2  THR  59          3HG2      THR  59  -6.526   0.387   0.387
  450   2HG2  THR  59          2HG2      THR  59  -8.037   0.068   0.068
  451   3HG2  THR  59          1HG2      THR  59  -6.965  -1.267  -1.267
  452    H    VAL  60           H        VAL  60  -3.708  -1.781  -1.781
  453    HA   VAL  60           HA       VAL  60  -2.449  -2.191  -2.191
  454    HB   VAL  60           HB       VAL  60  -1.334  -3.024  -3.024
  455   1HG1  VAL  60          1HG1      VAL  60  -0.830  -4.447  -4.447
  456   2HG1  VAL  60          3HG1      VAL  60   0.109  -3.063  -3.063
  457   3HG1  VAL  60          2HG1      VAL  60   0.542  -3.869  -3.869
  458   1HG2  VAL  60          2HG2      VAL  60  -0.880  -0.655  -0.655
  459   2HG2  VAL  60          1HG2      VAL  60  -0.934  -0.771  -0.771
  460   3HG2  VAL  60          3HG2      VAL  60   0.489  -1.334  -1.334
  461    H    GLN  61           H        GLN  61  -3.365  -3.825  -3.825
  462    HA   GLN  61           HA       GLN  61  -4.421  -6.078  -6.078
  463   1HB   GLN  61          2HB       GLN  61  -5.163  -6.142  -6.142
  464   2HB   GLN  61          1HB       GLN  61  -6.190  -6.126  -6.126
  465   1HG   GLN  61          2HG       GLN  61  -5.810  -3.623  -3.623
  466   2HG   GLN  61          1HG       GLN  61  -5.109  -3.790  -3.790
  467   1HE2  GLN  61          2HE2      GLN  61  -8.430  -5.148  -5.148
  468   2HE2  GLN  61          1HE2      GLN  61  -6.885  -5.877  -5.877
  469    H    GLY  62           H        GLY  62  -3.837  -8.177  -8.177
  470   1HA   GLY  62          2HA       GLY  62  -2.811  -9.765  -9.765
  471   2HA   GLY  62          1HA       GLY  62  -1.693  -8.489  -8.489
  472    H    ILE  63           H        ILE  63  -1.186  -7.576  -7.576
  473    HA   ILE  63           HA       ILE  63   1.070  -8.959  -8.959
  474    HB   ILE  63           HB       ILE  63  -0.777  -7.454  -7.454
  475   1HG1  ILE  63          2HG1      ILE  63  -0.023  -5.909  -5.909
  476   2HG1  ILE  63          1HG1      ILE  63   1.165  -5.748  -5.748
  477   1HG2  ILE  63          1HG2      ILE  63   1.769  -8.838  -8.838
  478   2HG2  ILE  63          3HG2      ILE  63   1.640  -7.205  -7.205
  479   3HG2  ILE  63          2HG2      ILE  63   0.458  -8.435  -8.435
  480   1HD1  ILE  63          2HD1      ILE  63   2.614  -7.337  -7.337
  481   2HD1  ILE  63          1HD1      ILE  63   1.468  -7.150  -7.150
  482   3HD1  ILE  63          3HD1      ILE  63   2.355  -5.750  -5.750
  483    H    ALA  64           H        ALA  64   1.634 -10.491 -10.491
  484    HA   ALA  64           HA       ALA  64  -0.348 -12.576 -12.576
  485   1HB   ALA  64          3HB       ALA  64   2.560 -12.400 -12.400
  486   2HB   ALA  64          2HB       ALA  64   1.907 -13.494 -13.494
  487   3HB   ALA  64          1HB       ALA  64   1.508 -13.730 -13.730
  488    H    ASP  65           H        ASP  65  -1.059 -13.459 -13.459
  489    HA   ASP  65           HA       ASP  65  -1.338 -11.662 -11.662
  490   1HB   ASP  65          2HB       ASP  65  -2.297 -14.368 -14.368
  491   2HB   ASP  65          1HB       ASP  65  -2.165 -14.038 -14.038
  492    H    ASP  66           H        ASP  66   1.021 -13.973 -13.973
  493    HA   ASP  66           HA       ASP  66   1.909 -14.716 -14.716
  494   1HB   ASP  66          2HB       ASP  66   2.880 -15.018 -15.018
  495   2HB   ASP  66          1HB       ASP  66   4.124 -15.045 -15.045
  496    H    TYR  67           H        TYR  67   2.409 -11.956 -11.956
  497    HA   TYR  67           HA       TYR  67   4.824 -10.952 -10.952
  498   1HB   TYR  67          2HB       TYR  67   2.267  -9.570  -9.570
  499   2HB   TYR  67          1HB       TYR  67   3.737  -8.682  -8.682
  500    HD1  TYR  67           HD1      TYR  67   4.176 -11.897 -11.897
  501    HD2  TYR  67           HD2      TYR  67   3.540  -7.746  -7.746
  502    HE1  TYR  67           HE1      TYR  67   4.927 -12.153 -12.153
  503    HE2  TYR  67           HE2      TYR  67   4.288  -7.981  -7.981
  504    HH   TYR  67           HH       TYR  67   4.421  -9.837  -9.837
  505    H    ASP  68           H        ASP  68   4.727  -8.671  -8.671
  506    HA   ASP  68           HA       ASP  68   3.674  -9.354  -9.354
  507   1HB   ASP  68          2HB       ASP  68   5.729  -7.232  -7.232
  508   2HB   ASP  68          1HB       ASP  68   5.365  -7.953  -7.953
  509    H    LYS  69           H        LYS  69   1.537  -8.648  -8.648
  510    HA   LYS  69           HA       LYS  69   0.685  -6.307  -6.307
  511   1HB   LYS  69          2HB       LYS  69  -0.492  -7.637  -7.637
  512   2HB   LYS  69          1HB       LYS  69  -1.327  -6.494  -6.494
  513   1HG   LYS  69          2HG       LYS  69  -1.835  -8.065  -8.065
  514   2HG   LYS  69          1HG       LYS  69  -0.209  -8.749  -8.749
  515   1HD   LYS  69          2HD       LYS  69  -0.760 -10.315 -10.315
  516   2HD   LYS  69          1HD       LYS  69  -1.844  -9.230  -9.230
  517   1HE   LYS  69          2HE       LYS  69  -2.509 -10.449 -10.449
  518   2HE   LYS  69          1HE       LYS  69  -2.947 -11.189 -11.189
  519   1HZ   LYS  69          1HZ       LYS  69  -4.041  -8.955  -8.955
  520   2HZ   LYS  69          3HZ       LYS  69  -3.917  -8.654  -8.654
  521   3HZ   LYS  69          2HZ       LYS  69  -4.815  -9.975  -9.975
  522    H    LYS  70           H        LYS  70   1.752  -6.772  -6.772
  523    HA   LYS  70           HA       LYS  70   1.199  -4.119  -4.119
  524   1HB   LYS  70          2HB       LYS  70   3.248  -5.991  -5.991
  525   2HB   LYS  70          1HB       LYS  70   2.417  -4.665  -4.665
  526   1HG   LYS  70          2HG       LYS  70   0.274  -6.036  -6.036
  527   2HG   LYS  70          1HG       LYS  70   1.414  -7.378  -7.378
  528   1HD   LYS  70          2HD       LYS  70   1.511  -7.556  -7.556
  529   2HD   LYS  70          1HD       LYS  70   1.930  -5.850  -5.850
  530   1HE   LYS  70          2HE       LYS  70  -0.210  -5.225  -5.225
  531   2HE   LYS  70          1HE       LYS  70  -0.898  -6.476  -6.476
  532   1HZ   LYS  70          3HZ       LYS  70   0.101  -7.991  -7.991
  533   2HZ   LYS  70          2HZ       LYS  70  -0.164  -6.591  -6.591
  534   3HZ   LYS  70          1HZ       LYS  70  -1.452  -7.326  -7.326
  535    H    LYS  71           H        LYS  71   4.312  -5.726  -5.726
  536    HA   LYS  71           HA       LYS  71   5.899  -3.440  -3.440
  537   1HB   LYS  71          2HB       LYS  71   6.227  -6.180  -6.180
  538   2HB   LYS  71          1HB       LYS  71   7.037  -5.163  -5.163
  539   1HG   LYS  71          2HG       LYS  71   8.654  -5.662  -5.662
  540   2HG   LYS  71          1HG       LYS  71   8.147  -4.005  -4.005
  541   1HD   LYS  71          2HD       LYS  71   8.218  -5.062  -5.062
  542   2HD   LYS  71          1HD       LYS  71   6.508  -5.010  -5.010
  543   1HE   LYS  71          2HE       LYS  71   6.903  -7.360  -7.360
  544   2HE   LYS  71          1HE       LYS  71   8.386  -7.347  -7.347
  545   1HZ   LYS  71          1HZ       LYS  71   5.922  -6.606  -6.606
  546   2HZ   LYS  71          3HZ       LYS  71   6.097  -8.235  -8.235
  547   3HZ   LYS  71          2HZ       LYS  71   7.252  -7.489  -7.489
  548    H    LEU  72           H        LEU  72   3.962  -4.688  -4.688
  549    HA   LEU  72           HA       LEU  72   5.098  -3.209  -3.209
  550   1HB   LEU  72          2HB       LEU  72   2.448  -4.498  -4.498
  551   2HB   LEU  72          1HB       LEU  72   2.614  -3.400  -3.400
  552    HG   LEU  72           HG       LEU  72   3.770  -4.894  -4.894
  553   1HD1  LEU  72          1HD1      LEU  72   5.195  -5.624  -5.624
  554   2HD1  LEU  72          3HD1      LEU  72   5.462  -6.476  -6.476
  555   3HD1  LEU  72          2HD1      LEU  72   5.824  -4.752  -4.752
  556   1HD2  LEU  72          3HD2      LEU  72   1.881  -6.168  -6.168
  557   2HD2  LEU  72          2HD2      LEU  72   2.732  -6.867  -6.867
  558   3HD2  LEU  72          1HD2      LEU  72   3.307  -7.173  -7.173
  559    H    VAL  73           H        VAL  73   2.114  -2.465  -2.465
  560    HA   VAL  73           HA       VAL  73   2.060   0.215   0.215
  561    HB   VAL  73           HB       VAL  73   0.236   0.534   0.534
  562   1HG1  VAL  73          2HG1      VAL  73   0.171  -1.370  -1.370
  563   2HG1  VAL  73          1HG1      VAL  73  -1.256  -1.249  -1.249
  564   3HG1  VAL  73          3HG1      VAL  73  -0.640   0.182   0.182
  565   1HG2  VAL  73          3HG2      VAL  73   1.303  -1.735  -1.735
  566   2HG2  VAL  73          2HG2      VAL  73  -0.282  -1.058  -1.058
  567   3HG2  VAL  73          1HG2      VAL  73  -0.132  -2.348  -2.348
  568    H    LYS  74           H        LYS  74   3.326  -1.366  -1.366
  569    HA   LYS  74           HA       LYS  74   3.653   0.962   0.962
  570   1HB   LYS  74          2HB       LYS  74   3.690  -1.247  -1.247
  571   2HB   LYS  74          1HB       LYS  74   5.089  -1.701  -1.701
  572   1HG   LYS  74          2HG       LYS  74   5.694   0.680   0.680
  573   2HG   LYS  74          1HG       LYS  74   5.037  -0.527  -0.527
  574   1HD   LYS  74          2HD       LYS  74   6.799  -1.935  -1.935
  575   2HD   LYS  74          1HD       LYS  74   7.047  -1.469  -1.469
  576   1HE   LYS  74          2HE       LYS  74   7.717   0.832   0.832
  577   2HE   LYS  74          1HE       LYS  74   8.139  -0.288  -0.288
  578   1HZ   LYS  74          1HZ       LYS  74   9.098  -0.568  -0.568
  579   2HZ   LYS  74          3HZ       LYS  74   9.976   0.210   0.210
  580   3HZ   LYS  74          2HZ       LYS  74   9.619  -1.438  -1.438
  581    H    ALA  75           H        ALA  75   5.903  -0.909  -0.909
  582    HA   ALA  75           HA       ALA  75   8.106   0.812   0.812
  583   1HB   ALA  75          2HB       ALA  75   7.396  -1.075  -1.075
  584   2HB   ALA  75          1HB       ALA  75   8.956  -0.271  -0.271
  585   3HB   ALA  75          3HB       ALA  75   8.414  -1.422  -1.422
  586    H    PHE  76           H        PHE  76   5.485   0.687   0.687
  587    HA   PHE  76           HA       PHE  76   6.277   2.551   2.551
  588   1HB   PHE  76          2HB       PHE  76   4.070   1.204   1.204
  589   2HB   PHE  76          1HB       PHE  76   3.468   2.600   2.600
  590    HD1  PHE  76           HD1      PHE  76   5.194   1.747   1.747
  591    HD2  PHE  76           HD2      PHE  76   2.470   4.314   4.314
  592    HE1  PHE  76           HE1      PHE  76   4.689   2.870   2.870
  593    HE2  PHE  76           HE2      PHE  76   1.955   5.441   5.441
  594    HZ   PHE  76           HZ       PHE  76   3.065   4.718   4.718
  595    H    LYS  77           H        LYS  77   4.484   3.270   3.270
  596    HA   LYS  77           HA       LYS  77   4.477   6.052   6.052
  597   1HB   LYS  77          2HB       LYS  77   4.242   4.175   4.175
  598   2HB   LYS  77          1HB       LYS  77   4.367   5.904   5.904
  599   1HG   LYS  77          2HG       LYS  77   2.406   6.208   6.208
  600   2HG   LYS  77          1HG       LYS  77   2.230   4.453   4.453
  601   1HD   LYS  77          2HD       LYS  77   2.145   6.228   6.228
  602   2HD   LYS  77          1HD       LYS  77   0.746   5.508   5.508
  603   1HE   LYS  77          2HE       LYS  77   1.495   3.297   3.297
  604   2HE   LYS  77          1HE       LYS  77   3.025   3.918   3.918
  605   1HZ   LYS  77          2HZ       LYS  77   0.400   4.637   4.637
  606   2HZ   LYS  77          1HZ       LYS  77   1.329   3.334   3.334
  607   3HZ   LYS  77          3HZ       LYS  77   1.936   4.910   4.910
  608    H    LYS  78           H        LYS  78   7.045   3.912   3.912
  609    HA   LYS  78           HA       LYS  78   8.644   5.877   5.877
  610   1HB   LYS  78          2HB       LYS  78   8.738   3.364   3.364
  611   2HB   LYS  78          1HB       LYS  78   9.584   3.261   3.261
  612   1HG   LYS  78          2HG       LYS  78  11.306   3.291   3.291
  613   2HG   LYS  78          1HG       LYS  78  11.204   4.980   4.980
  614   1HD   LYS  78          2HD       LYS  78   9.490   5.032   5.032
  615   2HD   LYS  78          1HD       LYS  78  10.542   3.722   3.722
  616   1HE   LYS  78          2HE       LYS  78  12.402   5.091   5.091
  617   2HE   LYS  78          1HE       LYS  78  11.736   6.269   6.269
  618   1HZ   LYS  78          1HZ       LYS  78   9.979   6.506   6.506
  619   2HZ   LYS  78          3HZ       LYS  78  11.295   5.993   5.993
  620   3HZ   LYS  78          2HZ       LYS  78  11.421   7.390   7.390
  621    H    LYS  79           H        LYS  79   8.024   5.003   5.003
  622    HA   LYS  79           HA       LYS  79  10.483   6.304   6.304
  623   1HB   LYS  79          2HB       LYS  79  10.064   4.086   4.086
  624   2HB   LYS  79          1HB       LYS  79   8.490   4.608   4.608
  625   1HG   LYS  79          2HG       LYS  79   9.418   5.946   5.946
  626   2HG   LYS  79          1HG       LYS  79  11.002   5.977   5.977
  627   1HD   LYS  79          2HD       LYS  79  11.257   3.572   3.572
  628   2HD   LYS  79          1HD       LYS  79   9.700   3.592   3.592
  629   1HE   LYS  79          2HE       LYS  79  11.315   3.779   3.779
  630   2HE   LYS  79          1HE       LYS  79  10.679   5.408   5.408
  631   1HZ   LYS  79          3HZ       LYS  79  12.715   5.476   5.476
  632   2HZ   LYS  79          2HZ       LYS  79  13.330   4.356   4.356
  633   3HZ   LYS  79          1HZ       LYS  79  12.866   5.896   5.896
  634    H    PHE  80           H        PHE  80   6.958   6.432   6.432
  635    HA   PHE  80           HA       PHE  80   7.286   9.101   9.101
  636   1HB   PHE  80          2HB       PHE  80   4.800   7.528   7.528
  637   2HB   PHE  80          1HB       PHE  80   5.599   8.716   8.716
  638    HD1  PHE  80           HD1      PHE  80   5.775   5.233   5.233
  639    HD2  PHE  80           HD2      PHE  80   7.120   8.055   8.055
  640    HE1  PHE  80           HE1      PHE  80   6.798   3.413   3.413
  641    HE2  PHE  80           HE2      PHE  80   8.144   6.238   6.238
  642    HZ   PHE  80           HZ       PHE  80   7.984   3.912   3.912
  643    H    ALA  81           H        ALA  81   6.053   7.390   7.390
  644    HA   ALA  81           HA       ALA  81   4.805   8.020   8.020
  645   1HB   ALA  81          3HB       ALA  81   6.233  10.011  10.011
  646   2HB   ALA  81          2HB       ALA  81   5.110  10.795  10.795
  647   3HB   ALA  81          1HB       ALA  81   4.594  10.395  10.395
  648    H    CYS  82           H        CYS  82   3.467   7.074   7.074
  649    HA   CYS  82           HA       CYS  82   1.025   8.705   8.705
  650   1HB   CYS  82          2HB       CYS  82   1.939   6.470   6.470
  651   2HB   CYS  82          1HB       CYS  82   0.436   7.368   7.368
  652    HG   CYS  82           HG       CYS  82   1.651   9.218   9.218
  653    H    ASN  83           H        ASN  83  -0.859   7.968   7.968
  654    HA   ASN  83           HA       ASN  83  -0.904   5.852   5.852
  655   1HB   ASN  83          2HB       ASN  83  -2.859   7.722   7.722
  656   2HB   ASN  83          1HB       ASN  83  -3.544   6.194   6.194
  657   1HD2  ASN  83          2HD2      ASN  83  -2.342   6.779   6.779
  658   2HD2  ASN  83          1HD2      ASN  83  -2.168   5.568   5.568
  659    H    GLY  84           H        GLY  84  -0.478   3.820   3.820
  660   1HA   GLY  84          2HA       GLY  84  -1.876   2.786   2.786
  661   2HA   GLY  84          1HA       GLY  84  -0.386   2.124   2.124
  662    H    THR  85           H        THR  85  -3.400   1.281   1.281
  663    HA   THR  85           HA       THR  85  -3.544  -0.241  -0.241
  664    HB   THR  85           HB       THR  85  -5.933   0.006   0.006
  665    HG1  THR  85           HG1      THR  85  -5.629   1.355   1.355
  666   1HG2  THR  85          2HG2      THR  85  -4.565   2.637   2.637
  667   2HG2  THR  85          1HG2      THR  85  -6.228   2.491   2.491
  668   3HG2  THR  85          3HG2      THR  85  -4.908   1.840   1.840
  669    H    VAL  86           H        VAL  86  -4.514  -2.309  -2.309
  670    HA   VAL  86           HA       VAL  86  -4.309  -3.504  -3.504
  671    HB   VAL  86           HB       VAL  86  -2.977  -4.527  -4.527
  672   1HG1  VAL  86          1HG1      VAL  86  -4.447  -4.030  -4.030
  673   2HG1  VAL  86          3HG1      VAL  86  -5.649  -5.159  -5.159
  674   3HG1  VAL  86          2HG1      VAL  86  -4.083  -5.755  -5.755
  675   1HG2  VAL  86          1HG2      VAL  86  -4.316  -5.796  -5.796
  676   2HG2  VAL  86          3HG2      VAL  86  -3.268  -6.631  -6.631
  677   3HG2  VAL  86          2HG2      VAL  86  -5.014  -6.605  -6.605
  678    H    ILE  87           H        ILE  87  -6.041  -4.346  -4.346
  679    HA   ILE  87           HA       ILE  87  -8.493  -4.911  -4.911
  680    HB   ILE  87           HB       ILE  87  -9.880  -3.623  -3.623
  681   1HG1  ILE  87          2HG1      ILE  87  -7.361  -2.171  -2.171
  682   2HG1  ILE  87          1HG1      ILE  87  -7.969  -3.534  -3.534
  683   1HG2  ILE  87          2HG2      ILE  87  -9.167  -2.768  -2.768
  684   2HG2  ILE  87          1HG2      ILE  87  -7.929  -1.828  -1.828
  685   3HG2  ILE  87          3HG2      ILE  87  -9.636  -1.532  -1.532
  686   1HD1  ILE  87          2HD1      ILE  87  -9.587  -1.076  -1.076
  687   2HD1  ILE  87          1HD1      ILE  87  -8.624  -1.291  -1.291
  688   3HD1  ILE  87          3HD1      ILE  87  -9.975  -2.374  -2.374
  689    H    GLU  88           H        GLU  88  -9.749  -6.472  -6.472
  690    HA   GLU  88           HA       GLU  88  -8.617  -7.799  -7.799
  691   1HB   GLU  88          2HB       GLU  88  -9.140  -8.986  -8.986
  692   2HB   GLU  88          1HB       GLU  88 -10.817  -8.912  -8.912
  693   1HG   GLU  88          2HG       GLU  88 -10.460 -10.344 -10.344
  694   2HG   GLU  88          1HG       GLU  88  -8.721 -10.053 -10.053
  695    H    HIS  89           H        HIS  89  -9.527  -6.009  -6.009
  696    HA   HIS  89           HA       HIS  89 -12.223  -5.460  -5.460
  697   1HB   HIS  89          2HB       HIS  89 -10.010  -4.492  -4.492
  698   2HB   HIS  89          1HB       HIS  89 -10.528  -5.541  -5.541
  699    HD1  HIS  89           HD1      HIS  89 -12.211  -4.590  -4.590
  700    HD2  HIS  89           HD2      HIS  89 -12.092  -2.544  -2.544
  701    HE1  HIS  89           HE1      HIS  89 -13.763  -2.634  -2.634
  702    HE2  HIS  89           HE2      HIS  89 -13.599  -1.355  -1.355
  703    HA   PRO  90           HA       PRO  90 -13.701  -9.316  -9.316
  704   1HB   PRO  90          2HB       PRO  90 -16.239  -8.562  -8.562
  705   2HB   PRO  90          1HB       PRO  90 -15.653  -8.852  -8.852
  706   1HG   PRO  90          2HG       PRO  90 -16.024  -6.259  -6.259
  707   2HG   PRO  90          1HG       PRO  90 -16.431  -6.673  -6.673
  708   1HD   PRO  90          2HD       PRO  90 -14.180  -5.302  -5.302
  709   2HD   PRO  90          1HD       PRO  90 -14.280  -6.343  -6.343
  710    H    GLU  91           H        GLU  91 -13.467  -6.323  -6.323
  711    HA   GLU  91           HA       GLU  91 -14.431  -7.334  -7.334
  712   1HB   GLU  91          2HB       GLU  91 -14.048  -4.781  -4.781
  713   2HB   GLU  91          1HB       GLU  91 -13.003  -4.866  -4.866
  714   1HG   GLU  91          2HG       GLU  91 -15.194  -3.932  -3.932
  715   2HG   GLU  91          1HG       GLU  91 -14.885  -5.432  -5.432
  716    H    TYR  92           H        TYR  92 -11.445  -7.023  -7.023
  717    HA   TYR  92           HA       TYR  92  -9.993  -7.921  -7.921
  718   1HB   TYR  92          2HB       TYR  92  -8.567  -6.504  -6.504
  719   2HB   TYR  92          1HB       TYR  92  -8.168  -6.587  -6.587
  720    HD1  TYR  92           HD2      TYR  92 -10.574  -5.674  -5.674
  721    HD2  TYR  92           HD1      TYR  92  -8.788  -4.267  -4.267
  722    HE1  TYR  92           HE2      TYR  92 -11.614  -3.476  -3.476
  723    HE2  TYR  92           HE1      TYR  92  -9.822  -2.062  -2.062
  724    HH   TYR  92           HH       TYR  92 -11.002  -1.000  -1.000
  725    H    GLY  93           H        GLY  93  -9.783  -7.877  -7.877
  726   1HA   GLY  93          2HA       GLY  93  -9.773  -9.964  -9.964
  727   2HA   GLY  93          1HA       GLY  93  -8.932 -10.699 -10.699
  728    H    GLU  94           H        GLU  94  -8.627  -8.925  -8.925
  729    HA   GLU  94           HA       GLU  94  -6.845  -8.424  -8.424
  730   1HB   GLU  94          2HB       GLU  94  -6.250 -10.799 -10.799
  731   2HB   GLU  94          1HB       GLU  94  -5.253 -10.208 -10.208
  732   1HG   GLU  94          2HG       GLU  94  -4.848  -9.315  -9.315
  733   2HG   GLU  94          1HG       GLU  94  -4.082 -10.760 -10.760
  734    H    VAL  95           H        VAL  95  -6.697  -6.251  -6.251
  735    HA   VAL  95           HA       VAL  95  -4.434  -5.536  -5.536
  736    HB   VAL  95           HB       VAL  95  -5.655  -3.624  -3.624
  737   1HG1  VAL  95          2HG1      VAL  95  -5.811  -6.276  -6.276
  738   2HG1  VAL  95          1HG1      VAL  95  -7.480  -5.713  -5.713
  739   3HG1  VAL  95          3HG1      VAL  95  -6.216  -4.876  -4.876
  740   1HG2  VAL  95          1HG2      VAL  95  -8.067  -4.857  -4.857
  741   2HG2  VAL  95          3HG2      VAL  95  -7.322  -3.312  -3.312
  742   3HG2  VAL  95          2HG2      VAL  95  -8.104  -3.526  -3.526
  743    H    ILE  96           H        ILE  96  -3.297  -3.729  -3.729
  744    HA   ILE  96           HA       ILE  96  -3.893  -2.839  -2.839
  745    HB   ILE  96           HB       ILE  96  -1.448  -2.906  -2.906
  746   1HG1  ILE  96          2HG1      ILE  96  -2.122  -4.524  -4.524
  747   2HG1  ILE  96          1HG1      ILE  96  -0.481  -3.886  -3.886
  748   1HG2  ILE  96          2HG2      ILE  96  -1.956  -0.792  -0.792
  749   2HG2  ILE  96          1HG2      ILE  96  -0.331  -1.323  -1.323
  750   3HG2  ILE  96          3HG2      ILE  96  -1.375  -0.590  -0.590
  751   1HD1  ILE  96          1HD1      ILE  96  -2.276  -2.201  -2.201
  752   2HD1  ILE  96          3HD1      ILE  96  -2.380  -3.873  -3.873
  753   3HD1  ILE  96          2HD1      ILE  96  -0.824  -3.048  -3.048
  754    H    GLN  97           H        GLN  97  -4.843  -0.972  -0.972
  755    HA   GLN  97           HA       GLN  97  -5.192   0.927   0.927
  756   1HB   GLN  97          2HB       GLN  97  -6.902  -0.038  -0.038
  757   2HB   GLN  97          1HB       GLN  97  -6.568   1.624   1.624
  758   1HG   GLN  97          2HG       GLN  97  -7.125   2.147   2.147
  759   2HG   GLN  97          1HG       GLN  97  -7.923   0.576   0.576
  760   1HE2  GLN  97          2HE2      GLN  97 -10.100   1.814   1.814
  761   2HE2  GLN  97          1HE2      GLN  97  -8.880   0.600   0.600
  762    H    LEU  98           H        LEU  98  -3.695   2.451   2.451
  763    HA   LEU  98           HA       LEU  98  -2.458   3.533   3.533
  764   1HB   LEU  98          2HB       LEU  98  -1.748   3.894   3.894
  765   2HB   LEU  98          1HB       LEU  98  -0.884   4.623   4.623
  766    HG   LEU  98           HG       LEU  98  -1.182   1.650   1.650
  767   1HD1  LEU  98          3HD1      LEU  98  -0.241   2.863   2.863
  768   2HD1  LEU  98          2HD1      LEU  98   1.235   2.817   2.817
  769   3HD1  LEU  98          1HD1      LEU  98   0.377   1.322   1.322
  770   1HD2  LEU  98          1HD2      LEU  98   0.406   3.653   3.653
  771   2HD2  LEU  98          3HD2      LEU  98  -0.072   2.023   2.023
  772   3HD2  LEU  98          2HD2      LEU  98   1.325   2.260   2.260
  773    H    GLN  99           H        GLN  99  -2.263   5.857   5.857
  774    HA   GLN  99           HA       GLN  99  -4.694   7.196   7.196
  775   1HB   GLN  99          2HB       GLN  99  -2.830   7.502   7.502
  776   2HB   GLN  99          1HB       GLN  99  -3.484   9.004   9.004
  777   1HG   GLN  99          2HG       GLN  99  -5.421   6.832   6.832
  778   2HG   GLN  99          1HG       GLN  99  -4.681   7.555   7.555
  779   1HE2  GLN  99          2HE2      GLN  99  -7.403   9.586   9.586
  780   2HE2  GLN  99          1HE2      GLN  99  -6.761   8.068   8.068
  781    H    GLY 100           H        GLY 100  -4.757   8.886   8.886
  782   1HA   GLY 100          2HA       GLY 100  -3.989  10.666  10.666
  783   2HA   GLY 100          1HA       GLY 100  -2.375  10.395  10.395
  784    H    ASP 101           H        ASP 101  -2.388  10.983  10.983
  785    HA   ASP 101           HA       ASP 101  -2.734   8.720   8.720
  786   1HB   ASP 101          2HB       ASP 101  -1.573  10.172  10.172
  787   2HB   ASP 101          1HB       ASP 101  -2.991  10.914  10.914
  788    H    GLN 102           H        GLN 102  -1.483   7.037   7.037
  789    HA   GLN 102           HA       GLN 102   1.423   7.474   7.474
  790   1HB   GLN 102          2HB       GLN 102  -0.432   5.790   5.790
  791   2HB   GLN 102          1HB       GLN 102   1.054   4.987   4.987
  792   1HG   GLN 102          2HG       GLN 102   1.026   6.126   6.126
  793   2HG   GLN 102          1HG       GLN 102   2.390   6.478   6.478
  794   1HE2  GLN 102          2HE2      GLN 102  -0.456   9.405   9.405
  795   2HE2  GLN 102          1HE2      GLN 102  -0.895   7.754   7.754
  796    H    ARG 103           H        ARG 103  -0.760   6.578   6.578
  797    HA   ARG 103           HA       ARG 103  -0.155   4.084   4.084
  798   1HB   ARG 103          2HB       ARG 103  -1.156   4.709   4.709
  799   2HB   ARG 103          1HB       ARG 103  -1.803   5.904   5.904
  800   1HG   ARG 103          2HG       ARG 103   0.566   6.384   6.384
  801   2HG   ARG 103          1HG       ARG 103  -1.096   6.815   6.815
  802   1HD   ARG 103          2HD       ARG 103  -0.428   7.808   7.808
  803   2HD   ARG 103          1HD       ARG 103   0.780   8.333   8.333
  804    HE   ARG 103           HE       ARG 103  -1.937   8.707   8.707
  805   1HH1  ARG 103          2HH1      ARG 103   0.728  10.109  10.109
  806   2HH1  ARG 103          1HH1      ARG 103   0.176  11.736  11.736
  807   1HH2  ARG 103          1HH2      ARG 103  -2.663  10.846  10.846
  808   2HH2  ARG 103          2HH2      ARG 103  -1.748  12.155  12.155
  809    H    LYS 104           H        LYS 104   1.847   6.915   6.915
  810    HA   LYS 104           HA       LYS 104   3.763   5.629   5.629
  811   1HB   LYS 104          2HB       LYS 104   2.993   8.083   8.083
  812   2HB   LYS 104          1HB       LYS 104   4.043   8.390   8.390
  813   1HG   LYS 104          2HG       LYS 104   5.482   6.869   6.869
  814   2HG   LYS 104          1HG       LYS 104   4.729   8.255   8.255
  815   1HD   LYS 104          2HD       LYS 104   6.419   8.404   8.404
  816   2HD   LYS 104          1HD       LYS 104   7.003   8.735   8.735
  817   1HE   LYS 104          2HE       LYS 104   4.952  10.392  10.392
  818   2HE   LYS 104          1HE       LYS 104   5.163  10.318  10.318
  819   1HZ   LYS 104          3HZ       LYS 104   7.664  10.728  10.728
  820   2HZ   LYS 104          2HZ       LYS 104   6.886  11.497  11.497
  821   3HZ   LYS 104          1HZ       LYS 104   6.585  11.996  11.996
  822    H    ASN 105           H        ASN 105   3.261   6.417   6.417
  823    HA   ASN 105           HA       ASN 105   6.062   6.059   6.059
  824   1HB   ASN 105          2HB       ASN 105   3.576   6.687   6.687
  825   2HB   ASN 105          1HB       ASN 105   5.098   6.287   6.287
  826   1HD2  ASN 105          2HD2      ASN 105   4.433   9.962   9.962
  827   2HD2  ASN 105          1HD2      ASN 105   3.242   8.708   8.708
  828    H    ILE 106           H        ILE 106   2.981   4.347   4.347
  829    HA   ILE 106           HA       ILE 106   4.001   2.261   2.261
  830    HB   ILE 106           HB       ILE 106   1.565   2.789   2.789
  831   1HG1  ILE 106          2HG1      ILE 106   0.847   0.544   0.544
  832   2HG1  ILE 106          1HG1      ILE 106   2.229  -0.116  -0.116
  833   1HG2  ILE 106          1HG2      ILE 106   1.694   2.884   2.884
  834   2HG2  ILE 106          3HG2      ILE 106   1.872   1.131   1.131
  835   3HG2  ILE 106          2HG2      ILE 106   0.394   1.862   1.862
  836   1HD1  ILE 106          3HD1      ILE 106   2.654   1.528   1.528
  837   2HD1  ILE 106          2HD1      ILE 106   2.172  -0.163  -0.163
  838   3HD1  ILE 106          1HD1      ILE 106   3.668   0.264   0.264
  839    H    CYS 107           H        CYS 107   3.511   2.436   2.436
  840    HA   CYS 107           HA       CYS 107   4.496  -0.113  -0.113
  841   1HB   CYS 107          2HB       CYS 107   4.951   0.822   0.822
  842   2HB   CYS 107          1HB       CYS 107   3.357   1.286   1.286
  843    HG   CYS 107           HG       CYS 107   4.217   3.477   3.477
  844    H    GLN 108           H        GLN 108   6.063   2.947   2.947
  845    HA   GLN 108           HA       GLN 108   8.708   2.121   2.121
  846   1HB   GLN 108          2HB       GLN 108   8.535   4.409   4.409
  847   2HB   GLN 108          1HB       GLN 108   7.407   4.479   4.479
  848   1HG   GLN 108          2HG       GLN 108   9.117   5.353   5.353
  849   2HG   GLN 108          1HG       GLN 108   9.683   3.691   3.691
  850   1HE2  GLN 108          2HE2      GLN 108  12.355   4.057   4.057
  851   2HE2  GLN 108          1HE2      GLN 108  11.280   2.943   2.943
  852    H    PHE 109           H        PHE 109   6.707   2.074   2.074
  853    HA   PHE 109           HA       PHE 109   8.778   1.402   1.402
  854   1HB   PHE 109          2HB       PHE 109   6.678   2.444   2.444
  855   2HB   PHE 109          1HB       PHE 109   5.777   1.037   1.037
  856    HD1  PHE 109           HD2      PHE 109   8.499   2.018   2.018
  857    HD2  PHE 109           HD1      PHE 109   5.328  -0.686  -0.686
  858    HE1  PHE 109           HE2      PHE 109   8.790   0.990   0.990
  859    HE2  PHE 109           HE1      PHE 109   5.611  -1.724  -1.724
  860    HZ   PHE 109           HZ       PHE 109   7.344  -0.885  -0.885
  861    H    LEU 110           H        LEU 110   6.294  -0.409  -0.409
  862    HA   LEU 110           HA       LEU 110   6.725  -2.941  -2.941
  863   1HB   LEU 110          2HB       LEU 110   5.661  -1.867  -1.867
  864   2HB   LEU 110          1HB       LEU 110   6.065  -3.571  -3.571
  865    HG   LEU 110           HG       LEU 110   4.436  -4.029  -4.029
  866   1HD1  LEU 110          1HD1      LEU 110   4.975  -2.033  -2.033
  867   2HD1  LEU 110          3HD1      LEU 110   3.946  -1.079  -1.079
  868   3HD1  LEU 110          2HD1      LEU 110   3.256  -2.403  -2.403
  869   1HD2  LEU 110          3HD2      LEU 110   3.719  -3.239  -3.239
  870   2HD2  LEU 110          2HD2      LEU 110   2.524  -3.644  -3.644
  871   3HD2  LEU 110          1HD2      LEU 110   2.927  -1.956  -1.956
  872    H    VAL 111           H        VAL 111   8.540  -1.142  -1.142
  873    HA   VAL 111           HA       VAL 111  10.216  -3.452  -3.452
  874    HB   VAL 111           HB       VAL 111  10.300  -0.641  -0.641
  875   1HG1  VAL 111          1HG1      VAL 111  11.835  -3.131  -3.131
  876   2HG1  VAL 111          3HG1      VAL 111  11.705  -1.731  -1.731
  877   3HG1  VAL 111          2HG1      VAL 111  12.477  -1.571  -1.571
  878   1HG2  VAL 111          3HG2      VAL 111   8.393  -2.531  -2.531
  879   2HG2  VAL 111          2HG2      VAL 111   8.847  -1.253  -1.253
  880   3HG2  VAL 111          1HG2      VAL 111   9.551  -2.863  -2.863
  881    H    GLU 112           H        GLU 112  10.273  -0.443  -0.443
  882    HA   GLU 112           HA       GLU 112  13.081  -0.291  -0.291
  883   1HB   GLU 112          2HB       GLU 112  10.705   0.952   0.952
  884   2HB   GLU 112          1HB       GLU 112  12.305   1.135   1.135
  885   1HG   GLU 112          2HG       GLU 112  12.168   1.731   1.731
  886   2HG   GLU 112          1HG       GLU 112  11.205   2.798   2.798
  887    H    ILE 113           H        ILE 113  10.458  -1.827  -1.827
  888    HA   ILE 113           HA       ILE 113  12.335  -2.754  -2.754
  889    HB   ILE 113           HB       ILE 113  10.477  -3.365  -3.365
  890   1HG1  ILE 113          2HG1      ILE 113   8.710  -2.921  -2.921
  891   2HG1  ILE 113          1HG1      ILE 113   9.160  -4.490  -4.490
  892   1HG2  ILE 113          3HG2      ILE 113  10.925  -0.836  -0.836
  893   2HG2  ILE 113          2HG2      ILE 113   9.281  -0.953  -0.953
  894   3HG2  ILE 113          1HG2      ILE 113   9.601  -1.308  -1.308
  895   1HD1  ILE 113          1HD1      ILE 113   7.949  -2.708  -2.708
  896   2HD1  ILE 113          3HD1      ILE 113   6.894  -3.112  -3.112
  897   3HD1  ILE 113          2HD1      ILE 113   7.603  -4.396  -4.396
  898    H    GLY 114           H        GLY 114  10.389  -3.900  -3.900
  899   1HA   GLY 114          2HA       GLY 114  11.029  -5.882  -5.882
  900   2HA   GLY 114          1HA       GLY 114  11.622  -6.556  -6.556
  901    H    LEU 115           H        LEU 115   8.585  -4.874  -4.874
  902    HA   LEU 115           HA       LEU 115   7.166  -7.118  -7.118
  903   1HB   LEU 115          2HB       LEU 115   6.772  -4.524  -4.524
  904   2HB   LEU 115          1HB       LEU 115   5.778  -4.745  -4.745
  905    HG   LEU 115           HG       LEU 115   4.415  -6.392  -6.392
  906   1HD1  LEU 115          2HD1      LEU 115   6.255  -5.745  -5.745
  907   2HD1  LEU 115          1HD1      LEU 115   4.700  -6.554  -6.554
  908   3HD1  LEU 115          3HD1      LEU 115   5.983  -7.316  -7.316
  909   1HD2  LEU 115          3HD2      LEU 115   4.052  -3.844  -3.844
  910   2HD2  LEU 115          2HD2      LEU 115   3.153  -4.854  -4.854
  911   3HD2  LEU 115          1HD2      LEU 115   4.574  -3.959  -3.959
  912    H    ALA 116           H        ALA 116   6.354  -5.195  -5.195
  913    HA   ALA 116           HA       ALA 116   5.198  -7.573  -7.573
  914   1HB   ALA 116          3HB       ALA 116   4.037  -5.335  -5.335
  915   2HB   ALA 116          2HB       ALA 116   5.264  -4.791  -4.791
  916   3HB   ALA 116          1HB       ALA 116   4.187  -6.116  -6.116
  917    H    LYS 117           H        LYS 117   5.582  -7.109  -7.109
  918    HA   LYS 117           HA       LYS 117   8.505  -7.369  -7.369
  919   1HB   LYS 117          2HB       LYS 117   6.344  -9.073  -9.073
  920   2HB   LYS 117          1HB       LYS 117   7.297  -8.532  -8.532
  921   1HG   LYS 117          2HG       LYS 117   8.144 -10.632 -10.632
  922   2HG   LYS 117          1HG       LYS 117   9.328  -9.353  -9.353
  923   1HD   LYS 117          2HD       LYS 117   7.437  -9.778  -9.778
  924   2HD   LYS 117          1HD       LYS 117   8.515 -11.138 -11.138
  925   1HE   LYS 117          2HE       LYS 117   9.944  -8.627  -8.627
  926   2HE   LYS 117          1HE       LYS 117   9.095  -8.837  -8.837
  927   1HZ   LYS 117          2HZ       LYS 117  10.834 -10.930 -10.930
  928   2HZ   LYS 117          1HZ       LYS 117  11.407  -9.760  -9.760
  929   3HZ   LYS 117          3HZ       LYS 117  10.218 -10.857 -10.857
  930    H    ASP 118           H        ASP 118   9.508  -6.391  -6.391
  931    HA   ASP 118           HA       ASP 118   8.472  -3.923  -3.923
  932   1HB   ASP 118          2HB       ASP 118  10.520  -5.438  -5.438
  933   2HB   ASP 118          1HB       ASP 118  10.359  -3.694  -3.694
  934    H    ASP 119           H        ASP 119   8.222  -7.097  -7.097
  935    HA   ASP 119           HA       ASP 119   7.096  -6.161  -6.161
  936   1HB   ASP 119          2HB       ASP 119   8.355  -8.444  -8.444
  937   2HB   ASP 119          1HB       ASP 119   6.693  -8.974  -8.974
  938    H    GLN 120           H        GLN 120   5.965  -6.935  -6.935
  939    HA   GLN 120           HA       GLN 120   3.211  -7.276  -7.276
  940   1HB   GLN 120          2HB       GLN 120   4.425  -7.222  -7.222
  941   2HB   GLN 120          1HB       GLN 120   2.751  -7.609  -7.609
  942   1HG   GLN 120          2HG       GLN 120   3.646  -9.501  -9.501
  943   2HG   GLN 120          1HG       GLN 120   5.211  -9.189  -9.189
  944   1HE2  GLN 120          2HE2      GLN 120   3.457  -9.904  -9.904
  945   2HE2  GLN 120          1HE2      GLN 120   3.969  -8.431  -8.431
  946    H    LEU 121           H        LEU 121   5.233  -4.702  -4.702
  947    HA   LEU 121           HA       LEU 121   3.745  -2.933  -2.933
  948   1HB   LEU 121          2HB       LEU 121   5.649  -2.496  -2.496
  949   2HB   LEU 121          1HB       LEU 121   4.891  -1.151  -1.151
  950    HG   LEU 121           HG       LEU 121   6.526  -3.226  -3.226
  951   1HD1  LEU 121          2HD1      LEU 121   7.396  -0.692  -0.692
  952   2HD1  LEU 121          1HD1      LEU 121   8.300  -1.404  -1.404
  953   3HD1  LEU 121          3HD1      LEU 121   8.074  -2.314  -2.314
  954   1HD2  LEU 121          2HD2      LEU 121   4.823  -1.281  -1.281
  955   2HD2  LEU 121          1HD2      LEU 121   6.134  -2.033  -2.033
  956   3HD2  LEU 121          3HD2      LEU 121   6.402  -0.499  -0.499
  957    H    LYS 122           H        LYS 122   1.544  -3.136  -3.136
  958    HA   LYS 122           HA       LYS 122   0.691  -2.109  -2.109
  959   1HB   LYS 122          2HB       LYS 122  -0.382  -4.193  -4.193
  960   2HB   LYS 122          1HB       LYS 122  -1.578  -3.158  -3.158
  961   1HG   LYS 122          2HG       LYS 122   0.568  -4.641  -4.641
  962   2HG   LYS 122          1HG       LYS 122  -1.068  -5.252  -5.252
  963   1HD   LYS 122          2HD       LYS 122  -1.970  -3.829  -3.829
  964   2HD   LYS 122          1HD       LYS 122  -0.859  -2.522  -2.522
  965   1HE   LYS 122          2HE       LYS 122   0.835  -3.377  -3.377
  966   2HE   LYS 122          1HE       LYS 122   0.070  -4.962  -4.962
  967   1HZ   LYS 122          3HZ       LYS 122  -1.069  -2.480  -2.480
  968   2HZ   LYS 122          2HZ       LYS 122  -0.158  -3.608  -3.608
  969   3HZ   LYS 122          1HZ       LYS 122  -1.647  -4.057  -4.057
  970    H    VAL 123           H        VAL 123   0.944   0.082   0.082
  971    HA   VAL 123           HA       VAL 123  -0.756   1.024   1.024
  972    HB   VAL 123           HB       VAL 123   1.543   1.885   1.885
  973   1HG1  VAL 123          1HG1      VAL 123   1.202   1.945   1.945
  974   2HG1  VAL 123          3HG1      VAL 123   1.012   3.651   3.651
  975   3HG1  VAL 123          2HG1      VAL 123   2.483   2.793   2.793
  976   1HG2  VAL 123          3HG2      VAL 123  -0.368   3.225   3.225
  977   2HG2  VAL 123          2HG2      VAL 123   1.029   4.169   4.169
  978   3HG2  VAL 123          1HG2      VAL 123  -0.413   4.094   4.094
  979    H    HIS 124           H        HIS 124  -2.721   1.818   1.818
  980    HA   HIS 124           HA       HIS 124  -3.346   2.947   2.947
  981   1HB   HIS 124          2HB       HIS 124  -5.243   1.276   1.276
  982   2HB   HIS 124          1HB       HIS 124  -5.536   1.925   1.925
  983    HD1  HIS 124           HD1      HIS 124  -4.867   0.486   0.486
  984    HD2  HIS 124           HD2      HIS 124  -3.216  -0.809  -0.809
  985    HE1  HIS 124           HE1      HIS 124  -3.764  -1.712  -1.712
  986    HE2  HIS 124           HE2      HIS 124  -2.855  -2.522  -2.522
  987    H    GLY 125           H        GLY 125  -2.798   4.962   4.962
  988   1HA   GLY 125          2HA       GLY 125  -4.212   5.925   5.925
  989   2HA   GLY 125          1HA       GLY 125  -3.458   6.929   6.929
  990    H    PHE 126           HN       PHE 126  -6.293   6.332   6.332
  991    HA   PHE 126           HA       PHE 126  -8.258   6.157   6.157
  992   1HB   PHE 126          2HB       PHE 126  -9.752   6.821   6.821
  993   2HB   PHE 126          1HB       PHE 126  -8.378   6.338   6.338
  994    HD1  PHE 126           HD2      PHE 126  -6.599   8.441   8.441
  995    HD2  PHE 126           HD1      PHE 126 -10.824   8.687   8.687
  996    HE1  PHE 126           HE2      PHE 126  -6.573  10.670  10.670
  997    HE2  PHE 126           HE1      PHE 126 -10.807  10.916  10.916
  998    HZ   PHE 126           HZ       PHE 126  -8.679  11.911  11.911

  Start of MODEL    6
    1   1H    MET   1          3H        MET   1 -30.159 -58.984 -58.984
    2   2H    MET   1          2H        MET   1 -29.681 -58.858 -58.858
    3   3H    MET   1          1H        MET   1 -29.349 -57.577 -57.577
    4    HA   MET   1           HA       MET   1 -27.386 -58.800 -58.800
    5   1HB   MET   1          2HB       MET   1 -29.258 -60.977 -60.977
    6   2HB   MET   1          1HB       MET   1 -27.970 -61.269 -61.269
    7   1HG   MET   1          2HG       MET   1 -27.208 -60.401 -60.401
    8   2HG   MET   1          1HG       MET   1 -27.801 -62.047 -62.047
    9   1HE   MET   1          2HE       MET   1 -24.898 -61.108 -61.108
   10   2HE   MET   1          1HE       MET   1 -25.343 -62.813 -62.813
   11   3HE   MET   1          3HE       MET   1 -23.830 -62.263 -62.263
   12    H    ARG   2           H        ARG   2 -29.487 -59.781 -59.781
   13    HA   ARG   2           HA       ARG   2 -27.351 -59.020 -59.020
   14   1HB   ARG   2          2HB       ARG   2 -29.822 -60.718 -60.718
   15   2HB   ARG   2          1HB       ARG   2 -28.889 -60.172 -60.172
   16   1HG   ARG   2          2HG       ARG   2 -26.891 -61.277 -61.277
   17   2HG   ARG   2          1HG       ARG   2 -27.948 -61.942 -61.942
   18   1HD   ARG   2          2HD       ARG   2 -28.274 -62.381 -62.381
   19   2HD   ARG   2          1HD       ARG   2 -27.523 -63.522 -63.522
   20    HE   ARG   2           HE       ARG   2 -29.963 -63.091 -63.091
   21   1HH1  ARG   2          2HH1      ARG   2 -28.895 -64.029 -64.029
   22   2HH1  ARG   2          1HH1      ARG   2 -30.317 -64.956 -64.956
   23   1HH2  ARG   2          1HH2      ARG   2 -31.836 -64.309 -64.309
   24   2HH2  ARG   2          2HH2      ARG   2 -31.988 -65.114 -65.114
   25    H    GLY   3           H        GLY   3 -27.827 -57.729 -57.729
   26   1HA   GLY   3          2HA       GLY   3 -30.100 -55.894 -55.894
   27   2HA   GLY   3          1HA       GLY   3 -28.551 -55.387 -55.387
   28    H    SER   4           H        SER   4 -31.653 -56.011 -56.011
   29    HA   SER   4           HA       SER   4 -30.947 -56.864 -56.864
   30   1HB   SER   4          2HB       SER   4 -32.409 -58.480 -58.480
   31   2HB   SER   4          1HB       SER   4 -33.543 -57.207 -57.207
   32    HG   SER   4           HG       SER   4 -33.623 -58.618 -58.618
   33    H    HIS   5           H        HIS   5 -32.896 -54.641 -54.641
   34    HA   HIS   5           HA       HIS   5 -33.411 -53.060 -53.060
   35   1HB   HIS   5          2HB       HIS   5 -35.117 -53.864 -53.864
   36   2HB   HIS   5          1HB       HIS   5 -34.925 -52.118 -52.118
   37    HD1  HIS   5           HD1      HIS   5 -37.026 -51.218 -51.218
   38    HD2  HIS   5           HD2      HIS   5 -35.375 -54.221 -54.221
   39    HE1  HIS   5           HE1      HIS   5 -38.438 -51.297 -51.297
   40    HE2  HIS   5           HE2      HIS   5 -37.471 -53.179 -53.179
   41    H    HIS   6           H        HIS   6 -31.586 -51.819 -51.819
   42    HA   HIS   6           HA       HIS   6 -31.432 -49.514 -49.514
   43   1HB   HIS   6          2HB       HIS   6 -30.036 -51.789 -51.789
   44   2HB   HIS   6          1HB       HIS   6 -28.847 -50.605 -50.605
   45    HD1  HIS   6           HD1      HIS   6 -29.475 -51.381 -51.381
   46    HD2  HIS   6           HD2      HIS   6 -30.844 -48.009 -48.009
   47    HE1  HIS   6           HE1      HIS   6 -29.991 -49.695 -49.695
   48    HE2  HIS   6           HE2      HIS   6 -30.883 -47.687 -47.687
   49    H    HIS   7           H        HIS   7 -31.287 -48.358 -48.358
   50    HA   HIS   7           HA       HIS   7 -28.751 -48.581 -48.581
   51   1HB   HIS   7          2HB       HIS   7 -30.119 -48.035 -48.035
   52   2HB   HIS   7          1HB       HIS   7 -30.145 -49.691 -49.691
   53    HD1  HIS   7           HD1      HIS   7 -32.248 -46.888 -46.888
   54    HD2  HIS   7           HD2      HIS   7 -32.675 -50.346 -50.346
   55    HE1  HIS   7           HE1      HIS   7 -34.728 -47.255 -47.255
   56    HE2  HIS   7           HE2      HIS   7 -34.962 -49.304 -49.304
   57    H    HIS   8           H        HIS   8 -28.028 -46.735 -46.735
   58    HA   HIS   8           HA       HIS   8 -29.437 -44.243 -44.243
   59   1HB   HIS   8          2HB       HIS   8 -28.058 -45.128 -45.128
   60   2HB   HIS   8          1HB       HIS   8 -27.849 -43.442 -43.442
   61    HD1  HIS   8           HD1      HIS   8 -29.217 -43.057 -43.057
   62    HD2  HIS   8           HD2      HIS   8 -31.344 -44.677 -44.677
   63    HE1  HIS   8           HE1      HIS   8 -31.643 -42.729 -42.729
   64    HE2  HIS   8           HE2      HIS   8 -32.912 -43.789 -43.789
   65    H    HIS   9           H        HIS   9 -28.189 -42.438 -42.438
   66    HA   HIS   9           HA       HIS   9 -25.380 -42.462 -42.462
   67   1HB   HIS   9          2HB       HIS   9 -26.551 -44.072 -44.072
   68   2HB   HIS   9          1HB       HIS   9 -26.386 -42.542 -42.542
   69    HD1  HIS   9           HD1      HIS   9 -24.720 -45.316 -45.316
   70    HD2  HIS   9           HD2      HIS   9 -23.414 -41.759 -41.759
   71    HE1  HIS   9           HE1      HIS   9 -22.214 -45.353 -45.353
   72    HE2  HIS   9           HE2      HIS   9 -21.441 -43.233 -43.233
   73    H    HIS  10           H        HIS  10 -24.895 -40.381 -40.381
   74    HA   HIS  10           HA       HIS  10 -26.675 -38.433 -38.433
   75   1HB   HIS  10          2HB       HIS  10 -26.521 -38.503 -38.503
   76   2HB   HIS  10          1HB       HIS  10 -24.947 -37.749 -37.749
   77    HD1  HIS  10           HD1      HIS  10 -25.222 -35.525 -35.525
   78    HD2  HIS  10           HD2      HIS  10 -28.420 -36.640 -36.640
   79    HE1  HIS  10           HE1      HIS  10 -26.697 -33.493 -33.493
   80    HE2  HIS  10           HE2      HIS  10 -28.579 -34.165 -34.165
   81    H    THR  11           H        THR  11 -25.620 -38.064 -38.064
   82    HA   THR  11           HA       THR  11 -22.916 -36.930 -36.930
   83    HB   THR  11           HB       THR  11 -23.719 -38.532 -38.532
   84    HG1  THR  11           HG1      THR  11 -23.978 -39.963 -39.963
   85   1HG2  THR  11          3HG2      THR  11 -21.373 -37.169 -37.169
   86   2HG2  THR  11          2HG2      THR  11 -21.025 -38.897 -38.897
   87   3HG2  THR  11          1HG2      THR  11 -21.661 -38.102 -38.102
   88    H    ASP  12           H        ASP  12 -22.864 -34.917 -34.917
   89    HA   ASP  12           HA       ASP  12 -24.627 -34.173 -34.173
   90   1HB   ASP  12          2HB       ASP  12 -25.212 -33.404 -33.404
   91   2HB   ASP  12          1HB       ASP  12 -24.143 -32.089 -32.089
   92    HA   PRO  13           HA       PRO  13 -20.209 -33.136 -33.136
   93   1HB   PRO  13          2HB       PRO  13 -21.444 -33.296 -33.296
   94   2HB   PRO  13          1HB       PRO  13 -19.927 -33.986 -33.986
   95   1HG   PRO  13          2HG       PRO  13 -22.057 -35.532 -35.532
   96   2HG   PRO  13          1HG       PRO  13 -20.978 -35.812 -35.812
   97   1HD   PRO  13          2HD       PRO  13 -23.680 -34.534 -34.534
   98   2HD   PRO  13          1HD       PRO  13 -22.970 -35.607 -35.607
   99    H    MET  14           H        MET  14 -23.292 -31.749 -31.749
  100    HA   MET  14           HA       MET  14 -22.551 -29.511 -29.511
  101   1HB   MET  14          2HB       MET  14 -24.772 -29.864 -29.864
  102   2HB   MET  14          1HB       MET  14 -24.618 -28.457 -28.457
  103   1HG   MET  14          2HG       MET  14 -24.809 -29.896 -29.896
  104   2HG   MET  14          1HG       MET  14 -24.976 -31.302 -31.302
  105   1HE   MET  14          2HE       MET  14 -26.390 -29.556 -29.556
  106   2HE   MET  14          1HE       MET  14 -27.993 -30.272 -30.272
  107   3HE   MET  14          3HE       MET  14 -27.749 -28.564 -28.564
  108    H    SER  15           H        SER  15 -21.987 -30.224 -30.224
  109    HA   SER  15           HA       SER  15 -21.434 -27.435 -27.435
  110   1HB   SER  15          2HB       SER  15 -22.540 -29.373 -29.373
  111   2HB   SER  15          1HB       SER  15 -20.851 -29.567 -29.567
  112    HG   SER  15           HG       SER  15 -22.137 -28.019 -28.019
  113    H    ALA  16           H        ALA  16 -19.780 -29.168 -29.168
  114    HA   ALA  16           HA       ALA  16 -17.258 -28.145 -28.145
  115   1HB   ALA  16          1HB       ALA  16 -17.275 -29.783 -29.783
  116   2HB   ALA  16          3HB       ALA  16 -17.586 -31.075 -31.075
  117   3HB   ALA  16          2HB       ALA  16 -16.056 -30.200 -30.200
  118    H    ILE  17           H        ILE  17 -18.918 -28.324 -28.324
  119    HA   ILE  17           HA       ILE  17 -18.235 -30.331 -30.331
  120    HB   ILE  17           HB       ILE  17 -18.822 -27.474 -27.474
  121   1HG1  ILE  17          2HG1      ILE  17 -21.187 -28.964 -28.964
  122   2HG1  ILE  17          1HG1      ILE  17 -20.481 -29.388 -29.388
  123   1HG2  ILE  17          3HG2      ILE  17 -18.990 -30.112 -30.112
  124   2HG2  ILE  17          2HG2      ILE  17 -19.990 -28.750 -28.750
  125   3HG2  ILE  17          1HG2      ILE  17 -18.232 -28.610 -28.610
  126   1HD1  ILE  17          2HD1      ILE  17 -20.943 -26.567 -26.567
  127   2HD1  ILE  17          1HD1      ILE  17 -22.065 -27.484 -27.484
  128   3HD1  ILE  17          3HD1      ILE  17 -20.452 -27.099 -27.099
  129    H    GLN  18           H        GLN  18 -16.856 -30.211 -30.211
  130    HA   GLN  18           HA       GLN  18 -14.689 -28.289 -28.289
  131   1HB   GLN  18          2HB       GLN  18 -12.934 -30.040 -30.040
  132   2HB   GLN  18          1HB       GLN  18 -13.827 -29.917 -29.917
  133   1HG   GLN  18          2HG       GLN  18 -14.776 -31.886 -31.886
  134   2HG   GLN  18          1HG       GLN  18 -13.278 -32.240 -32.240
  135   1HE2  GLN  18          2HE2      GLN  18 -16.781 -32.911 -32.911
  136   2HE2  GLN  18          1HE2      GLN  18 -16.560 -32.578 -32.578
  137    H    ASN  19           H        ASN  19 -13.191 -28.659 -28.659
  138    HA   ASN  19           HA       ASN  19 -14.544 -30.042 -30.042
  139   1HB   ASN  19          2HB       ASN  19 -14.276 -27.261 -27.261
  140   2HB   ASN  19          1HB       ASN  19 -13.079 -27.732 -27.732
  141   1HD2  ASN  19          2HD2      ASN  19 -15.797 -27.205 -27.205
  142   2HD2  ASN  19          1HD2      ASN  19 -14.417 -26.469 -26.469
  143    H    LEU  20           H        LEU  20 -11.495 -28.485 -28.485
  144    HA   LEU  20           HA       LEU  20  -9.316 -29.021 -29.021
  145   1HB   LEU  20          2HB       LEU  20 -10.197 -31.096 -31.096
  146   2HB   LEU  20          1HB       LEU  20 -10.263 -31.853 -31.853
  147    HG   LEU  20           HG       LEU  20  -7.750 -31.173 -31.173
  148   1HD1  LEU  20          1HD1      LEU  20  -8.400 -30.778 -30.778
  149   2HD1  LEU  20          3HD1      LEU  20  -6.836 -31.466 -31.466
  150   3HD1  LEU  20          2HD1      LEU  20  -7.301 -29.876 -29.876
  151   1HD2  LEU  20          1HD2      LEU  20  -9.027 -33.436 -33.436
  152   2HD2  LEU  20          3HD2      LEU  20  -8.097 -33.432 -33.432
  153   3HD2  LEU  20          2HD2      LEU  20  -7.270 -33.285 -33.285
  154    H    HIS  21           H        HIS  21 -10.548 -28.004 -28.004
  155    HA   HIS  21           HA       HIS  21 -10.289 -27.744 -27.744
  156   1HB   HIS  21          2HB       HIS  21  -7.896 -28.077 -28.077
  157   2HB   HIS  21          1HB       HIS  21  -8.106 -29.816 -29.816
  158    HD1  HIS  21           HD1      HIS  21 -10.000 -27.925 -27.925
  159    HD2  HIS  21           HD2      HIS  21  -6.153 -29.456 -29.456
  160    HE1  HIS  21           HE1      HIS  21  -9.062 -27.928 -27.928
  161    HE2  HIS  21           HE2      HIS  21  -6.766 -28.940 -28.940
  162    H    SER  22           H        SER  22 -11.958 -28.431 -28.431
  163    HA   SER  22           HA       SER  22 -12.557 -31.286 -31.286
  164   1HB   SER  22          2HB       SER  22 -14.101 -28.787 -28.787
  165   2HB   SER  22          1HB       SER  22 -14.618 -30.338 -30.338
  166    HG   SER  22           HG       SER  22 -14.246 -29.724 -29.724
  167    H    PHE  23           H        PHE  23 -13.528 -31.929 -31.929
  168    HA   PHE  23           HA       PHE  23 -13.104 -32.467 -32.467
  169   1HB   PHE  23          2HB       PHE  23 -13.472 -29.873 -29.873
  170   2HB   PHE  23          1HB       PHE  23 -11.743 -29.833 -29.833
  171    HD1  PHE  23           HD1      PHE  23 -14.436 -32.163 -32.163
  172    HD2  PHE  23           HD2      PHE  23 -11.443 -29.356 -29.356
  173    HE1  PHE  23           HE1      PHE  23 -14.885 -32.644 -32.644
  174    HE2  PHE  23           HE2      PHE  23 -11.887 -29.832 -29.832
  175    HZ   PHE  23           HZ       PHE  23 -13.609 -31.477 -31.477
  176    H    ASP  24           H        ASP  24 -11.545 -34.003 -34.003
  177    HA   ASP  24           HA       ASP  24  -8.848 -33.416 -33.416
  178   1HB   ASP  24          2HB       ASP  24  -7.914 -34.659 -34.659
  179   2HB   ASP  24          1HB       ASP  24  -8.621 -33.091 -33.091
  180    HA   PRO  25           HA       PRO  25 -10.805 -37.476 -37.476
  181   1HB   PRO  25          2HB       PRO  25  -9.571 -36.440 -36.440
  182   2HB   PRO  25          1HB       PRO  25 -11.147 -37.201 -37.201
  183   1HG   PRO  25          2HG       PRO  25 -10.949 -34.575 -34.575
  184   2HG   PRO  25          1HG       PRO  25 -12.130 -35.235 -35.235
  185   1HD   PRO  25          2HD       PRO  25  -9.515 -33.891 -33.891
  186   2HD   PRO  25          1HD       PRO  25 -11.043 -33.783 -33.783
  187    H    PHE  26           H        PHE  26  -7.703 -35.886 -35.886
  188    HA   PHE  26           HA       PHE  26  -6.410 -38.532 -38.532
  189   1HB   PHE  26          2HB       PHE  26  -5.109 -35.998 -35.998
  190   2HB   PHE  26          1HB       PHE  26  -4.689 -37.664 -37.664
  191    HD1  PHE  26           HD2      PHE  26  -7.057 -34.934 -34.934
  192    HD2  PHE  26           HD1      PHE  26  -5.799 -38.851 -38.851
  193    HE1  PHE  26           HE2      PHE  26  -8.415 -34.798 -34.798
  194    HE2  PHE  26           HE1      PHE  26  -7.154 -38.723 -38.723
  195    HZ   PHE  26           HZ       PHE  26  -8.465 -36.695 -36.695
  196    H    ALA  27           H        ALA  27  -5.526 -35.180 -35.180
  197    HA   ALA  27           HA       ALA  27  -4.426 -34.310 -34.310
  198   1HB   ALA  27          2HB       ALA  27  -6.302 -35.798 -35.798
  199   2HB   ALA  27          1HB       ALA  27  -4.908 -36.731 -36.731
  200   3HB   ALA  27          3HB       ALA  27  -5.046 -35.024 -35.024
  201    H    ASP  28           H        ASP  28  -2.779 -35.355 -35.355
  202    HA   ASP  28           HA       ASP  28  -0.959 -37.251 -37.251
  203   1HB   ASP  28          2HB       ASP  28  -1.010 -35.806 -35.806
  204   2HB   ASP  28          1HB       ASP  28   0.377 -36.762 -36.762
  205    H    ALA  29           H        ALA  29  -1.261 -33.818 -33.818
  206    HA   ALA  29           HA       ALA  29   1.364 -32.959 -32.959
  207   1HB   ALA  29          1HB       ALA  29  -1.262 -31.825 -31.825
  208   2HB   ALA  29          3HB       ALA  29   0.191 -31.049 -31.049
  209   3HB   ALA  29          2HB       ALA  29  -0.043 -31.199 -31.199
  210    H    SER  30           H        SER  30   2.839 -33.669 -33.669
  211    HA   SER  30           HA       SER  30   2.045 -34.264 -34.264
  212   1HB   SER  30          2HB       SER  30   4.015 -35.353 -35.353
  213   2HB   SER  30          1HB       SER  30   4.724 -34.967 -34.967
  214    HG   SER  30           HG       SER  30   3.806 -36.700 -36.700
  215    H    LYS  31           H        LYS  31   4.349 -32.346 -32.346
  216    HA   LYS  31           HA       LYS  31   4.516 -30.430 -30.430
  217   1HB   LYS  31          2HB       LYS  31   7.045 -30.448 -30.448
  218   2HB   LYS  31          1HB       LYS  31   6.303 -31.822 -31.822
  219   1HG   LYS  31          2HG       LYS  31   7.050 -33.292 -33.292
  220   2HG   LYS  31          1HG       LYS  31   6.801 -32.180 -32.180
  221   1HD   LYS  31          2HD       LYS  31   9.086 -32.261 -32.261
  222   2HD   LYS  31          1HD       LYS  31   8.823 -30.912 -30.912
  223   1HE   LYS  31          2HE       LYS  31  10.158 -32.070 -32.070
  224   2HE   LYS  31          1HE       LYS  31   8.712 -33.028 -33.028
  225   1HZ   LYS  31          2HZ       LYS  31   9.641 -34.263 -34.263
  226   2HZ   LYS  31          1HZ       LYS  31  11.104 -33.719 -33.719
  227   3HZ   LYS  31          3HZ       LYS  31  10.078 -34.702 -34.702
  228    H    GLY  32           H        GLY  32   3.880 -28.699 -28.699
  229   1HA   GLY  32          2HA       GLY  32   5.570 -27.868 -27.868
  230   2HA   GLY  32          1HA       GLY  32   3.848 -28.032 -28.032
  231    H    ASP  33           H        ASP  33   2.433 -26.816 -26.816
  232    HA   ASP  33           HA       ASP  33   3.507 -24.557 -24.557
  233   1HB   ASP  33          2HB       ASP  33   3.651 -23.999 -23.999
  234   2HB   ASP  33          1HB       ASP  33   1.907 -23.784 -23.784
  235    H    ASP  34           H        ASP  34   1.735 -26.640 -26.640
  236    HA   ASP  34           HA       ASP  34  -0.981 -25.982 -25.982
  237   1HB   ASP  34          2HB       ASP  34   0.570 -27.594 -27.594
  238   2HB   ASP  34          1HB       ASP  34  -1.181 -27.423 -27.423
  239    H    LEU  35           H        LEU  35   1.000 -25.702 -25.702
  240    HA   LEU  35           HA       LEU  35  -0.772 -23.584 -23.584
  241   1HB   LEU  35          2HB       LEU  35   0.409 -25.681 -25.681
  242   2HB   LEU  35          1HB       LEU  35   1.506 -24.372 -24.372
  243    HG   LEU  35           HG       LEU  35  -0.157 -24.625 -24.625
  244   1HD1  LEU  35          1HD1      LEU  35   0.623 -22.306 -22.306
  245   2HD1  LEU  35          3HD1      LEU  35  -1.103 -22.162 -22.162
  246   3HD1  LEU  35          2HD1      LEU  35  -0.540 -22.406 -22.406
  247   1HD2  LEU  35          3HD2      LEU  35  -1.967 -24.807 -24.807
  248   2HD2  LEU  35          2HD2      LEU  35  -2.134 -25.443 -25.443
  249   3HD2  LEU  35          1HD2      LEU  35  -2.554 -23.764 -23.764
  250    H    LEU  36           H        LEU  36  -0.281 -21.503 -21.503
  251    HA   LEU  36           HA       LEU  36   2.060 -20.579 -20.579
  252   1HB   LEU  36          2HB       LEU  36   0.209 -18.963 -18.963
  253   2HB   LEU  36          1HB       LEU  36   1.263 -18.360 -18.360
  254    HG   LEU  36           HG       LEU  36  -1.105 -20.174 -20.174
  255   1HD1  LEU  36          3HD1      LEU  36  -1.610 -17.838 -17.838
  256   2HD1  LEU  36          2HD1      LEU  36  -0.912 -17.250 -17.250
  257   3HD1  LEU  36          1HD1      LEU  36  -2.334 -18.292 -18.292
  258   1HD2  LEU  36          3HD2      LEU  36   1.052 -19.883 -19.883
  259   2HD2  LEU  36          2HD2      LEU  36  -0.578 -20.195 -20.195
  260   3HD2  LEU  36          1HD2      LEU  36   0.051 -18.548 -18.548
  261    HA   PRO  37           HA       PRO  37   4.990 -20.294 -20.294
  262   1HB   PRO  37          2HB       PRO  37   6.412 -18.100 -18.100
  263   2HB   PRO  37          1HB       PRO  37   6.552 -19.665 -19.665
  264   1HG   PRO  37          2HG       PRO  37   4.977 -17.249 -17.249
  265   2HG   PRO  37          1HG       PRO  37   5.967 -18.324 -18.324
  266   1HD   PRO  37          2HD       PRO  37   3.272 -18.510 -18.510
  267   2HD   PRO  37          1HD       PRO  37   4.315 -19.928 -19.928
  268    H    ALA  38           H        ALA  38   3.233 -17.348 -17.348
  269    HA   ALA  38           HA       ALA  38   2.468 -16.792 -16.792
  270   1HB   ALA  38          1HB       ALA  38   5.062 -16.171 -16.171
  271   2HB   ALA  38          3HB       ALA  38   4.353 -14.656 -14.656
  272   3HB   ALA  38          2HB       ALA  38   3.950 -15.281 -15.281
  273    H    GLY  39           H        GLY  39   0.584 -15.800 -15.800
  274   1HA   GLY  39          2HA       GLY  39   0.321 -13.882 -13.882
  275   2HA   GLY  39          1HA       GLY  39  -0.961 -14.994 -14.994
  276    H    THR  40           H        THR  40   0.882 -13.587 -13.587
  277    HA   THR  40           HA       THR  40  -0.605 -11.213 -11.213
  278    HB   THR  40           HB       THR  40  -1.636 -12.235 -12.235
  279    HG1  THR  40           HG1      THR  40  -1.811 -14.393 -14.393
  280   1HG2  THR  40          1HG2      THR  40  -2.726 -11.298 -11.298
  281   2HG2  THR  40          3HG2      THR  40  -3.325 -12.956 -12.956
  282   3HG2  THR  40          2HG2      THR  40  -3.647 -11.896 -11.896
  283    H    GLU  41           H        GLU  41   1.220 -13.827 -13.827
  284    HA   GLU  41           HA       GLU  41   2.973 -13.830 -13.830
  285   1HB   GLU  41          2HB       GLU  41   3.244 -11.427 -11.427
  286   2HB   GLU  41          1HB       GLU  41   3.743 -11.107 -11.107
  287   1HG   GLU  41          2HG       GLU  41   5.171 -13.204 -13.204
  288   2HG   GLU  41          1HG       GLU  41   4.862 -13.104 -13.104
  289    H    ASP  42           H        ASP  42   0.131 -12.786 -12.786
  290    HA   ASP  42           HA       ASP  42  -0.945 -11.986 -11.986
  291   1HB   ASP  42          2HB       ASP  42   0.462 -14.113 -14.113
  292   2HB   ASP  42          1HB       ASP  42   1.314 -12.927 -12.927
  293    H    TYR  43           H        TYR  43  -0.038  -9.853  -9.853
  294    HA   TYR  43           HA       TYR  43   1.993  -8.415  -8.415
  295   1HB   TYR  43          2HB       TYR  43  -0.471  -7.325  -7.325
  296   2HB   TYR  43          1HB       TYR  43   1.006  -6.432  -6.432
  297    HD1  TYR  43           HD1      TYR  43   2.866  -8.829  -8.829
  298    HD2  TYR  43           HD2      TYR  43  -0.408  -6.934  -6.934
  299    HE1  TYR  43           HE1      TYR  43   3.784  -9.497  -9.497
  300    HE2  TYR  43           HE2      TYR  43   0.501  -7.604  -7.604
  301    HH   TYR  43           HH       TYR  43   3.067  -8.194  -8.194
  302    H    ILE  44           H        ILE  44   1.455  -6.235  -6.235
  303    HA   ILE  44           HA       ILE  44  -0.421  -6.835  -6.835
  304    HB   ILE  44           HB       ILE  44   2.026  -5.062  -5.062
  305   1HG1  ILE  44          2HG1      ILE  44   2.764  -7.315  -7.315
  306   2HG1  ILE  44          1HG1      ILE  44   2.796  -6.788  -6.788
  307   1HG2  ILE  44          1HG2      ILE  44   0.047  -4.383  -4.383
  308   2HG2  ILE  44          3HG2      ILE  44   0.355  -5.864  -5.864
  309   3HG2  ILE  44          2HG2      ILE  44   1.595  -4.613  -4.613
  310   1HD1  ILE  44          1HD1      ILE  44   0.481  -7.846  -7.846
  311   2HD1  ILE  44          3HD1      ILE  44   0.876  -8.646  -8.646
  312   3HD1  ILE  44          2HD1      ILE  44   1.879  -8.917  -8.917
  313    H    HIS  45           H        HIS  45  -2.266  -5.923  -5.923
  314    HA   HIS  45           HA       HIS  45  -2.408  -3.437  -3.437
  315   1HB   HIS  45          2HB       HIS  45  -4.171  -5.556  -5.556
  316   2HB   HIS  45          1HB       HIS  45  -4.897  -4.062  -4.062
  317    HD1  HIS  45           HD1      HIS  45  -3.885  -5.826  -5.826
  318    HD2  HIS  45           HD2      HIS  45  -5.757  -2.302  -2.302
  319    HE1  HIS  45           HE1      HIS  45  -4.899  -4.886  -4.886
  320    HE2  HIS  45           HE2      HIS  45  -6.119  -2.809  -2.809
  321    H    ILE  46           H        ILE  46  -2.125  -1.505  -1.505
  322    HA   ILE  46           HA       ILE  46  -2.246  -1.021  -1.021
  323    HB   ILE  46           HB       ILE  46  -1.795   0.938   0.938
  324   1HG1  ILE  46          2HG1      ILE  46  -0.095  -0.871  -0.871
  325   2HG1  ILE  46          1HG1      ILE  46   0.565   0.727   0.727
  326   1HG2  ILE  46          2HG2      ILE  46  -1.911   1.222   1.222
  327   2HG2  ILE  46          1HG2      ILE  46  -0.597   2.065   2.065
  328   3HG2  ILE  46          3HG2      ILE  46  -2.271   2.391   2.391
  329   1HD1  ILE  46          3HD1      ILE  46   0.040   0.033   0.033
  330   2HD1  ILE  46          2HD1      ILE  46   0.185  -1.588  -1.588
  331   3HD1  ILE  46          1HD1      ILE  46   1.529  -0.453  -0.453
  332    H    ARG  47           H        ARG  47  -3.515   1.482   1.482
  333    HA   ARG  47           HA       ARG  47  -5.654   2.204   2.204
  334   1HB   ARG  47          2HB       ARG  47  -6.351  -0.241  -0.241
  335   2HB   ARG  47          1HB       ARG  47  -6.791   0.379   0.379
  336   1HG   ARG  47          2HG       ARG  47  -8.718   1.121   1.121
  337   2HG   ARG  47          1HG       ARG  47  -7.878   2.106   2.106
  338   1HD   ARG  47          2HD       ARG  47  -7.803  -0.619  -0.619
  339   2HD   ARG  47          1HD       ARG  47  -9.462  -0.207  -0.207
  340    HE   ARG  47           HE       ARG  47  -8.068   0.631   0.631
  341   1HH1  ARG  47          2HH1      ARG  47 -10.295   1.826   1.826
  342   2HH1  ARG  47          1HH1      ARG  47 -11.005   2.999   2.999
  343   1HH2  ARG  47          1HH2      ARG  47  -9.000   2.174   2.174
  344   2HH2  ARG  47          2HH2      ARG  47 -10.271   3.196   3.196
  345    H    ILE  48           H        ILE  48  -6.455   4.027   4.027
  346    HA   ILE  48           HA       ILE  48  -6.037   4.679   4.679
  347    HB   ILE  48           HB       ILE  48  -5.558   6.208   6.208
  348   1HG1  ILE  48          2HG1      ILE  48  -4.506   6.420   6.420
  349   2HG1  ILE  48          1HG1      ILE  48  -3.752   5.539   5.539
  350   1HG2  ILE  48          3HG2      ILE  48  -6.849   7.532   7.532
  351   2HG2  ILE  48          2HG2      ILE  48  -5.984   8.398   8.398
  352   3HG2  ILE  48          1HG2      ILE  48  -7.445   7.490   7.490
  353   1HD1  ILE  48          2HD1      ILE  48  -3.474   7.668   7.668
  354   2HD1  ILE  48          1HD1      ILE  48  -4.142   8.516   8.516
  355   3HD1  ILE  48          3HD1      ILE  48  -2.622   7.632   7.632
  356    H    GLN  49           H        GLN  49  -7.654   6.050   6.050
  357    HA   GLN  49           HA       GLN  49 -10.219   6.229   6.229
  358   1HB   GLN  49          2HB       GLN  49 -11.442   5.238   5.238
  359   2HB   GLN  49          1HB       GLN  49 -10.306   4.089   4.089
  360   1HG   GLN  49          2HG       GLN  49  -8.796   5.187   5.187
  361   2HG   GLN  49          1HG       GLN  49 -10.403   5.281   5.281
  362   1HE2  GLN  49          2HE2      GLN  49 -10.153   2.022   2.022
  363   2HE2  GLN  49          1HE2      GLN  49 -10.556   3.673   3.673
  364    H    GLN  50           H        GLN  50 -10.161   8.427   8.427
  365    HA   GLN  50           HA       GLN  50  -9.834   9.841   9.841
  366   1HB   GLN  50          2HB       GLN  50  -8.983  10.390  10.390
  367   2HB   GLN  50          1HB       GLN  50 -10.230  11.577  11.577
  368   1HG   GLN  50          2HG       GLN  50  -8.941  12.681  12.681
  369   2HG   GLN  50          1HG       GLN  50  -8.253  11.198  11.198
  370   1HE2  GLN  50          2HE2      GLN  50  -5.759  13.294  13.294
  371   2HE2  GLN  50          1HE2      GLN  50  -6.974  13.717  13.717
  372    H    ARG  51           H        ARG  51 -11.773   9.649   9.649
  373    HA   ARG  51           HA       ARG  51 -14.307   9.683   9.683
  374   1HB   ARG  51          2HB       ARG  51 -13.640  10.817  10.817
  375   2HB   ARG  51          1HB       ARG  51 -15.164  10.110  10.110
  376   1HG   ARG  51          2HG       ARG  51 -13.135   8.174   8.174
  377   2HG   ARG  51          1HG       ARG  51 -12.938   8.842   8.842
  378   1HD   ARG  51          2HD       ARG  51 -15.418   7.597   7.597
  379   2HD   ARG  51          1HD       ARG  51 -14.413   6.952   6.952
  380    HE   ARG  51           HE       ARG  51 -15.213   9.342   9.342
  381   1HH1  ARG  51          2HH1      ARG  51 -16.935   6.640   6.640
  382   2HH1  ARG  51          1HH1      ARG  51 -18.369   6.918   6.918
  383   1HH2  ARG  51          1HH2      ARG  51 -17.098   9.709   9.709
  384   2HH2  ARG  51          2HH2      ARG  51 -18.462   8.661   8.661
  385    H    ASN  52           H        ASN  52 -12.192  12.314  12.314
  386    HA   ASN  52           HA       ASN  52 -14.057  14.190  14.190
  387   1HB   ASN  52          2HB       ASN  52 -12.364  15.052  15.052
  388   2HB   ASN  52          1HB       ASN  52 -13.816  15.806  15.806
  389   1HD2  ASN  52          2HD2      ASN  52 -14.177  13.583  13.583
  390   2HD2  ASN  52          1HD2      ASN  52 -12.778  14.444  14.444
  391    H    GLY  53           H        GLY  53 -12.149  16.407  16.407
  392   1HA   GLY  53          2HA       GLY  53 -10.336  15.837  15.837
  393   2HA   GLY  53          1HA       GLY  53 -10.652  17.415  17.415
  394    H    ARG  54           H        ARG  54  -9.872  14.608  14.608
  395    HA   ARG  54           HA       ARG  54  -7.101  14.902  14.902
  396   1HB   ARG  54          2HB       ARG  54  -6.825  16.054  16.054
  397   2HB   ARG  54          1HB       ARG  54  -7.573  17.102  17.102
  398   1HG   ARG  54          2HG       ARG  54  -9.789  16.540  16.540
  399   2HG   ARG  54          1HG       ARG  54  -8.921  15.694  15.694
  400   1HD   ARG  54          2HD       ARG  54  -9.046  17.701  17.701
  401   2HD   ARG  54          1HD       ARG  54  -7.626  18.048  18.048
  402    HE   ARG  54           HE       ARG  54 -10.082  18.677  18.677
  403   1HH1  ARG  54          2HH1      ARG  54  -7.721  19.851  19.851
  404   2HH1  ARG  54          1HH1      ARG  54  -8.084  21.519  21.519
  405   1HH2  ARG  54          1HH2      ARG  54 -10.561  20.870  20.870
  406   2HH2  ARG  54          2HH2      ARG  54  -9.696  22.097  22.097
  407    H    LYS  55           H        LYS  55 -10.072  14.013  14.013
  408    HA   LYS  55           HA       LYS  55  -8.925  12.279  12.279
  409   1HB   LYS  55          2HB       LYS  55 -11.267  13.195  13.195
  410   2HB   LYS  55          1HB       LYS  55 -11.678  12.058  12.058
  411   1HG   LYS  55          2HG       LYS  55 -12.368  11.191  11.191
  412   2HG   LYS  55          1HG       LYS  55 -11.069  10.197  10.197
  413   1HD   LYS  55          2HD       LYS  55 -10.736  10.604  10.604
  414   2HD   LYS  55          1HD       LYS  55  -9.454  11.353  11.353
  415   1HE   LYS  55          2HE       LYS  55 -10.418  12.746  12.746
  416   2HE   LYS  55          1HE       LYS  55 -10.352  13.510  13.510
  417   1HZ   LYS  55          1HZ       LYS  55 -12.782  12.143  12.143
  418   2HZ   LYS  55          3HZ       LYS  55 -12.482  13.782  13.782
  419   3HZ   LYS  55          2HZ       LYS  55 -12.649  13.224  13.224
  420    H    THR  56           H        THR  56  -7.324  11.366  11.366
  421    HA   THR  56           HA       THR  56  -8.349   9.308   9.308
  422    HB   THR  56           HB       THR  56  -5.442   9.527   9.527
  423    HG1  THR  56           HG1      THR  56  -5.700  11.661  11.661
  424   1HG2  THR  56          3HG2      THR  56  -7.294   9.420   9.420
  425   2HG2  THR  56          2HG2      THR  56  -5.596   9.857   9.857
  426   3HG2  THR  56          1HG2      THR  56  -6.033   8.283   8.283
  427    H    LEU  57           H        LEU  57  -7.348   7.145   7.145
  428    HA   LEU  57           HA       LEU  57  -6.253   6.213   6.213
  429   1HB   LEU  57          2HB       LEU  57  -9.093   5.871   5.871
  430   2HB   LEU  57          1HB       LEU  57  -8.278   4.402   4.402
  431    HG   LEU  57           HG       LEU  57  -8.233   6.927   6.927
  432   1HD1  LEU  57          2HD1      LEU  57 -10.252   4.724   4.724
  433   2HD1  LEU  57          1HD1      LEU  57  -9.932   5.573   5.573
  434   3HD1  LEU  57          3HD1      LEU  57 -10.502   6.466   6.466
  435   1HD2  LEU  57          2HD2      LEU  57  -7.388   4.090   4.090
  436   2HD2  LEU  57          1HD2      LEU  57  -6.525   5.582   5.582
  437   3HD2  LEU  57          3HD2      LEU  57  -7.878   5.067   5.067
  438    H    THR  58           H        THR  58  -4.600   5.800   5.800
  439    HA   THR  58           HA       THR  58  -4.927   4.083   4.083
  440    HB   THR  58           HB       THR  58  -2.390   4.042   4.042
  441    HG1  THR  58           HG1      THR  58  -3.575   6.277   6.277
  442   1HG2  THR  58          2HG2      THR  58  -2.973   4.276   4.276
  443   2HG2  THR  58          1HG2      THR  58  -1.365   4.313   4.313
  444   3HG2  THR  58          3HG2      THR  58  -2.355   2.859   2.859
  445    H    THR  59           H        THR  59  -4.959   1.905   1.905
  446    HA   THR  59           HA       THR  59  -4.691   0.267   0.267
  447    HB   THR  59           HB       THR  59  -6.286  -1.236  -1.236
  448    HG1  THR  59           HG1      THR  59  -7.432   0.025   0.025
  449   1HG2  THR  59          2HG2      THR  59  -6.622   0.210   0.210
  450   2HG2  THR  59          1HG2      THR  59  -8.108   0.196   0.196
  451   3HG2  THR  59          3HG2      THR  59  -7.323  -1.324  -1.324
  452    H    VAL  60           H        VAL  60  -3.700  -1.745  -1.745
  453    HA   VAL  60           HA       VAL  60  -2.215  -2.140  -2.140
  454    HB   VAL  60           HB       VAL  60  -1.239  -3.492  -3.492
  455   1HG1  VAL  60          2HG1      VAL  60  -0.233  -2.533  -2.533
  456   2HG1  VAL  60          1HG1      VAL  60   0.877  -2.293  -2.293
  457   3HG1  VAL  60          3HG1      VAL  60   0.279  -3.910  -3.910
  458   1HG2  VAL  60          2HG2      VAL  60  -0.952  -0.517  -0.517
  459   2HG2  VAL  60          1HG2      VAL  60  -1.725  -1.329  -1.329
  460   3HG2  VAL  60          3HG2      VAL  60   0.017  -1.471  -1.471
  461    H    GLN  61           H        GLN  61  -2.828  -3.816  -3.816
  462    HA   GLN  61           HA       GLN  61  -4.065  -6.110  -6.110
  463   1HB   GLN  61          2HB       GLN  61  -5.336  -4.554  -4.554
  464   2HB   GLN  61          1HB       GLN  61  -4.552  -5.643  -5.643
  465   1HG   GLN  61          2HG       GLN  61  -5.597  -7.374  -7.374
  466   2HG   GLN  61          1HG       GLN  61  -6.809  -6.095  -6.095
  467   1HE2  GLN  61          2HE2      GLN  61  -7.082  -6.616  -6.616
  468   2HE2  GLN  61          1HE2      GLN  61  -6.499  -5.337  -5.337
  469    H    GLY  62           H        GLY  62  -3.612  -8.205  -8.205
  470   1HA   GLY  62          2HA       GLY  62  -2.443  -9.704  -9.704
  471   2HA   GLY  62          1HA       GLY  62  -1.338  -8.394  -8.394
  472    H    ILE  63           H        ILE  63  -0.925  -7.554  -7.554
  473    HA   ILE  63           HA       ILE  63   1.331  -8.987  -8.987
  474    HB   ILE  63           HB       ILE  63  -0.473  -7.284  -7.284
  475   1HG1  ILE  63          2HG1      ILE  63   0.520  -5.769  -5.769
  476   2HG1  ILE  63          1HG1      ILE  63   1.811  -5.896  -5.896
  477   1HG2  ILE  63          2HG2      ILE  63   1.743  -8.965  -8.965
  478   2HG2  ILE  63          1HG2      ILE  63   1.969  -7.271  -7.271
  479   3HG2  ILE  63          3HG2      ILE  63   0.527  -8.134  -8.134
  480   1HD1  ILE  63          3HD1      ILE  63   2.797  -7.682  -7.682
  481   2HD1  ILE  63          2HD1      ILE  63   1.656  -7.101  -7.101
  482   3HD1  ILE  63          1HD1      ILE  63   2.870  -6.007  -6.007
  483    H    ALA  64           H        ALA  64   1.826 -10.566 -10.566
  484    HA   ALA  64           HA       ALA  64  -0.310 -12.472 -12.472
  485   1HB   ALA  64          1HB       ALA  64   1.960 -13.090 -13.090
  486   2HB   ALA  64          3HB       ALA  64   2.593 -12.801 -12.801
  487   3HB   ALA  64          2HB       ALA  64   1.384 -14.058 -14.058
  488    H    ASP  65           H        ASP  65  -1.048 -13.144 -13.144
  489    HA   ASP  65           HA       ASP  65  -0.902 -11.347 -11.347
  490   1HB   ASP  65          2HB       ASP  65  -2.771 -13.022 -13.022
  491   2HB   ASP  65          1HB       ASP  65  -1.787 -14.216 -14.216
  492    H    ASP  66           H        ASP  66   1.095 -13.947 -13.947
  493    HA   ASP  66           HA       ASP  66   2.139 -14.685 -14.685
  494   1HB   ASP  66          2HB       ASP  66   2.273 -15.843 -15.843
  495   2HB   ASP  66          1HB       ASP  66   3.806 -14.975 -14.975
  496    H    TYR  67           H        TYR  67   2.651 -12.018 -12.018
  497    HA   TYR  67           HA       TYR  67   5.273 -11.282 -11.282
  498   1HB   TYR  67          2HB       TYR  67   2.753  -9.679  -9.679
  499   2HB   TYR  67          1HB       TYR  67   4.302  -8.885  -8.885
  500    HD1  TYR  67           HD1      TYR  67   4.480 -11.990 -11.990
  501    HD2  TYR  67           HD2      TYR  67   3.766  -7.816  -7.816
  502    HE1  TYR  67           HE1      TYR  67   4.919 -12.127 -12.127
  503    HE2  TYR  67           HE2      TYR  67   4.200  -7.931  -7.931
  504    HH   TYR  67           HH       TYR  67   5.684  -9.713  -9.713
  505    H    ASP  68           H        ASP  68   5.666  -9.050  -9.050
  506    HA   ASP  68           HA       ASP  68   5.244  -9.756  -9.756
  507   1HB   ASP  68          2HB       ASP  68   6.976  -7.577  -7.577
  508   2HB   ASP  68          1HB       ASP  68   6.981  -8.113  -8.113
  509    H    LYS  69           H        LYS  69   2.957  -9.190  -9.190
  510    HA   LYS  69           HA       LYS  69   1.734  -6.896  -6.896
  511   1HB   LYS  69          2HB       LYS  69   1.080  -9.055  -9.055
  512   2HB   LYS  69          1HB       LYS  69   0.906  -7.691  -7.691
  513   1HG   LYS  69          2HG       LYS  69  -0.622  -6.616  -6.616
  514   2HG   LYS  69          1HG       LYS  69  -0.430  -7.963  -7.963
  515   1HD   LYS  69          2HD       LYS  69  -1.154  -8.878  -8.878
  516   2HD   LYS  69          1HD       LYS  69  -2.332  -7.726  -7.726
  517   1HE   LYS  69          2HE       LYS  69  -2.067  -9.211  -9.211
  518   2HE   LYS  69          1HE       LYS  69  -1.580 -10.427 -10.427
  519   1HZ   LYS  69          1HZ       LYS  69  -4.008  -8.923  -8.923
  520   2HZ   LYS  69          3HZ       LYS  69  -4.094 -10.036 -10.036
  521   3HZ   LYS  69          2HZ       LYS  69  -3.652 -10.552 -10.552
  522    H    LYS  70           H        LYS  70   3.454  -7.361  -7.361
  523    HA   LYS  70           HA       LYS  70   2.966  -4.769  -4.769
  524   1HB   LYS  70          2HB       LYS  70   5.239  -6.665  -6.665
  525   2HB   LYS  70          1HB       LYS  70   4.805  -5.249  -5.249
  526   1HG   LYS  70          2HG       LYS  70   2.813  -6.216  -6.216
  527   2HG   LYS  70          1HG       LYS  70   2.840  -7.455  -7.455
  528   1HD   LYS  70          2HD       LYS  70   3.585  -8.709  -8.709
  529   2HD   LYS  70          1HD       LYS  70   5.134  -8.067  -8.067
  530   1HE   LYS  70          2HE       LYS  70   3.506  -6.629  -6.629
  531   2HE   LYS  70          1HE       LYS  70   4.580  -7.953  -7.953
  532   1HZ   LYS  70          1HZ       LYS  70   6.251  -6.535  -6.535
  533   2HZ   LYS  70          3HZ       LYS  70   5.232  -5.273  -5.273
  534   3HZ   LYS  70          2HZ       LYS  70   6.010  -6.224  -6.224
  535    H    LYS  71           H        LYS  71   5.739  -6.140  -6.140
  536    HA   LYS  71           HA       LYS  71   7.117  -3.616  -3.616
  537   1HB   LYS  71          2HB       LYS  71   7.962  -6.175  -6.175
  538   2HB   LYS  71          1HB       LYS  71   7.946  -5.760  -5.760
  539   1HG   LYS  71          2HG       LYS  71   9.177  -3.595  -3.595
  540   2HG   LYS  71          1HG       LYS  71   9.814  -5.007  -5.007
  541   1HD   LYS  71          2HD       LYS  71   9.668  -5.156  -5.156
  542   2HD   LYS  71          1HD       LYS  71  10.879  -4.073  -4.073
  543   1HE   LYS  71          2HE       LYS  71  11.690  -6.397  -6.397
  544   2HE   LYS  71          1HE       LYS  71  11.888  -5.856  -5.856
  545   1HZ   LYS  71          1HZ       LYS  71   9.598  -7.501  -7.501
  546   2HZ   LYS  71          3HZ       LYS  71  11.012  -8.156  -8.156
  547   3HZ   LYS  71          2HZ       LYS  71  10.032  -7.143  -7.143
  548    H    LEU  72           H        LEU  72   4.399  -4.293  -4.293
  549    HA   LEU  72           HA       LEU  72   5.228  -3.265  -3.265
  550   1HB   LEU  72          2HB       LEU  72   2.961  -4.952  -4.952
  551   2HB   LEU  72          1HB       LEU  72   2.675  -3.887  -3.887
  552    HG   LEU  72           HG       LEU  72   3.922  -5.139  -5.139
  553   1HD1  LEU  72          3HD1      LEU  72   5.718  -5.619  -5.619
  554   2HD1  LEU  72          2HD1      LEU  72   5.886  -6.558  -6.558
  555   3HD1  LEU  72          1HD1      LEU  72   6.071  -4.802  -4.802
  556   1HD2  LEU  72          3HD2      LEU  72   2.416  -6.666  -6.666
  557   2HD2  LEU  72          2HD2      LEU  72   3.105  -7.203  -7.203
  558   3HD2  LEU  72          1HD2      LEU  72   3.970  -7.498  -7.498
  559    H    VAL  73           H        VAL  73   2.289  -2.966  -2.966
  560    HA   VAL  73           HA       VAL  73   1.836  -0.309  -0.309
  561    HB   VAL  73           HB       VAL  73   0.043  -2.001  -2.001
  562   1HG1  VAL  73          1HG1      VAL  73   1.087  -2.453  -2.453
  563   2HG1  VAL  73          3HG1      VAL  73   0.522  -0.861  -0.861
  564   3HG1  VAL  73          2HG1      VAL  73  -0.641  -2.101  -2.101
  565   1HG2  VAL  73          3HG2      VAL  73  -0.296   0.424   0.424
  566   2HG2  VAL  73          2HG2      VAL  73  -1.514  -0.281  -0.281
  567   3HG2  VAL  73          1HG2      VAL  73  -0.252   0.754   0.754
  568    H    LYS  74           H        LYS  74   3.028  -1.727  -1.727
  569    HA   LYS  74           HA       LYS  74   3.135   0.704   0.704
  570   1HB   LYS  74          2HB       LYS  74   3.499  -1.891  -1.891
  571   2HB   LYS  74          1HB       LYS  74   5.174  -1.363  -1.363
  572   1HG   LYS  74          2HG       LYS  74   4.884   0.208   0.208
  573   2HG   LYS  74          1HG       LYS  74   3.124   0.137   0.137
  574   1HD   LYS  74          2HD       LYS  74   4.015  -2.488  -2.488
  575   2HD   LYS  74          1HD       LYS  74   4.890  -1.418  -1.418
  576   1HE   LYS  74          2HE       LYS  74   3.051  -1.619  -1.619
  577   2HE   LYS  74          1HE       LYS  74   2.387  -0.403  -0.403
  578   1HZ   LYS  74          3HZ       LYS  74   2.132  -3.284  -3.284
  579   2HZ   LYS  74          2HZ       LYS  74   1.030  -2.505  -2.505
  580   3HZ   LYS  74          1HZ       LYS  74   1.204  -1.997  -1.997
  581    H    ALA  75           H        ALA  75   5.477  -1.058  -1.058
  582    HA   ALA  75           HA       ALA  75   7.648   0.704   0.704
  583   1HB   ALA  75          3HB       ALA  75   6.969  -1.222  -1.222
  584   2HB   ALA  75          2HB       ALA  75   8.472  -0.299  -0.299
  585   3HB   ALA  75          1HB       ALA  75   8.104  -1.455  -1.455
  586    H    PHE  76           H        PHE  76   5.055   0.533   0.533
  587    HA   PHE  76           HA       PHE  76   5.825   2.528   2.528
  588   1HB   PHE  76          2HB       PHE  76   3.732   1.002   1.002
  589   2HB   PHE  76          1HB       PHE  76   2.966   2.288   2.288
  590    HD1  PHE  76           HD1      PHE  76   4.488   1.414   1.414
  591    HD2  PHE  76           HD2      PHE  76   2.323   4.341   4.341
  592    HE1  PHE  76           HE1      PHE  76   3.996   2.614   2.614
  593    HE2  PHE  76           HE2      PHE  76   1.825   5.548   5.548
  594    HZ   PHE  76           HZ       PHE  76   2.663   4.682   4.682
  595    H    LYS  77           H        LYS  77   4.267   2.834   2.834
  596    HA   LYS  77           HA       LYS  77   3.902   5.667   5.667
  597   1HB   LYS  77          2HB       LYS  77   3.864   3.835   3.835
  598   2HB   LYS  77          1HB       LYS  77   3.336   5.512   5.512
  599   1HG   LYS  77          2HG       LYS  77   1.347   5.001   5.001
  600   2HG   LYS  77          1HG       LYS  77   2.043   3.895   3.895
  601   1HD   LYS  77          2HD       LYS  77   1.115   2.257   2.257
  602   2HD   LYS  77          1HD       LYS  77   2.391   2.558   2.558
  603   1HE   LYS  77          2HE       LYS  77   0.803   3.046   3.046
  604   2HE   LYS  77          1HE       LYS  77   0.444   4.486   4.486
  605   1HZ   LYS  77          3HZ       LYS  77  -0.904   2.636   2.636
  606   2HZ   LYS  77          2HZ       LYS  77  -1.015   1.988   1.988
  607   3HZ   LYS  77          1HZ       LYS  77  -1.581   3.552   3.552
  608    H    LYS  78           H        LYS  78   6.644   3.811   3.811
  609    HA   LYS  78           HA       LYS  78   7.986   5.841   5.841
  610   1HB   LYS  78          2HB       LYS  78   8.076   3.338   3.338
  611   2HB   LYS  78          1HB       LYS  78   9.153   3.190   3.190
  612   1HG   LYS  78          2HG       LYS  78  10.887   4.049   4.049
  613   2HG   LYS  78          1HG       LYS  78   9.909   5.327   5.327
  614   1HD   LYS  78          2HD       LYS  78  10.691   3.972   3.972
  615   2HD   LYS  78          1HD       LYS  78   8.986   3.577   3.577
  616   1HE   LYS  78          2HE       LYS  78   9.779   1.662   1.662
  617   2HE   LYS  78          1HE       LYS  78  11.394   1.984   1.984
  618   1HZ   LYS  78          3HZ       LYS  78  10.073   1.836   1.836
  619   2HZ   LYS  78          2HZ       LYS  78   9.074   0.834   0.834
  620   3HZ   LYS  78          1HZ       LYS  78  10.716   0.465   0.465
  621    H    LYS  79           H        LYS  79   7.729   4.620   4.620
  622    HA   LYS  79           HA       LYS  79  10.286   5.718   5.718
  623   1HB   LYS  79          2HB       LYS  79   8.921   3.559   3.559
  624   2HB   LYS  79          1HB       LYS  79   8.344   4.753   4.753
  625   1HG   LYS  79          2HG       LYS  79  11.108   5.120   5.120
  626   2HG   LYS  79          1HG       LYS  79  10.864   3.373   3.373
  627   1HD   LYS  79          2HD       LYS  79   9.748   3.421   3.421
  628   2HD   LYS  79          1HD       LYS  79   9.414   5.150   5.150
  629   1HE   LYS  79          2HE       LYS  79  12.198   4.036   4.036
  630   2HE   LYS  79          1HE       LYS  79  11.216   4.464   4.464
  631   1HZ   LYS  79          3HZ       LYS  79  11.710   6.407   6.407
  632   2HZ   LYS  79          2HZ       LYS  79  12.823   6.202   6.202
  633   3HZ   LYS  79          1HZ       LYS  79  11.244   6.703   6.703
  634    H    PHE  80           H        PHE  80   6.828   6.267   6.267
  635    HA   PHE  80           HA       PHE  80   7.546   8.899   8.899
  636   1HB   PHE  80          2HB       PHE  80   4.876   7.670   7.670
  637   2HB   PHE  80          1HB       PHE  80   5.822   8.766   8.766
  638    HD1  PHE  80           HD1      PHE  80   5.439   5.270   5.270
  639    HD2  PHE  80           HD2      PHE  80   7.369   7.949   7.949
  640    HE1  PHE  80           HE1      PHE  80   6.221   3.361   3.361
  641    HE2  PHE  80           HE2      PHE  80   8.156   6.041   6.041
  642    HZ   PHE  80           HZ       PHE  80   7.581   3.744   3.744
  643    H    ALA  81           H        ALA  81   5.993   7.322   7.322
  644    HA   ALA  81           HA       ALA  81   4.899   8.126   8.126
  645   1HB   ALA  81          1HB       ALA  81   6.511  10.157  10.157
  646   2HB   ALA  81          3HB       ALA  81   4.965  10.946  10.946
  647   3HB   ALA  81          2HB       ALA  81   5.296  10.260  10.260
  648    H    CYS  82           H        CYS  82   3.437   7.180   7.180
  649    HA   CYS  82           HA       CYS  82   1.138   9.009   9.009
  650   1HB   CYS  82          2HB       CYS  82   1.926   6.683   6.683
  651   2HB   CYS  82          1HB       CYS  82   0.427   7.592   7.592
  652    HG   CYS  82           HG       CYS  82   2.326   9.678   9.678
  653    H    ASN  83           H        ASN  83  -0.981   8.165   8.165
  654    HA   ASN  83           HA       ASN  83  -1.137   6.214   6.214
  655   1HB   ASN  83          2HB       ASN  83  -2.814   8.284   8.284
  656   2HB   ASN  83          1HB       ASN  83  -3.733   6.788   6.788
  657   1HD2  ASN  83          2HD2      ASN  83  -2.027   7.987   7.987
  658   2HD2  ASN  83          1HD2      ASN  83  -1.097   7.902   7.902
  659    H    GLY  84           H        GLY  84  -0.997   4.110   4.110
  660   1HA   GLY  84          2HA       GLY  84  -2.277   3.109   3.109
  661   2HA   GLY  84          1HA       GLY  84  -0.874   2.368   2.368
  662    H    THR  85           H        THR  85  -3.719   1.479   1.479
  663    HA   THR  85           HA       THR  85  -4.225   0.204   0.204
  664    HB   THR  85           HB       THR  85  -6.657   0.359   0.359
  665    HG1  THR  85           HG1      THR  85  -5.881   2.032   2.032
  666   1HG2  THR  85          3HG2      THR  85  -5.365   2.170   2.170
  667   2HG2  THR  85          2HG2      THR  85  -5.587   3.144   3.144
  668   3HG2  THR  85          1HG2      THR  85  -6.991   2.546   2.546
  669    H    VAL  86           H        VAL  86  -5.595  -1.782  -1.782
  670    HA   VAL  86           HA       VAL  86  -5.123  -3.128  -3.128
  671    HB   VAL  86           HB       VAL  86  -3.530  -3.873  -3.873
  672   1HG1  VAL  86          3HG1      VAL  86  -5.451  -3.650  -3.650
  673   2HG1  VAL  86          2HG1      VAL  86  -5.730  -5.341  -5.341
  674   3HG1  VAL  86          1HG1      VAL  86  -4.157  -4.832  -4.832
  675   1HG2  VAL  86          3HG2      VAL  86  -5.418  -5.648  -5.648
  676   2HG2  VAL  86          2HG2      VAL  86  -3.664  -5.520  -5.520
  677   3HG2  VAL  86          1HG2      VAL  86  -4.389  -6.398  -6.398
  678    H    ILE  87           H        ILE  87  -6.871  -4.086  -4.086
  679    HA   ILE  87           HA       ILE  87  -9.074  -4.927  -4.927
  680    HB   ILE  87           HB       ILE  87 -10.776  -3.819  -3.819
  681   1HG1  ILE  87          2HG1      ILE  87  -9.273  -3.747  -3.747
  682   2HG1  ILE  87          1HG1      ILE  87 -10.375  -2.405  -2.405
  683   1HG2  ILE  87          1HG2      ILE  87  -8.660  -1.991  -1.991
  684   2HG2  ILE  87          3HG2      ILE  87 -10.265  -1.444  -1.444
  685   3HG2  ILE  87          2HG2      ILE  87 -10.090  -2.617  -2.617
  686   1HD1  ILE  87          1HD1      ILE  87  -8.519  -1.095  -1.095
  687   2HD1  ILE  87          3HD1      ILE  87  -7.425  -2.436  -2.436
  688   3HD1  ILE  87          2HD1      ILE  87  -8.227  -1.601  -1.601
  689    H    GLU  88           H        GLU  88 -10.689  -6.228  -6.228
  690    HA   GLU  88           HA       GLU  88  -9.426  -7.728  -7.728
  691   1HB   GLU  88          2HB       GLU  88 -10.241  -8.761  -8.761
  692   2HB   GLU  88          1HB       GLU  88 -11.785  -8.802  -8.802
  693   1HG   GLU  88          2HG       GLU  88 -10.733 -10.082 -10.082
  694   2HG   GLU  88          1HG       GLU  88  -9.224 -10.093 -10.093
  695    H    HIS  89           H        HIS  89 -10.171  -5.988  -5.988
  696    HA   HIS  89           HA       HIS  89 -12.796  -5.248  -5.248
  697   1HB   HIS  89          2HB       HIS  89 -10.473  -4.524  -4.524
  698   2HB   HIS  89          1HB       HIS  89 -11.053  -5.573  -5.573
  699    HD1  HIS  89           HD1      HIS  89 -12.590  -4.526  -4.526
  700    HD2  HIS  89           HD2      HIS  89 -12.411  -2.388  -2.388
  701    HE1  HIS  89           HE1      HIS  89 -13.971  -2.462  -2.462
  702    HE2  HIS  89           HE2      HIS  89 -13.778  -1.140  -1.140
  703    HA   PRO  90           HA       PRO  90 -14.595  -8.921  -8.921
  704   1HB   PRO  90          2HB       PRO  90 -16.970  -7.923  -7.923
  705   2HB   PRO  90          1HB       PRO  90 -16.527  -8.091  -8.091
  706   1HG   PRO  90          2HG       PRO  90 -16.495  -5.653  -5.653
  707   2HG   PRO  90          1HG       PRO  90 -17.035  -5.825  -5.825
  708   1HD   PRO  90          2HD       PRO  90 -14.576  -4.839  -4.839
  709   2HD   PRO  90          1HD       PRO  90 -14.916  -5.594  -5.594
  710    H    GLU  91           H        GLU  91 -13.964  -6.036  -6.036
  711    HA   GLU  91           HA       GLU  91 -14.812  -7.111  -7.111
  712   1HB   GLU  91          2HB       GLU  91 -14.260  -4.545  -4.545
  713   2HB   GLU  91          1HB       GLU  91 -13.115  -4.816  -4.816
  714   1HG   GLU  91          2HG       GLU  91 -16.037  -5.336  -5.336
  715   2HG   GLU  91          1HG       GLU  91 -15.365  -3.714  -3.714
  716    H    TYR  92           H        TYR  92 -11.962  -7.034  -7.034
  717    HA   TYR  92           HA       TYR  92 -10.445  -8.239  -8.239
  718   1HB   TYR  92          2HB       TYR  92  -9.070  -6.667  -6.667
  719   2HB   TYR  92          1HB       TYR  92  -8.534  -7.016  -7.016
  720    HD1  TYR  92           HD1      TYR  92 -10.580  -6.114  -6.114
  721    HD2  TYR  92           HD2      TYR  92  -9.318  -4.392  -4.392
  722    HE1  TYR  92           HE1      TYR  92 -11.427  -3.932  -3.932
  723    HE2  TYR  92           HE2      TYR  92 -10.160  -2.200  -2.200
  724    HH   TYR  92           HH       TYR  92 -12.263  -1.760  -1.760
  725    H    GLY  93           H        GLY  93 -10.445  -7.840  -7.840
  726   1HA   GLY  93          2HA       GLY  93 -10.635  -9.743  -9.743
  727   2HA   GLY  93          1HA       GLY  93  -9.869 -10.719 -10.719
  728    H    GLU  94           H        GLU  94  -9.405  -8.753  -8.753
  729    HA   GLU  94           HA       GLU  94  -7.601  -8.334  -8.334
  730   1HB   GLU  94          2HB       GLU  94  -7.254 -10.823 -10.823
  731   2HB   GLU  94          1HB       GLU  94  -6.040 -10.305 -10.305
  732   1HG   GLU  94          2HG       GLU  94  -4.628 -10.483 -10.483
  733   2HG   GLU  94          1HG       GLU  94  -5.282  -8.920  -8.920
  734    H    VAL  95           H        VAL  95  -7.367  -6.209  -6.209
  735    HA   VAL  95           HA       VAL  95  -4.922  -5.797  -5.797
  736    HB   VAL  95           HB       VAL  95  -6.001  -3.915  -3.915
  737   1HG1  VAL  95          3HG1      VAL  95  -6.468  -6.775  -6.775
  738   2HG1  VAL  95          2HG1      VAL  95  -7.568  -5.721  -5.721
  739   3HG1  VAL  95          1HG1      VAL  95  -5.827  -5.553  -5.553
  740   1HG2  VAL  95          1HG2      VAL  95  -8.064  -4.241  -4.241
  741   2HG2  VAL  95          3HG2      VAL  95  -8.149  -3.333  -3.333
  742   3HG2  VAL  95          2HG2      VAL  95  -8.695  -5.010  -5.010
  743    H    ILE  96           H        ILE  96  -3.723  -4.050  -4.050
  744    HA   ILE  96           HA       ILE  96  -4.415  -2.895  -2.895
  745    HB   ILE  96           HB       ILE  96  -2.037  -2.794  -2.794
  746   1HG1  ILE  96          2HG1      ILE  96  -2.736  -4.251  -4.251
  747   2HG1  ILE  96          1HG1      ILE  96  -1.087  -4.026  -4.026
  748   1HG2  ILE  96          1HG2      ILE  96  -2.529  -0.778  -0.778
  749   2HG2  ILE  96          3HG2      ILE  96  -0.969  -1.073  -1.073
  750   3HG2  ILE  96          2HG2      ILE  96  -2.315  -0.446  -0.446
  751   1HD1  ILE  96          2HD1      ILE  96  -2.365  -2.180  -2.180
  752   2HD1  ILE  96          1HD1      ILE  96  -1.510  -3.650  -3.650
  753   3HD1  ILE  96          3HD1      ILE  96  -0.654  -2.367  -2.367
  754    H    GLN  97           H        GLN  97  -4.480  -0.573  -0.573
  755    HA   GLN  97           HA       GLN  97  -5.380   1.004   1.004
  756   1HB   GLN  97          2HB       GLN  97  -6.998   0.092   0.092
  757   2HB   GLN  97          1HB       GLN  97  -6.790   1.821   1.821
  758   1HG   GLN  97          2HG       GLN  97  -7.466   2.061   2.061
  759   2HG   GLN  97          1HG       GLN  97  -7.978   0.376   0.376
  760   1HE2  GLN  97          2HE2      GLN  97 -11.057   1.203   1.203
  761   2HE2  GLN  97          1HE2      GLN  97 -10.052   0.147   0.147
  762    H    LEU  98           H        LEU  98  -3.753   2.433   2.433
  763    HA   LEU  98           HA       LEU  98  -2.625   3.685   3.685
  764   1HB   LEU  98          2HB       LEU  98  -1.891   4.054   4.054
  765   2HB   LEU  98          1HB       LEU  98  -1.010   4.689   4.689
  766    HG   LEU  98           HG       LEU  98  -1.413   1.732   1.732
  767   1HD1  LEU  98          1HD1      LEU  98   0.628   3.474   3.474
  768   2HD1  LEU  98          3HD1      LEU  98   0.889   1.755   1.755
  769   3HD1  LEU  98          2HD1      LEU  98  -0.449   2.280   2.280
  770   1HD2  LEU  98          2HD2      LEU  98   0.118   3.537   3.537
  771   2HD2  LEU  98          1HD2      LEU  98  -0.415   1.879   1.879
  772   3HD2  LEU  98          3HD2      LEU  98   1.054   2.190   2.190
  773    H    GLN  99           H        GLN  99  -2.476   6.018   6.018
  774    HA   GLN  99           HA       GLN  99  -4.928   7.268   7.268
  775   1HB   GLN  99          2HB       GLN  99  -3.108   7.680   7.680
  776   2HB   GLN  99          1HB       GLN  99  -3.758   9.155   9.155
  777   1HG   GLN  99          2HG       GLN  99  -5.554   6.874   6.874
  778   2HG   GLN  99          1HG       GLN  99  -5.024   8.033   8.033
  779   1HE2  GLN  99          2HE2      GLN  99  -6.953  10.704  10.704
  780   2HE2  GLN  99          1HE2      GLN  99  -5.533  10.279  10.279
  781    H    GLY 100           H        GLY 100  -5.016   8.920   8.920
  782   1HA   GLY 100          2HA       GLY 100  -4.287  10.642  10.642
  783   2HA   GLY 100          1HA       GLY 100  -2.687  10.490  10.490
  784    H    ASP 101           H        ASP 101  -2.927  10.934  10.934
  785    HA   ASP 101           HA       ASP 101  -3.008   8.589   8.589
  786   1HB   ASP 101          2HB       ASP 101  -1.845  10.005  10.005
  787   2HB   ASP 101          1HB       ASP 101  -3.322  10.712  10.712
  788    H    GLN 102           H        GLN 102  -1.720   6.980   6.980
  789    HA   GLN 102           HA       GLN 102   1.163   7.521   7.521
  790   1HB   GLN 102          2HB       GLN 102  -0.676   5.882   5.882
  791   2HB   GLN 102          1HB       GLN 102   0.760   5.001   5.001
  792   1HG   GLN 102          2HG       GLN 102   0.890   6.127   6.127
  793   2HG   GLN 102          1HG       GLN 102   2.193   6.509   6.509
  794   1HE2  GLN 102          2HE2      GLN 102  -0.637   9.435   9.435
  795   2HE2  GLN 102          1HE2      GLN 102  -1.072   7.798   7.798
  796    H    ARG 103           H        ARG 103  -0.922   6.502   6.502
  797    HA   ARG 103           HA       ARG 103  -0.209   4.020   4.020
  798   1HB   ARG 103          2HB       ARG 103  -1.116   4.592   4.592
  799   2HB   ARG 103          1HB       ARG 103  -1.868   5.761   5.761
  800   1HG   ARG 103          2HG       ARG 103   0.591   6.366   6.366
  801   2HG   ARG 103          1HG       ARG 103  -1.051   6.653   6.653
  802   1HD   ARG 103          2HD       ARG 103  -0.697   7.747   7.747
  803   2HD   ARG 103          1HD       ARG 103   0.542   8.359   8.359
  804    HE   ARG 103           HE       ARG 103  -2.139   8.457   8.457
  805   1HH1  ARG 103          2HH1      ARG 103   0.301  10.150  10.150
  806   2HH1  ARG 103          1HH1      ARG 103  -0.366  11.715  11.715
  807   1HH2  ARG 103          1HH2      ARG 103  -3.016  10.513  10.513
  808   2HH2  ARG 103          2HH2      ARG 103  -2.249  11.922  11.922
  809    H    LYS 104           H        LYS 104   1.681   6.940   6.940
  810    HA   LYS 104           HA       LYS 104   3.708   5.702   5.702
  811   1HB   LYS 104          2HB       LYS 104   2.871   8.375   8.375
  812   2HB   LYS 104          1HB       LYS 104   4.558   8.234   8.234
  813   1HG   LYS 104          2HG       LYS 104   3.502   7.352   7.352
  814   2HG   LYS 104          1HG       LYS 104   4.160   8.959   8.959
  815   1HD   LYS 104          2HD       LYS 104   5.661   6.386   6.386
  816   2HD   LYS 104          1HD       LYS 104   5.799   7.363   7.363
  817   1HE   LYS 104          2HE       LYS 104   6.193   9.207   9.207
  818   2HE   LYS 104          1HE       LYS 104   6.968   7.764   7.764
  819   1HZ   LYS 104          2HZ       LYS 104   8.073   7.624   7.624
  820   2HZ   LYS 104          1HZ       LYS 104   7.608   9.239   9.239
  821   3HZ   LYS 104          3HZ       LYS 104   8.637   8.796   8.796
  822    H    ASN 105           H        ASN 105   3.077   6.425   6.425
  823    HA   ASN 105           HA       ASN 105   5.840   6.076   6.076
  824   1HB   ASN 105          2HB       ASN 105   3.300   6.851   6.851
  825   2HB   ASN 105          1HB       ASN 105   4.479   6.024   6.024
  826   1HD2  ASN 105          2HD2      ASN 105   4.880   9.885   9.885
  827   2HD2  ASN 105          1HD2      ASN 105   3.445   8.961   8.961
  828    H    ILE 106           H        ILE 106   2.808   4.238   4.238
  829    HA   ILE 106           HA       ILE 106   3.774   2.128   2.128
  830    HB   ILE 106           HB       ILE 106   1.375   2.507   2.507
  831   1HG1  ILE 106          2HG1      ILE 106   0.767   0.143   0.143
  832   2HG1  ILE 106          1HG1      ILE 106   2.354  -0.250  -0.250
  833   1HG2  ILE 106          2HG2      ILE 106   1.669   2.945   2.945
  834   2HG2  ILE 106          1HG2      ILE 106   1.878   1.208   1.208
  835   3HG2  ILE 106          3HG2      ILE 106   0.354   1.840   1.840
  836   1HD1  ILE 106          3HD1      ILE 106   2.491   1.187   1.187
  837   2HD1  ILE 106          2HD1      ILE 106   1.628  -0.347  -0.347
  838   3HD1  ILE 106          1HD1      ILE 106   3.279  -0.308  -0.308
  839    H    CYS 107           H        CYS 107   3.550   2.395   2.395
  840    HA   CYS 107           HA       CYS 107   4.726  -0.080  -0.080
  841   1HB   CYS 107          2HB       CYS 107   5.388   1.026   1.026
  842   2HB   CYS 107          1HB       CYS 107   3.681   1.179   1.179
  843    HG   CYS 107           HG       CYS 107   5.509   3.454   3.454
  844    H    GLN 108           H        GLN 108   6.031   3.020   3.020
  845    HA   GLN 108           HA       GLN 108   8.775   2.414   2.414
  846   1HB   GLN 108          2HB       GLN 108   8.343   4.695   4.695
  847   2HB   GLN 108          1HB       GLN 108   7.234   4.590   4.590
  848   1HG   GLN 108          2HG       GLN 108   8.933   5.605   5.605
  849   2HG   GLN 108          1HG       GLN 108   9.492   3.948   3.948
  850   1HE2  GLN 108          2HE2      GLN 108  12.228   4.244   4.244
  851   2HE2  GLN 108          1HE2      GLN 108  11.135   3.159   3.159
  852    H    PHE 109           H        PHE 109   6.550   2.076   2.076
  853    HA   PHE 109           HA       PHE 109   8.526   1.442   1.442
  854   1HB   PHE 109          2HB       PHE 109   6.270   2.333   2.333
  855   2HB   PHE 109          1HB       PHE 109   5.566   0.818   0.818
  856    HD1  PHE 109           HD2      PHE 109   8.100   2.111   2.111
  857    HD2  PHE 109           HD1      PHE 109   5.192  -0.869  -0.869
  858    HE1  PHE 109           HE2      PHE 109   8.407   1.155   1.155
  859    HE2  PHE 109           HE1      PHE 109   5.493  -1.830  -1.830
  860    HZ   PHE 109           HZ       PHE 109   7.102  -0.818  -0.818
  861    H    LEU 110           H        LEU 110   6.338  -0.415  -0.415
  862    HA   LEU 110           HA       LEU 110   6.868  -2.966  -2.966
  863   1HB   LEU 110          2HB       LEU 110   5.888  -1.874  -1.874
  864   2HB   LEU 110          1HB       LEU 110   6.374  -3.557  -3.557
  865    HG   LEU 110           HG       LEU 110   4.639  -4.157  -4.157
  866   1HD1  LEU 110          3HD1      LEU 110   5.043  -2.417  -2.417
  867   2HD1  LEU 110          2HD1      LEU 110   4.216  -1.247  -1.247
  868   3HD1  LEU 110          1HD1      LEU 110   3.327  -2.613  -2.613
  869   1HD2  LEU 110          1HD2      LEU 110   3.808  -2.085  -2.085
  870   2HD2  LEU 110          3HD2      LEU 110   3.528  -3.825  -3.825
  871   3HD2  LEU 110          2HD2      LEU 110   2.602  -2.789  -2.789
  872    H    VAL 111           H        VAL 111   8.696  -0.914  -0.914
  873    HA   VAL 111           HA       VAL 111  10.549  -3.069  -3.069
  874    HB   VAL 111           HB       VAL 111  10.584  -0.179  -0.179
  875   1HG1  VAL 111          1HG1      VAL 111  12.308  -2.533  -2.533
  876   2HG1  VAL 111          3HG1      VAL 111  11.977  -1.399  -1.399
  877   3HG1  VAL 111          2HG1      VAL 111  12.739  -0.832  -0.832
  878   1HG2  VAL 111          2HG2      VAL 111   8.650  -1.854  -1.854
  879   2HG2  VAL 111          1HG2      VAL 111   9.343  -0.719  -0.719
  880   3HG2  VAL 111          3HG2      VAL 111   9.865  -2.404  -2.404
  881    H    GLU 112           H        GLU 112  10.317  -0.210  -0.210
  882    HA   GLU 112           HA       GLU 112  13.086   0.066   0.066
  883   1HB   GLU 112          2HB       GLU 112  10.570   1.075   1.075
  884   2HB   GLU 112          1HB       GLU 112  12.126   1.316   1.316
  885   1HG   GLU 112          2HG       GLU 112  12.123   2.076   2.076
  886   2HG   GLU 112          1HG       GLU 112  10.967   2.983   2.983
  887    H    ILE 113           H        ILE 113  10.452  -1.722  -1.722
  888    HA   ILE 113           HA       ILE 113  12.256  -2.724  -2.724
  889    HB   ILE 113           HB       ILE 113  10.353  -3.465  -3.465
  890   1HG1  ILE 113          2HG1      ILE 113   8.796  -2.997  -2.997
  891   2HG1  ILE 113          1HG1      ILE 113   9.102  -4.539  -4.539
  892   1HG2  ILE 113          3HG2      ILE 113  10.779  -0.940  -0.940
  893   2HG2  ILE 113          2HG2      ILE 113   9.312  -0.939  -0.939
  894   3HG2  ILE 113          1HG2      ILE 113   9.248  -1.466  -1.466
  895   1HD1  ILE 113          2HD1      ILE 113   7.809  -2.824  -2.824
  896   2HD1  ILE 113          1HD1      ILE 113   6.913  -2.799  -2.799
  897   3HD1  ILE 113          3HD1      ILE 113   7.232  -4.330  -4.330
  898    H    GLY 114           H        GLY 114  10.685  -3.676  -3.676
  899   1HA   GLY 114          2HA       GLY 114  11.289  -5.581  -5.581
  900   2HA   GLY 114          1HA       GLY 114  11.927  -6.316  -6.316
  901    H    LEU 115           H        LEU 115   8.796  -4.791  -4.791
  902    HA   LEU 115           HA       LEU 115   7.485  -7.121  -7.121
  903   1HB   LEU 115          2HB       LEU 115   6.953  -4.524  -4.524
  904   2HB   LEU 115          1HB       LEU 115   5.947  -4.861  -4.861
  905    HG   LEU 115           HG       LEU 115   4.631  -6.438  -6.438
  906   1HD1  LEU 115          2HD1      LEU 115   6.709  -6.079  -6.079
  907   2HD1  LEU 115          1HD1      LEU 115   5.105  -6.723  -6.723
  908   3HD1  LEU 115          3HD1      LEU 115   6.176  -7.568  -7.568
  909   1HD2  LEU 115          1HD2      LEU 115   4.391  -3.869  -3.869
  910   2HD2  LEU 115          3HD2      LEU 115   3.479  -4.968  -4.968
  911   3HD2  LEU 115          2HD2      LEU 115   4.948  -4.201  -4.201
  912    H    ALA 116           H        ALA 116   6.679  -5.225  -5.225
  913    HA   ALA 116           HA       ALA 116   5.663  -7.660  -7.660
  914   1HB   ALA 116          2HB       ALA 116   4.281  -5.596  -5.596
  915   2HB   ALA 116          1HB       ALA 116   5.483  -4.823  -4.823
  916   3HB   ALA 116          3HB       ALA 116   4.584  -6.221  -6.221
  917    H    LYS 117           H        LYS 117   5.977  -7.107  -7.107
  918    HA   LYS 117           HA       LYS 117   8.906  -7.124  -7.124
  919   1HB   LYS 117          2HB       LYS 117   6.781  -8.877  -8.877
  920   2HB   LYS 117          1HB       LYS 117   8.002  -8.389  -8.389
  921   1HG   LYS 117          2HG       LYS 117   8.797  -9.499  -9.499
  922   2HG   LYS 117          1HG       LYS 117   8.341 -10.566 -10.566
  923   1HD   LYS 117          2HD       LYS 117  10.503 -10.436 -10.436
  924   2HD   LYS 117          1HD       LYS 117  10.076  -8.848  -8.848
  925   1HE   LYS 117          2HE       LYS 117  11.541  -7.943  -7.943
  926   2HE   LYS 117          1HE       LYS 117  10.534  -8.483  -8.483
  927   1HZ   LYS 117          2HZ       LYS 117  12.419 -10.376 -10.376
  928   2HZ   LYS 117          1HZ       LYS 117  13.012  -9.204  -9.204
  929   3HZ   LYS 117          3HZ       LYS 117  11.841 -10.311 -10.311
  930    H    ASP 118           H        ASP 118   9.800  -5.953  -5.953
  931    HA   ASP 118           HA       ASP 118   8.576  -3.594  -3.594
  932   1HB   ASP 118          2HB       ASP 118  10.360  -3.328  -3.328
  933   2HB   ASP 118          1HB       ASP 118  11.008  -3.986  -3.986
  934    H    ASP 119           H        ASP 119   8.409  -6.748  -6.748
  935    HA   ASP 119           HA       ASP 119   7.199  -5.819  -5.819
  936   1HB   ASP 119          2HB       ASP 119   7.997  -8.425  -8.425
  937   2HB   ASP 119          1HB       ASP 119   6.620  -8.469  -8.469
  938    H    GLN 120           H        GLN 120   6.159  -6.797  -6.797
  939    HA   GLN 120           HA       GLN 120   3.407  -7.205  -7.205
  940   1HB   GLN 120          2HB       GLN 120   4.734  -7.071  -7.071
  941   2HB   GLN 120          1HB       GLN 120   3.035  -7.432  -7.432
  942   1HG   GLN 120          2HG       GLN 120   3.690  -9.419  -9.419
  943   2HG   GLN 120          1HG       GLN 120   5.378  -9.071  -9.071
  944   1HE2  GLN 120          2HE2      GLN 120   2.963 -10.031 -10.031
  945   2HE2  GLN 120          1HE2      GLN 120   2.400  -8.985  -8.985
  946    H    LEU 121           H        LEU 121   5.325  -4.524  -4.524
  947    HA   LEU 121           HA       LEU 121   3.791  -2.813  -2.813
  948   1HB   LEU 121          2HB       LEU 121   5.554  -2.263  -2.263
  949   2HB   LEU 121          1HB       LEU 121   4.812  -0.982  -0.982
  950    HG   LEU 121           HG       LEU 121   6.591  -3.058  -3.058
  951   1HD1  LEU 121          1HD1      LEU 121   7.782  -1.865  -1.865
  952   2HD1  LEU 121          3HD1      LEU 121   7.451  -0.348  -0.348
  953   3HD1  LEU 121          2HD1      LEU 121   8.455  -1.580  -1.580
  954   1HD2  LEU 121          1HD2      LEU 121   4.981  -0.962  -0.962
  955   2HD2  LEU 121          3HD2      LEU 121   6.106  -1.996  -1.996
  956   3HD2  LEU 121          2HD2      LEU 121   6.664  -0.470  -0.470
  957    H    LYS 122           H        LYS 122   1.591  -3.108  -3.108
  958    HA   LYS 122           HA       LYS 122   0.587  -2.198  -2.198
  959   1HB   LYS 122          2HB       LYS 122  -0.339  -4.219  -4.219
  960   2HB   LYS 122          1HB       LYS 122  -1.598  -3.257  -3.257
  961   1HG   LYS 122          2HG       LYS 122   0.517  -4.736  -4.736
  962   2HG   LYS 122          1HG       LYS 122  -1.063  -5.415  -5.415
  963   1HD   LYS 122          2HD       LYS 122  -2.127  -4.168  -4.168
  964   2HD   LYS 122          1HD       LYS 122  -1.127  -2.748  -2.748
  965   1HE   LYS 122          2HE       LYS 122   0.447  -3.346  -3.346
  966   2HE   LYS 122          1HE       LYS 122   0.160  -5.072  -5.072
  967   1HZ   LYS 122          3HZ       LYS 122  -2.001  -3.507  -3.507
  968   2HZ   LYS 122          2HZ       LYS 122  -0.632  -3.763  -3.763
  969   3HZ   LYS 122          1HZ       LYS 122  -1.491  -5.084  -5.084
  970    H    VAL 123           H        VAL 123   0.895   0.024   0.024
  971    HA   VAL 123           HA       VAL 123  -0.737   1.016   1.016
  972    HB   VAL 123           HB       VAL 123   1.561   1.885   1.885
  973   1HG1  VAL 123          2HG1      VAL 123   1.258   1.852   1.852
  974   2HG1  VAL 123          1HG1      VAL 123   0.612   3.477   3.477
  975   3HG1  VAL 123          3HG1      VAL 123   2.258   3.099   3.099
  976   1HG2  VAL 123          3HG2      VAL 123  -0.658   3.225   3.225
  977   2HG2  VAL 123          2HG2      VAL 123   0.978   3.878   3.878
  978   3HG2  VAL 123          1HG2      VAL 123  -0.059   4.287   4.287
  979    H    HIS 124           H        HIS 124  -2.783   1.568   1.568
  980    HA   HIS 124           HA       HIS 124  -3.539   2.659   2.659
  981   1HB   HIS 124          2HB       HIS 124  -5.321   1.036   1.036
  982   2HB   HIS 124          1HB       HIS 124  -5.698   1.598   1.598
  983    HD1  HIS 124           HD1      HIS 124  -5.084   0.083   0.083
  984    HD2  HIS 124           HD2      HIS 124  -3.255  -1.009  -1.009
  985    HE1  HIS 124           HE1      HIS 124  -3.957  -2.113  -2.113
  986    HE2  HIS 124           HE2      HIS 124  -2.995  -2.826  -2.826
  987    H    GLY 125           H        GLY 125  -3.066   4.764   4.764
  988   1HA   GLY 125          2HA       GLY 125  -4.425   5.774   5.774
  989   2HA   GLY 125          1HA       GLY 125  -3.653   6.738   6.738
  990    H    PHE 126           HN       PHE 126  -6.504   6.220   6.220
  991    HA   PHE 126           HA       PHE 126  -8.484   5.960   5.960
  992   1HB   PHE 126          2HB       PHE 126  -9.949   6.989   6.989
  993   2HB   PHE 126          1HB       PHE 126  -8.675   6.319   6.319
  994    HD1  PHE 126           HD1      PHE 126  -6.558   8.360   8.360
  995    HD2  PHE 126           HD2      PHE 126 -10.754   8.780   8.780
  996    HE1  PHE 126           HE1      PHE 126  -6.194  10.578  10.578
  997    HE2  PHE 126           HE2      PHE 126 -10.396  11.000  11.000
  998    HZ   PHE 126           HZ       PHE 126  -8.114  11.903  11.903

  Start of MODEL    7
    1   1H    MET   1          1H        MET   1  43.393  20.360  20.360
    2   2H    MET   1          3H        MET   1  41.830  19.795  19.795
    3   3H    MET   1          2H        MET   1  43.123  19.648  19.648
    4    HA   MET   1           HA       MET   1  44.241  18.134  18.134
    5   1HB   MET   1          2HB       MET   1  41.556  17.735  17.735
    6   2HB   MET   1          1HB       MET   1  41.996  16.535  16.535
    7   1HG   MET   1          2HG       MET   1  42.626  15.656  15.656
    8   2HG   MET   1          1HG       MET   1  44.112  16.158  16.158
    9   1HE   MET   1          3HE       MET   1  42.317  16.047  16.047
   10   2HE   MET   1          2HE       MET   1  43.999  15.526  15.526
   11   3HE   MET   1          1HE       MET   1  43.552  16.865  16.865
   12    H    ARG   2           H        ARG   2  44.783  18.626  18.626
   13    HA   ARG   2           HA       ARG   2  44.691  18.602  18.602
   14   1HB   ARG   2          2HB       ARG   2  42.948  16.467  16.467
   15   2HB   ARG   2          1HB       ARG   2  42.375  17.152  17.152
   16   1HG   ARG   2          2HG       ARG   2  44.660  16.826  16.826
   17   2HG   ARG   2          1HG       ARG   2  45.090  15.982  15.982
   18   1HD   ARG   2          2HD       ARG   2  43.528  14.253  14.253
   19   2HD   ARG   2          1HD       ARG   2  42.757  15.169  15.169
   20    HE   ARG   2           HE       ARG   2  44.379  14.440  14.440
   21   1HH1  ARG   2          2HH1      ARG   2  45.405  13.804  13.804
   22   2HH1  ARG   2          1HH1      ARG   2  46.775  12.860  12.860
   23   1HH2  ARG   2          1HH2      ARG   2  46.181  13.197  13.197
   24   2HH2  ARG   2          2HH2      ARG   2  47.216  12.516  12.516
   25    H    GLY   3           H        GLY   3  44.228  20.489  20.489
   26   1HA   GLY   3          2HA       GLY   3  41.805  21.915  21.915
   27   2HA   GLY   3          1HA       GLY   3  43.057  22.370  22.370
   28    H    SER   4           H        SER   4  39.962  20.989  20.989
   29    HA   SER   4           HA       SER   4  39.418  21.104  21.104
   30   1HB   SER   4          2HB       SER   4  40.513  18.988  18.988
   31   2HB   SER   4          1HB       SER   4  39.698  18.392  18.392
   32    HG   SER   4           HG       SER   4  37.899  18.066  18.066
   33    H    HIS   5           H        HIS   5  38.132  18.936  18.936
   34    HA   HIS   5           HA       HIS   5  35.729  20.609  20.609
   35   1HB   HIS   5          2HB       HIS   5  34.295  18.601  18.601
   36   2HB   HIS   5          1HB       HIS   5  35.198  18.865  18.865
   37    HD1  HIS   5           HD1      HIS   5  34.671  16.254  16.254
   38    HD2  HIS   5           HD2      HIS   5  37.331  17.172  17.172
   39    HE1  HIS   5           HE1      HIS   5  35.872  14.105  14.105
   40    HE2  HIS   5           HE2      HIS   5  37.414  14.666  14.666
   41    H    HIS   6           H        HIS   6  34.207  19.368  19.368
   42    HA   HIS   6           HA       HIS   6  35.912  19.114  19.114
   43   1HB   HIS   6          2HB       HIS   6  32.932  19.602  19.602
   44   2HB   HIS   6          1HB       HIS   6  34.017  19.792  19.792
   45    HD1  HIS   6           HD1      HIS   6  33.215  21.395  21.395
   46    HD2  HIS   6           HD2      HIS   6  35.176  22.267  22.267
   47    HE1  HIS   6           HE1      HIS   6  33.782  23.842  23.842
   48    HE2  HIS   6           HE2      HIS   6  34.905  24.363  24.363
   49    H    HIS   7           H        HIS   7  35.431  17.503  17.503
   50    HA   HIS   7           HA       HIS   7  33.534  15.443  15.443
   51   1HB   HIS   7          2HB       HIS   7  35.035  13.603  13.603
   52   2HB   HIS   7          1HB       HIS   7  35.096  14.842  14.842
   53    HD1  HIS   7           HD1      HIS   7  37.119  13.531  13.531
   54    HD2  HIS   7           HD2      HIS   7  37.589  15.879  15.879
   55    HE1  HIS   7           HE1      HIS   7  39.593  13.937  13.937
   56    HE2  HIS   7           HE2      HIS   7  39.860  15.287  15.287
   57    H    HIS   8           H        HIS   8  36.656  16.303  16.303
   58    HA   HIS   8           HA       HIS   8  36.697  14.508  14.508
   59   1HB   HIS   8          2HB       HIS   8  38.580  15.998  15.998
   60   2HB   HIS   8          1HB       HIS   8  37.705  17.361  17.361
   61    HD1  HIS   8           HD1      HIS   8  39.296  14.094  14.094
   62    HD2  HIS   8           HD2      HIS   8  38.070  17.719  17.719
   63    HE1  HIS   8           HE1      HIS   8  40.118  14.081  14.081
   64    HE2  HIS   8           HE2      HIS   8  39.282  16.243  16.243
   65    H    HIS   9           H        HIS   9  34.866  14.172  14.172
   66    HA   HIS   9           HA       HIS   9  34.153  15.973  15.973
   67   1HB   HIS   9          2HB       HIS   9  33.100  17.082  17.082
   68   2HB   HIS   9          1HB       HIS   9  32.004  15.705  15.705
   69    HD1  HIS   9           HD1      HIS   9  33.099  17.461  17.461
   70    HD2  HIS   9           HD2      HIS   9  29.712  16.975  16.975
   71    HE1  HIS   9           HE1      HIS   9  31.215  18.487  18.487
   72    HE2  HIS   9           HE2      HIS   9  29.161  18.103  18.103
   73    H    HIS  10           H        HIS  10  34.629  13.862  13.862
   74    HA   HIS  10           HA       HIS  10  33.984  11.967  11.967
   75   1HB   HIS  10          2HB       HIS  10  31.562  13.512  13.512
   76   2HB   HIS  10          1HB       HIS  10  31.206  11.789  11.789
   77    HD1  HIS  10           HD1      HIS  10  32.995  14.258  14.258
   78    HD2  HIS  10           HD2      HIS  10  31.026  10.603  10.603
   79    HE1  HIS  10           HE1      HIS  10  32.857  13.680  13.680
   80    HE2  HIS  10           HE2      HIS  10  31.746  11.420  11.420
   81    H    THR  11           H        THR  11  34.631  10.156  10.156
   82    HA   THR  11           HA       THR  11  33.988   9.436   9.436
   83    HB   THR  11           HB       THR  11  34.859   7.102   7.102
   84    HG1  THR  11           HG1      THR  11  35.356   7.333   7.333
   85   1HG2  THR  11          3HG2      THR  11  36.412   9.548   9.548
   86   2HG2  THR  11          2HG2      THR  11  37.235   8.084   8.084
   87   3HG2  THR  11          1HG2      THR  11  36.211   8.044   8.044
   88    H    ASP  12           H        ASP  12  33.018   7.937   7.937
   89    HA   ASP  12           HA       ASP  12  31.200   6.703   6.703
   90   1HB   ASP  12          2HB       ASP  12  30.146   8.540   8.540
   91   2HB   ASP  12          1HB       ASP  12  29.125   7.189   7.189
   92    HA   PRO  13           HA       PRO  13  32.201   3.381   3.381
   93   1HB   PRO  13          2HB       PRO  13  31.773   1.376   1.376
   94   2HB   PRO  13          1HB       PRO  13  33.314   2.213   2.213
   95   1HG   PRO  13          2HG       PRO  13  31.167   2.663   2.663
   96   2HG   PRO  13          1HG       PRO  13  32.929   2.653   2.653
   97   1HD   PRO  13          2HD       PRO  13  31.527   4.944   4.944
   98   2HD   PRO  13          1HD       PRO  13  33.164   4.806   4.806
   99    H    MET  14           H        MET  14  29.409   4.017   4.017
  100    HA   MET  14           HA       MET  14  27.715   1.940   1.940
  101   1HB   MET  14          2HB       MET  14  26.913   4.814   4.814
  102   2HB   MET  14          1HB       MET  14  25.881   3.397   3.397
  103   1HG   MET  14          2HG       MET  14  27.756   2.688   2.688
  104   2HG   MET  14          1HG       MET  14  27.950   4.437   4.437
  105   1HE   MET  14          3HE       MET  14  27.260   5.040   5.040
  106   2HE   MET  14          2HE       MET  14  26.228   6.049   6.049
  107   3HE   MET  14          1HE       MET  14  25.559   5.259   5.259
  108    H    SER  15           H        SER  15  28.777   4.742   4.742
  109    HA   SER  15           HA       SER  15  26.772   4.900   4.900
  110   1HB   SER  15          2HB       SER  15  28.834   6.449   6.449
  111   2HB   SER  15          1HB       SER  15  29.642   5.421   5.421
  112    HG   SER  15           HG       SER  15  28.617   6.454   6.454
  113    H    ALA  16           H        ALA  16  29.592   2.819   2.819
  114    HA   ALA  16           HA       ALA  16  28.628   1.339   1.339
  115   1HB   ALA  16          1HB       ALA  16  30.727   2.612   2.612
  116   2HB   ALA  16          3HB       ALA  16  31.522   1.632   1.632
  117   3HB   ALA  16          2HB       ALA  16  30.878   0.869   0.869
  118    H    ILE  17           H        ILE  17  27.469  -0.095  -0.095
  119    HA   ILE  17           HA       ILE  17  29.109  -1.809  -1.809
  120    HB   ILE  17           HB       ILE  17  26.102  -1.568  -1.568
  121   1HG1  ILE  17          2HG1      ILE  17  28.009  -0.363  -0.363
  122   2HG1  ILE  17          1HG1      ILE  17  27.371   0.544   0.544
  123   1HG2  ILE  17          3HG2      ILE  17  28.100  -3.038  -3.038
  124   2HG2  ILE  17          2HG2      ILE  17  26.565  -2.531  -2.531
  125   3HG2  ILE  17          1HG2      ILE  17  26.581  -3.607  -3.607
  126   1HD1  ILE  17          3HD1      ILE  17  25.442  -0.838  -0.838
  127   2HD1  ILE  17          2HD1      ILE  17  26.235   0.619   0.619
  128   3HD1  ILE  17          1HD1      ILE  17  25.282   0.676   0.676
  129    H    GLN  18           H        GLN  18  29.059  -4.025  -4.025
  130    HA   GLN  18           HA       GLN  18  27.330  -5.270  -5.270
  131   1HB   GLN  18          2HB       GLN  18  29.233  -6.239  -6.239
  132   2HB   GLN  18          1HB       GLN  18  29.056  -4.502  -4.502
  133   1HG   GLN  18          2HG       GLN  18  30.796  -4.514  -4.514
  134   2HG   GLN  18          1HG       GLN  18  31.214  -6.057  -6.057
  135   1HE2  GLN  18          2HE2      GLN  18  32.491  -2.631  -2.631
  136   2HE2  GLN  18          1HE2      GLN  18  31.709  -2.759  -2.759
  137    H    ASN  19           H        ASN  19  28.253  -7.693  -7.693
  138    HA   ASN  19           HA       ASN  19  28.488  -9.718  -9.718
  139   1HB   ASN  19          2HB       ASN  19  30.159  -8.229  -8.229
  140   2HB   ASN  19          1HB       ASN  19  30.207  -9.955  -9.955
  141   1HD2  ASN  19          2HD2      ASN  19  32.756  -7.670  -7.670
  142   2HD2  ASN  19          1HD2      ASN  19  32.014  -7.408  -7.408
  143    H    LEU  20           H        LEU  20  26.233  -8.092  -8.092
  144    HA   LEU  20           HA       LEU  20  25.448  -9.473  -9.473
  145   1HB   LEU  20          2HB       LEU  20  26.438  -7.380  -7.380
  146   2HB   LEU  20          1HB       LEU  20  25.343  -6.459  -6.459
  147    HG   LEU  20           HG       LEU  20  24.758  -6.646  -6.646
  148   1HD1  LEU  20          2HD1      LEU  20  23.221  -6.226  -6.226
  149   2HD1  LEU  20          1HD1      LEU  20  22.466  -7.704  -7.704
  150   3HD1  LEU  20          3HD1      LEU  20  22.579  -6.290  -6.290
  151   1HD2  LEU  20          3HD2      LEU  20  24.052  -9.443  -9.443
  152   2HD2  LEU  20          2HD2      LEU  20  25.224  -8.979  -8.979
  153   3HD2  LEU  20          1HD2      LEU  20  23.504  -8.691  -8.691
  154    H    HIS  21           H        HIS  21  24.360  -6.789  -6.789
  155    HA   HIS  21           HA       HIS  21  21.947  -8.350  -8.350
  156   1HB   HIS  21          2HB       HIS  21  21.427  -6.663  -6.663
  157   2HB   HIS  21          1HB       HIS  21  21.952  -5.394  -5.394
  158    HD1  HIS  21           HD1      HIS  21  20.150  -7.967  -7.967
  159    HD2  HIS  21           HD2      HIS  21  19.144  -4.591  -4.591
  160    HE1  HIS  21           HE1      HIS  21  17.782  -7.423  -7.423
  161    HE2  HIS  21           HE2      HIS  21  17.226  -5.325  -5.325
  162    H    SER  22           H        SER  22  23.514  -8.692  -8.692
  163    HA   SER  22           HA       SER  22  22.672  -6.967  -6.967
  164   1HB   SER  22          2HB       SER  22  24.577  -5.683  -5.683
  165   2HB   SER  22          1HB       SER  22  25.556  -7.120  -7.120
  166    HG   SER  22           HG       SER  22  25.237  -5.758  -5.758
  167    H    PHE  23           H        PHE  23  22.208  -8.218  -8.218
  168    HA   PHE  23           HA       PHE  23  23.396 -10.901 -10.901
  169   1HB   PHE  23          2HB       PHE  23  21.492 -11.499 -11.499
  170   2HB   PHE  23          1HB       PHE  23  20.943 -10.810 -10.810
  171    HD1  PHE  23           HD2      PHE  23  20.037  -8.515  -8.515
  172    HD2  PHE  23           HD1      PHE  23  21.027 -10.446 -10.446
  173    HE1  PHE  23           HE2      PHE  23  18.688  -6.866  -6.866
  174    HE2  PHE  23           HE1      PHE  23  19.681  -8.800  -8.800
  175    HZ   PHE  23           HZ       PHE  23  18.508  -7.008  -7.008
  176    H    ASP  24           H        ASP  24  24.884 -11.324 -11.324
  177    HA   ASP  24           HA       ASP  24  25.979  -9.514  -9.514
  178   1HB   ASP  24          2HB       ASP  24  26.796 -11.614 -11.614
  179   2HB   ASP  24          1HB       ASP  24  27.264 -11.425 -11.425
  180    HA   PRO  25           HA       PRO  25  22.479  -9.330  -9.330
  181   1HB   PRO  25          2HB       PRO  25  24.094  -7.153  -7.153
  182   2HB   PRO  25          1HB       PRO  25  22.434  -7.123  -7.123
  183   1HG   PRO  25          2HG       PRO  25  24.427  -5.937  -5.937
  184   2HG   PRO  25          1HG       PRO  25  23.094  -6.749  -6.749
  185   1HD   PRO  25          2HD       PRO  25  25.879  -7.727  -7.727
  186   2HD   PRO  25          1HD       PRO  25  24.900  -7.857  -7.857
  187    H    PHE  26           H        PHE  26  25.843  -9.839  -9.839
  188    HA   PHE  26           HA       PHE  26  25.364 -10.495 -10.495
  189   1HB   PHE  26          2HB       PHE  26  28.129 -10.750 -10.750
  190   2HB   PHE  26          1HB       PHE  26  27.365  -9.586  -9.586
  191    HD1  PHE  26           HD2      PHE  26  26.241  -7.541  -7.541
  192    HD2  PHE  26           HD1      PHE  26  29.283  -9.982  -9.982
  193    HE1  PHE  26           HE2      PHE  26  26.824  -5.724  -5.724
  194    HE2  PHE  26           HE1      PHE  26  29.872  -8.172  -8.172
  195    HZ   PHE  26           HZ       PHE  26  28.642  -6.038  -6.038
  196    H    ALA  27           H        ALA  27  24.606 -12.159 -12.159
  197    HA   ALA  27           HA       ALA  27  25.672 -14.645 -14.645
  198   1HB   ALA  27          3HB       ALA  27  27.148 -13.615 -13.615
  199   2HB   ALA  27          2HB       ALA  27  25.901 -14.357 -14.357
  200   3HB   ALA  27          1HB       ALA  27  26.839 -15.349 -15.349
  201    H    ASP  28           H        ASP  28  24.782 -15.948 -15.948
  202    HA   ASP  28           HA       ASP  28  22.060 -16.359 -16.359
  203   1HB   ASP  28          2HB       ASP  28  23.743 -17.378 -17.378
  204   2HB   ASP  28          1HB       ASP  28  22.041 -17.797 -17.797
  205    H    ALA  29           H        ALA  29  20.416 -16.468 -16.468
  206    HA   ALA  29           HA       ALA  29  20.599 -14.515 -14.515
  207   1HB   ALA  29          2HB       ALA  29  19.144 -13.704 -13.704
  208   2HB   ALA  29          1HB       ALA  29  18.864 -12.946 -12.946
  209   3HB   ALA  29          3HB       ALA  29  20.458 -12.858 -12.858
  210    H    SER  30           H        SER  30  18.555 -14.240 -14.240
  211    HA   SER  30           HA       SER  30  17.182 -16.700 -16.700
  212   1HB   SER  30          2HB       SER  30  17.538 -15.127 -15.127
  213   2HB   SER  30          1HB       SER  30  16.424 -13.990 -13.990
  214    HG   SER  30           HG       SER  30  14.756 -15.290 -15.290
  215    H    LYS  31           H        LYS  31  15.067 -17.267 -17.267
  216    HA   LYS  31           HA       LYS  31  13.312 -15.451 -15.451
  217   1HB   LYS  31          2HB       LYS  31  13.172 -16.905 -16.905
  218   2HB   LYS  31          1HB       LYS  31  14.635 -15.943 -15.943
  219   1HG   LYS  31          2HG       LYS  31  15.926 -17.825 -17.825
  220   2HG   LYS  31          1HG       LYS  31  14.490 -18.820 -18.820
  221   1HD   LYS  31          2HD       LYS  31  15.503 -19.431 -19.431
  222   2HD   LYS  31          1HD       LYS  31  13.987 -18.589 -18.589
  223   1HE   LYS  31          2HE       LYS  31  15.266 -16.511 -16.511
  224   2HE   LYS  31          1HE       LYS  31  16.761 -17.411 -17.411
  225   1HZ   LYS  31          2HZ       LYS  31  14.889 -18.418 -18.418
  226   2HZ   LYS  31          1HZ       LYS  31  15.758 -17.018 -17.018
  227   3HZ   LYS  31          3HZ       LYS  31  16.580 -18.446 -18.446
  228    H    GLY  32           H        GLY  32  11.525 -15.920 -15.920
  229   1HA   GLY  32          2HA       GLY  32   9.596 -17.436 -17.436
  230   2HA   GLY  32          1HA       GLY  32  10.733 -18.762 -18.762
  231    H    ASP  33           H        ASP  33  10.883 -19.571 -19.571
  232    HA   ASP  33           HA       ASP  33  10.753 -19.806 -19.806
  233   1HB   ASP  33          2HB       ASP  33  12.518 -18.040 -18.040
  234   2HB   ASP  33          1HB       ASP  33  11.257 -16.824 -16.824
  235    H    ASP  34           H        ASP  34   8.738 -20.358 -20.358
  236    HA   ASP  34           HA       ASP  34   6.644 -18.313 -18.313
  237   1HB   ASP  34          2HB       ASP  34   6.710 -21.182 -21.182
  238   2HB   ASP  34          1HB       ASP  34   5.499 -20.748 -20.748
  239    H    LEU  35           H        LEU  35   8.702 -18.208 -18.208
  240    HA   LEU  35           HA       LEU  35   7.149 -18.847 -18.847
  241   1HB   LEU  35          2HB       LEU  35  10.138 -18.763 -18.763
  242   2HB   LEU  35          1HB       LEU  35   9.368 -18.875 -18.875
  243    HG   LEU  35           HG       LEU  35   8.872 -20.917 -20.917
  244   1HD1  LEU  35          3HD1      LEU  35  11.223 -20.567 -20.567
  245   2HD1  LEU  35          2HD1      LEU  35  10.558 -22.196 -22.196
  246   3HD1  LEU  35          1HD1      LEU  35  11.084 -21.348 -21.348
  247   1HD2  LEU  35          1HD2      LEU  35   7.518 -20.516 -20.516
  248   2HD2  LEU  35          3HD2      LEU  35   7.809 -22.126 -22.126
  249   3HD2  LEU  35          2HD2      LEU  35   8.827 -21.510 -21.510
  250    H    LEU  36           H        LEU  36   6.185 -17.002 -17.002
  251    HA   LEU  36           HA       LEU  36   7.656 -14.479 -14.479
  252   1HB   LEU  36          2HB       LEU  36   4.815 -15.256 -15.256
  253   2HB   LEU  36          1HB       LEU  36   5.195 -13.789 -13.789
  254    HG   LEU  36           HG       LEU  36   6.248 -12.868 -12.868
  255   1HD1  LEU  36          1HD1      LEU  36   5.359 -15.506 -15.506
  256   2HD1  LEU  36          3HD1      LEU  36   5.495 -14.089 -14.089
  257   3HD1  LEU  36          2HD1      LEU  36   6.911 -14.687 -14.687
  258   1HD2  LEU  36          3HD2      LEU  36   3.367 -13.735 -13.735
  259   2HD2  LEU  36          2HD2      LEU  36   3.998 -12.227 -12.227
  260   3HD2  LEU  36          1HD2      LEU  36   4.105 -12.542 -12.542
  261    HA   PRO  37           HA       PRO  37   8.697 -14.023 -14.023
  262   1HB   PRO  37          2HB       PRO  37   7.253 -11.417 -11.417
  263   2HB   PRO  37          1HB       PRO  37   8.903 -11.775 -11.775
  264   1HG   PRO  37          2HG       PRO  37   8.448 -10.609 -10.609
  265   2HG   PRO  37          1HG       PRO  37   9.718 -11.835 -11.835
  266   1HD   PRO  37          2HD       PRO  37   7.016 -12.068 -12.068
  267   2HD   PRO  37          1HD       PRO  37   8.546 -12.836 -12.836
  268    H    ALA  38           H        ALA  38   7.814 -14.633 -14.633
  269    HA   ALA  38           HA       ALA  38   5.280 -13.872 -13.872
  270   1HB   ALA  38          2HB       ALA  38   5.378 -16.334 -16.334
  271   2HB   ALA  38          1HB       ALA  38   4.413 -16.381 -16.381
  272   3HB   ALA  38          3HB       ALA  38   4.069 -15.177 -15.177
  273    H    GLY  39           H        GLY  39   4.698 -14.967 -14.967
  274   1HA   GLY  39          2HA       GLY  39   5.597 -16.903 -16.903
  275   2HA   GLY  39          1HA       GLY  39   7.107 -16.013 -16.013
  276    H    THR  40           H        THR  40   5.636 -13.421 -13.421
  277    HA   THR  40           HA       THR  40   4.937 -13.402 -13.402
  278    HB   THR  40           HB       THR  40   5.888 -10.840 -10.840
  279    HG1  THR  40           HG1      THR  40   7.614 -13.070 -13.070
  280   1HG2  THR  40          3HG2      THR  40   6.714 -12.711 -12.711
  281   2HG2  THR  40          2HG2      THR  40   7.567 -11.203 -11.203
  282   3HG2  THR  40          1HG2      THR  40   5.865 -11.171 -11.171
  283    H    GLU  41           H        GLU  41   3.142 -13.709 -13.709
  284    HA   GLU  41           HA       GLU  41   1.862 -11.379 -11.379
  285   1HB   GLU  41          2HB       GLU  41   1.170 -14.231 -14.231
  286   2HB   GLU  41          1HB       GLU  41  -0.214 -13.148 -13.148
  287   1HG   GLU  41          2HG       GLU  41   0.721 -12.048 -12.048
  288   2HG   GLU  41          1HG       GLU  41   1.863 -13.387 -13.387
  289    H    ASP  42           H        ASP  42   1.644 -13.146 -13.146
  290    HA   ASP  42           HA       ASP  42  -0.682 -11.854 -11.854
  291   1HB   ASP  42          2HB       ASP  42   1.484 -13.547 -13.547
  292   2HB   ASP  42          1HB       ASP  42   0.489 -12.607 -12.607
  293    H    TYR  43           H        TYR  43   0.069  -9.681  -9.681
  294    HA   TYR  43           HA       TYR  43   2.156  -8.315  -8.315
  295   1HB   TYR  43          2HB       TYR  43  -0.221  -7.021  -7.021
  296   2HB   TYR  43          1HB       TYR  43   1.400  -6.363  -6.363
  297    HD1  TYR  43           HD1      TYR  43   2.985  -8.770  -8.770
  298    HD2  TYR  43           HD2      TYR  43  -0.487  -6.937  -6.937
  299    HE1  TYR  43           HE1      TYR  43   3.590  -9.623  -9.623
  300    HE2  TYR  43           HE2      TYR  43   0.109  -7.786  -7.786
  301    HH   TYR  43           HH       TYR  43   3.146  -9.037  -9.037
  302    H    ILE  44           H        ILE  44   1.636  -6.166  -6.166
  303    HA   ILE  44           HA       ILE  44  -0.326  -6.727  -6.727
  304    HB   ILE  44           HB       ILE  44   2.147  -4.989  -4.989
  305   1HG1  ILE  44          2HG1      ILE  44   2.861  -7.249  -7.249
  306   2HG1  ILE  44          1HG1      ILE  44   2.867  -6.730  -6.730
  307   1HG2  ILE  44          3HG2      ILE  44   0.114  -4.330  -4.330
  308   2HG2  ILE  44          2HG2      ILE  44   0.459  -5.791  -5.791
  309   3HG2  ILE  44          1HG2      ILE  44   1.666  -4.510  -4.510
  310   1HD1  ILE  44          1HD1      ILE  44   0.568  -7.782  -7.782
  311   2HD1  ILE  44          3HD1      ILE  44   0.919  -8.537  -8.537
  312   3HD1  ILE  44          2HD1      ILE  44   1.942  -8.875  -8.875
  313    H    HIS  45           H        HIS  45  -2.154  -5.733  -5.733
  314    HA   HIS  45           HA       HIS  45  -2.137  -3.190  -3.190
  315   1HB   HIS  45          2HB       HIS  45  -3.953  -5.326  -5.326
  316   2HB   HIS  45          1HB       HIS  45  -4.738  -3.904  -3.904
  317    HD1  HIS  45           HD1      HIS  45  -3.453  -5.319  -5.319
  318    HD2  HIS  45           HD2      HIS  45  -5.418  -1.923  -1.923
  319    HE1  HIS  45           HE1      HIS  45  -4.265  -4.141  -4.141
  320    HE2  HIS  45           HE2      HIS  45  -5.381  -2.044  -2.044
  321    H    ILE  46           H        ILE  46  -1.893  -1.324  -1.324
  322    HA   ILE  46           HA       ILE  46  -2.149  -0.983  -0.983
  323    HB   ILE  46           HB       ILE  46  -1.896   1.153   1.153
  324   1HG1  ILE  46          2HG1      ILE  46  -0.078  -0.515  -0.515
  325   2HG1  ILE  46          1HG1      ILE  46   0.499   1.064   1.064
  326   1HG2  ILE  46          3HG2      ILE  46  -1.363   1.217   1.217
  327   2HG2  ILE  46          2HG2      ILE  46  -0.972   2.512   2.512
  328   3HG2  ILE  46          1HG2      ILE  46  -2.654   2.060   2.060
  329   1HD1  ILE  46          1HD1      ILE  46   0.151   0.096   0.096
  330   2HD1  ILE  46          3HD1      ILE  46   0.208  -1.460  -1.460
  331   3HD1  ILE  46          2HD1      ILE  46   1.577  -0.351  -0.351
  332    H    ARG  47           H        ARG  47  -3.671   1.443   1.443
  333    HA   ARG  47           HA       ARG  47  -5.878   1.993   1.993
  334   1HB   ARG  47          2HB       ARG  47  -6.355  -0.493  -0.493
  335   2HB   ARG  47          1HB       ARG  47  -6.779   0.109   0.109
  336   1HG   ARG  47          2HG       ARG  47  -8.795   0.658   0.658
  337   2HG   ARG  47          1HG       ARG  47  -8.087   1.729   1.729
  338   1HD   ARG  47          2HD       ARG  47  -7.901  -0.111  -0.111
  339   2HD   ARG  47          1HD       ARG  47  -8.494  -1.240  -1.240
  340    HE   ARG  47           HE       ARG  47 -10.621  -0.589  -0.589
  341   1HH1  ARG  47          2HH1      ARG  47  -8.415   1.847   1.847
  342   2HH1  ARG  47          1HH1      ARG  47  -9.650   2.754   2.754
  343   1HH2  ARG  47          1HH2      ARG  47 -12.247   0.604   0.604
  344   2HH2  ARG  47          2HH2      ARG  47 -11.826   2.050   2.050
  345    H    ILE  48           H        ILE  48  -6.358   3.926   3.926
  346    HA   ILE  48           HA       ILE  48  -6.080   4.554   4.554
  347    HB   ILE  48           HB       ILE  48  -5.989   6.288   6.288
  348   1HG1  ILE  48          2HG1      ILE  48  -4.097   5.809   5.809
  349   2HG1  ILE  48          1HG1      ILE  48  -3.867   5.353   5.353
  350   1HG2  ILE  48          3HG2      ILE  48  -6.306   7.219   7.219
  351   2HG2  ILE  48          2HG2      ILE  48  -5.857   8.256   8.256
  352   3HG2  ILE  48          1HG2      ILE  48  -7.435   7.471   7.471
  353   1HD1  ILE  48          2HD1      ILE  48  -4.028   8.178   8.178
  354   2HD1  ILE  48          1HD1      ILE  48  -2.539   7.309   7.309
  355   3HD1  ILE  48          3HD1      ILE  48  -3.696   7.676   7.676
  356    H    GLN  49           H        GLN  49  -7.713   5.978   5.978
  357    HA   GLN  49           HA       GLN  49 -10.284   6.049   6.049
  358   1HB   GLN  49          2HB       GLN  49 -11.466   5.158   5.158
  359   2HB   GLN  49          1HB       GLN  49 -10.392   3.975   3.975
  360   1HG   GLN  49          2HG       GLN  49  -8.780   5.137   5.137
  361   2HG   GLN  49          1HG       GLN  49 -10.355   5.152   5.152
  362   1HE2  GLN  49          2HE2      GLN  49 -10.191   1.829   1.829
  363   2HE2  GLN  49          1HE2      GLN  49 -10.828   3.415   3.415
  364    H    GLN  50           H        GLN  50 -10.221   8.254   8.254
  365    HA   GLN  50           HA       GLN  50  -9.959   9.761   9.761
  366   1HB   GLN  50          2HB       GLN  50  -8.965  10.211  10.211
  367   2HB   GLN  50          1HB       GLN  50 -10.253  11.392  11.392
  368   1HG   GLN  50          2HG       GLN  50  -9.190  12.441  12.441
  369   2HG   GLN  50          1HG       GLN  50  -8.185  11.039  11.039
  370   1HE2  GLN  50          1HE2      GLN  50  -6.992  13.430  13.430
  371   2HE2  GLN  50          2HE2      GLN  50  -6.040  13.573  13.573
  372    H    ARG  51           H        ARG  51 -11.876   9.863   9.863
  373    HA   ARG  51           HA       ARG  51 -14.392   9.697   9.697
  374   1HB   ARG  51          2HB       ARG  51 -13.331  10.087  10.087
  375   2HB   ARG  51          1HB       ARG  51 -14.560  11.318  11.318
  376   1HG   ARG  51          2HG       ARG  51 -15.863   9.654   9.654
  377   2HG   ARG  51          1HG       ARG  51 -15.941   9.252   9.252
  378   1HD   ARG  51          2HD       ARG  51 -15.339   7.204   7.204
  379   2HD   ARG  51          1HD       ARG  51 -13.719   7.900   7.900
  380    HE   ARG  51           HE       ARG  51 -14.576   8.487   8.487
  381   1HH1  ARG  51          2HH1      ARG  51 -14.607   5.508   5.508
  382   2HH1  ARG  51          1HH1      ARG  51 -14.486   4.504   4.504
  383   1HH2  ARG  51          1HH2      ARG  51 -14.414   7.165   7.165
  384   2HH2  ARG  51          2HH2      ARG  51 -14.376   5.443   5.443
  385    H    ASN  52           H        ASN  52 -13.395  12.698  12.698
  386    HA   ASN  52           HA       ASN  52 -14.898  14.195  14.195
  387   1HB   ASN  52          2HB       ASN  52 -13.708  15.232  15.232
  388   2HB   ASN  52          1HB       ASN  52 -14.922  16.016  16.016
  389   1HD2  ASN  52          2HD2      ASN  52 -15.972  13.368  13.368
  390   2HD2  ASN  52          1HD2      ASN  52 -14.338  13.855  13.855
  391    H    GLY  53           H        GLY  53 -12.403  13.131  13.131
  392   1HA   GLY  53          2HA       GLY  53 -10.556  13.794  13.794
  393   2HA   GLY  53          1HA       GLY  53 -11.220  15.422  15.422
  394    H    ARG  54           H        ARG  54 -10.659  13.788  13.788
  395    HA   ARG  54           HA       ARG  54  -8.034  14.975  14.975
  396   1HB   ARG  54          2HB       ARG  54  -8.606  16.315  16.315
  397   2HB   ARG  54          1HB       ARG  54  -9.718  16.737  16.737
  398   1HG   ARG  54          2HG       ARG  54 -11.347  15.110  15.110
  399   2HG   ARG  54          1HG       ARG  54 -10.261  15.117  15.117
  400   1HD   ARG  54          2HD       ARG  54 -10.469  17.646  17.646
  401   2HD   ARG  54          1HD       ARG  54 -11.792  17.421  17.421
  402    HE   ARG  54           HE       ARG  54 -12.339  15.811  15.811
  403   1HH1  ARG  54          2HH1      ARG  54 -11.957  19.216  19.216
  404   2HH1  ARG  54          1HH1      ARG  54 -13.039  19.710  19.710
  405   1HH2  ARG  54          1HH2      ARG  54 -13.761  16.459  16.459
  406   2HH2  ARG  54          2HH2      ARG  54 -14.063  18.146  18.146
  407    H    LYS  55           H        LYS  55 -10.717  13.266  13.266
  408    HA   LYS  55           HA       LYS  55  -9.027  11.995  11.995
  409   1HB   LYS  55          2HB       LYS  55 -11.455  12.408  12.408
  410   2HB   LYS  55          1HB       LYS  55 -11.814  11.221  11.221
  411   1HG   LYS  55          2HG       LYS  55 -12.051  10.312  10.312
  412   2HG   LYS  55          1HG       LYS  55 -10.817   9.467   9.467
  413   1HD   LYS  55          2HD       LYS  55 -10.060   9.878   9.878
  414   2HD   LYS  55          1HD       LYS  55  -9.075  10.766  10.766
  415   1HE   LYS  55          2HE       LYS  55  -9.682  12.750  12.750
  416   2HE   LYS  55          1HE       LYS  55 -11.378  12.281  12.281
  417   1HZ   LYS  55          2HZ       LYS  55  -9.300  11.439  11.439
  418   2HZ   LYS  55          1HZ       LYS  55 -10.321  12.769  12.769
  419   3HZ   LYS  55          3HZ       LYS  55 -10.970  11.209  11.209
  420    H    THR  56           H        THR  56  -7.517  11.419  11.419
  421    HA   THR  56           HA       THR  56  -8.225   9.204   9.204
  422    HB   THR  56           HB       THR  56  -5.365   9.674   9.674
  423    HG1  THR  56           HG1      THR  56  -5.507  11.754  11.754
  424   1HG2  THR  56          3HG2      THR  56  -7.140   9.100   9.100
  425   2HG2  THR  56          2HG2      THR  56  -5.968  10.361  10.361
  426   3HG2  THR  56          1HG2      THR  56  -5.415   8.784   8.784
  427    H    LEU  57           H        LEU  57  -7.413   7.087   7.087
  428    HA   LEU  57           HA       LEU  57  -6.059   6.186   6.186
  429   1HB   LEU  57          2HB       LEU  57  -8.919   5.758   5.758
  430   2HB   LEU  57          1HB       LEU  57  -8.033   4.304   4.304
  431    HG   LEU  57           HG       LEU  57  -8.070   6.812   6.812
  432   1HD1  LEU  57          2HD1      LEU  57  -9.887   4.487   4.487
  433   2HD1  LEU  57          1HD1      LEU  57  -9.397   5.019   5.019
  434   3HD1  LEU  57          3HD1      LEU  57 -10.197   6.146   6.146
  435   1HD2  LEU  57          3HD2      LEU  57  -6.825   4.111   4.111
  436   2HD2  LEU  57          2HD2      LEU  57  -6.138   5.703   5.703
  437   3HD2  LEU  57          1HD2      LEU  57  -7.316   5.010   5.010
  438    H    THR  58           H        THR  58  -4.451   5.787   5.787
  439    HA   THR  58           HA       THR  58  -4.817   4.135   4.135
  440    HB   THR  58           HB       THR  58  -2.309   4.513   4.513
  441    HG1  THR  58           HG1      THR  58  -3.443   6.418   6.418
  442   1HG2  THR  58          2HG2      THR  58  -2.200   2.644   2.644
  443   2HG2  THR  58          1HG2      THR  58  -2.526   3.816   3.816
  444   3HG2  THR  58          3HG2      THR  58  -1.061   3.955   3.955
  445    H    THR  59           H        THR  59  -5.204   2.029   2.029
  446    HA   THR  59           HA       THR  59  -4.745   0.320   0.320
  447    HB   THR  59           HB       THR  59  -6.195  -1.228  -1.228
  448    HG1  THR  59           HG1      THR  59  -6.394   0.651   0.651
  449   1HG2  THR  59          2HG2      THR  59  -6.610  -0.091  -0.091
  450   2HG2  THR  59          1HG2      THR  59  -7.959   0.507   0.507
  451   3HG2  THR  59          3HG2      THR  59  -7.678  -1.228  -1.228
  452    H    VAL  60           H        VAL  60  -4.036  -1.914  -1.914
  453    HA   VAL  60           HA       VAL  60  -2.294  -2.135  -2.135
  454    HB   VAL  60           HB       VAL  60  -1.545  -3.132  -3.132
  455   1HG1  VAL  60          2HG1      VAL  60  -0.576  -4.358  -4.358
  456   2HG1  VAL  60          1HG1      VAL  60   0.084  -2.845  -2.845
  457   3HG1  VAL  60          3HG1      VAL  60   0.649  -3.487  -3.487
  458   1HG2  VAL  60          3HG2      VAL  60  -0.975  -0.548  -0.548
  459   2HG2  VAL  60          2HG2      VAL  60  -1.389  -0.849  -0.849
  460   3HG2  VAL  60          1HG2      VAL  60   0.224  -1.242  -1.242
  461    H    GLN  61           H        GLN  61  -2.907  -3.789  -3.789
  462    HA   GLN  61           HA       GLN  61  -4.114  -6.127  -6.127
  463   1HB   GLN  61          2HB       GLN  61  -5.230  -4.585  -4.585
  464   2HB   GLN  61          1HB       GLN  61  -4.453  -5.824  -5.824
  465   1HG   GLN  61          2HG       GLN  61  -5.659  -7.349  -7.349
  466   2HG   GLN  61          1HG       GLN  61  -6.783  -5.994  -5.994
  467   1HE2  GLN  61          2HE2      GLN  61  -7.080  -6.653  -6.653
  468   2HE2  GLN  61          1HE2      GLN  61  -6.384  -5.382  -5.382
  469    H    GLY  62           H        GLY  62  -3.577  -8.225  -8.225
  470   1HA   GLY  62          2HA       GLY  62  -2.265  -9.689  -9.689
  471   2HA   GLY  62          1HA       GLY  62  -1.169  -8.354  -8.354
  472    H    ILE  63           H        ILE  63  -0.732  -7.457  -7.457
  473    HA   ILE  63           HA       ILE  63   1.411  -8.946  -8.946
  474    HB   ILE  63           HB       ILE  63  -0.406  -7.107  -7.107
  475   1HG1  ILE  63          2HG1      ILE  63   0.828  -5.553  -5.553
  476   2HG1  ILE  63          1HG1      ILE  63   2.192  -6.084  -6.084
  477   1HG2  ILE  63          3HG2      ILE  63   1.662  -8.871  -8.871
  478   2HG2  ILE  63          2HG2      ILE  63   1.845  -7.179  -7.179
  479   3HG2  ILE  63          1HG2      ILE  63   0.345  -8.035  -8.035
  480   1HD1  ILE  63          1HD1      ILE  63   1.482  -7.108  -7.108
  481   2HD1  ILE  63          3HD1      ILE  63   2.756  -5.950  -5.950
  482   3HD1  ILE  63          2HD1      ILE  63   2.867  -7.608  -7.608
  483    H    ALA  64           H        ALA  64   1.790 -10.510 -10.510
  484    HA   ALA  64           HA       ALA  64  -0.363 -12.386 -12.386
  485   1HB   ALA  64          1HB       ALA  64   2.460 -12.517 -12.517
  486   2HB   ALA  64          3HB       ALA  64   1.970 -13.169 -13.169
  487   3HB   ALA  64          2HB       ALA  64   1.303 -13.846 -13.846
  488    H    ASP  65           H        ASP  65  -0.788 -13.383 -13.383
  489    HA   ASP  65           HA       ASP  65  -1.265 -11.359 -11.359
  490   1HB   ASP  65          2HB       ASP  65  -1.844 -14.329 -14.329
  491   2HB   ASP  65          1HB       ASP  65  -2.401 -13.184 -13.184
  492    H    ASP  66           H        ASP  66   1.255 -13.538 -13.538
  493    HA   ASP  66           HA       ASP  66   2.110 -13.693 -13.693
  494   1HB   ASP  66          2HB       ASP  66   3.312 -14.909 -14.909
  495   2HB   ASP  66          1HB       ASP  66   3.879 -15.189 -15.189
  496    H    TYR  67           H        TYR  67   2.103 -11.156 -11.156
  497    HA   TYR  67           HA       TYR  67   4.934 -10.568 -10.568
  498   1HB   TYR  67          2HB       TYR  67   2.380  -9.204  -9.204
  499   2HB   TYR  67          1HB       TYR  67   3.823  -8.220  -8.220
  500    HD1  TYR  67           HD1      TYR  67   4.100 -11.638 -11.638
  501    HD2  TYR  67           HD2      TYR  67   3.748  -7.526  -7.526
  502    HE1  TYR  67           HE1      TYR  67   4.774 -12.154 -12.154
  503    HE2  TYR  67           HE2      TYR  67   4.415  -8.020  -8.020
  504    HH   TYR  67           HH       TYR  67   4.256 -10.309 -10.309
  505    H    ASP  68           H        ASP  68   3.467 -11.035 -11.035
  506    HA   ASP  68           HA       ASP  68   3.391 -10.162 -10.162
  507   1HB   ASP  68          2HB       ASP  68   5.948 -10.192 -10.192
  508   2HB   ASP  68          1HB       ASP  68   5.768  -8.458  -8.458
  509    H    LYS  69           H        LYS  69   1.448  -8.950  -8.950
  510    HA   LYS  69           HA       LYS  69   1.149  -6.468  -6.468
  511   1HB   LYS  69          2HB       LYS  69  -0.189  -7.343  -7.343
  512   2HB   LYS  69          1HB       LYS  69  -0.800  -6.179  -6.179
  513   1HG   LYS  69          2HG       LYS  69  -1.978  -7.911  -7.911
  514   2HG   LYS  69          1HG       LYS  69  -0.468  -8.372  -8.372
  515   1HD   LYS  69          2HD       LYS  69  -0.728 -10.323 -10.323
  516   2HD   LYS  69          1HD       LYS  69  -0.158  -9.442  -9.442
  517   1HE   LYS  69          2HE       LYS  69  -2.991  -9.043  -9.043
  518   2HE   LYS  69          1HE       LYS  69  -2.596 -10.756 -10.756
  519   1HZ   LYS  69          2HZ       LYS  69  -1.342  -9.030  -9.030
  520   2HZ   LYS  69          1HZ       LYS  69  -3.023  -9.165  -9.165
  521   3HZ   LYS  69          3HZ       LYS  69  -2.055 -10.553 -10.553
  522    H    LYS  70           H        LYS  70   2.544  -7.246  -7.246
  523    HA   LYS  70           HA       LYS  70   2.555  -4.636  -4.636
  524   1HB   LYS  70          2HB       LYS  70   3.309  -7.172  -7.172
  525   2HB   LYS  70          1HB       LYS  70   4.812  -6.262  -6.262
  526   1HG   LYS  70          2HG       LYS  70   4.097  -4.786  -4.786
  527   2HG   LYS  70          1HG       LYS  70   2.390  -5.082  -5.082
  528   1HD   LYS  70          2HD       LYS  70   3.181  -7.548  -7.548
  529   2HD   LYS  70          1HD       LYS  70   4.261  -6.537  -6.537
  530   1HE   LYS  70          2HE       LYS  70   2.491  -5.488  -5.488
  531   2HE   LYS  70          1HE       LYS  70   1.320  -5.973  -5.973
  532   1HZ   LYS  70          1HZ       LYS  70   2.664  -8.113  -8.113
  533   2HZ   LYS  70          3HZ       LYS  70   1.542  -7.197  -7.197
  534   3HZ   LYS  70          2HZ       LYS  70   1.062  -8.006  -8.006
  535    H    LYS  71           H        LYS  71   5.080  -6.502  -6.502
  536    HA   LYS  71           HA       LYS  71   6.732  -4.115  -4.115
  537   1HB   LYS  71          2HB       LYS  71   7.505  -6.571  -6.571
  538   2HB   LYS  71          1HB       LYS  71   7.457  -6.743  -6.743
  539   1HG   LYS  71          2HG       LYS  71   8.843  -4.411  -4.411
  540   2HG   LYS  71          1HG       LYS  71   9.375  -5.346  -5.346
  541   1HD   LYS  71          2HD       LYS  71   9.436  -7.189  -7.189
  542   2HD   LYS  71          1HD       LYS  71   9.977  -5.702  -5.702
  543   1HE   LYS  71          2HE       LYS  71  11.293  -5.800  -5.800
  544   2HE   LYS  71          1HE       LYS  71  11.388  -7.430  -7.430
  545   1HZ   LYS  71          3HZ       LYS  71  12.154  -4.979  -4.979
  546   2HZ   LYS  71          2HZ       LYS  71  13.249  -5.973  -5.973
  547   3HZ   LYS  71          1HZ       LYS  71  12.381  -6.581  -6.581
  548    H    LEU  72           H        LEU  72   4.158  -4.457  -4.457
  549    HA   LEU  72           HA       LEU  72   5.219  -4.218  -4.218
  550   1HB   LEU  72          2HB       LEU  72   3.534  -6.091  -6.091
  551   2HB   LEU  72          1HB       LEU  72   2.347  -4.802  -4.802
  552    HG   LEU  72           HG       LEU  72   3.984  -5.696  -5.696
  553   1HD1  LEU  72          1HD1      LEU  72   1.743  -6.818  -6.818
  554   2HD1  LEU  72          3HD1      LEU  72   1.041  -5.581  -5.581
  555   3HD1  LEU  72          2HD1      LEU  72   2.150  -6.776  -6.776
  556   1HD2  LEU  72          3HD2      LEU  72   2.240  -3.294  -3.294
  557   2HD2  LEU  72          2HD2      LEU  72   3.838  -3.391  -3.391
  558   3HD2  LEU  72          1HD2      LEU  72   2.427  -4.007  -4.007
  559    H    VAL  73           H        VAL  73   2.671  -3.030  -3.030
  560    HA   VAL  73           HA       VAL  73   2.452  -0.590  -0.590
  561    HB   VAL  73           HB       VAL  73   0.654  -0.079  -0.079
  562   1HG1  VAL  73          3HG1      VAL  73   0.333  -2.053  -2.053
  563   2HG1  VAL  73          2HG1      VAL  73  -1.022  -1.357  -1.357
  564   3HG1  VAL  73          1HG1      VAL  73   0.056  -0.312  -0.312
  565   1HG2  VAL  73          3HG2      VAL  73   1.390  -2.128  -2.128
  566   2HG2  VAL  73          2HG2      VAL  73  -0.342  -1.930  -1.930
  567   3HG2  VAL  73          1HG2      VAL  73   0.570  -3.082  -3.082
  568    H    LYS  74           H        LYS  74   3.437  -1.694  -1.694
  569    HA   LYS  74           HA       LYS  74   3.734   0.781   0.781
  570   1HB   LYS  74          2HB       LYS  74   3.966  -1.545  -1.545
  571   2HB   LYS  74          1HB       LYS  74   5.609  -1.547  -1.547
  572   1HG   LYS  74          2HG       LYS  74   5.719   0.760   0.760
  573   2HG   LYS  74          1HG       LYS  74   4.429   0.011   0.011
  574   1HD   LYS  74          2HD       LYS  74   6.321  -0.649  -0.649
  575   2HD   LYS  74          1HD       LYS  74   6.038  -2.029  -2.029
  576   1HE   LYS  74          2HE       LYS  74   7.688   0.006   0.006
  577   2HE   LYS  74          1HE       LYS  74   8.392  -0.591  -0.591
  578   1HZ   LYS  74          2HZ       LYS  74   7.360  -2.503  -2.503
  579   2HZ   LYS  74          1HZ       LYS  74   8.881  -1.801  -1.801
  580   3HZ   LYS  74          3HZ       LYS  74   8.573  -2.714  -2.714
  581    H    ALA  75           H        ALA  75   5.918  -1.010  -1.010
  582    HA   ALA  75           HA       ALA  75   8.139   0.716   0.716
  583   1HB   ALA  75          3HB       ALA  75   7.323  -1.477  -1.477
  584   2HB   ALA  75          2HB       ALA  75   8.433  -0.309  -0.309
  585   3HB   ALA  75          1HB       ALA  75   8.878  -1.154  -1.154
  586    H    PHE  76           H        PHE  76   5.202   0.866   0.866
  587    HA   PHE  76           HA       PHE  76   5.995   2.754   2.754
  588   1HB   PHE  76          2HB       PHE  76   3.819   1.285   1.285
  589   2HB   PHE  76          1HB       PHE  76   3.196   2.697   2.697
  590    HD1  PHE  76           HD2      PHE  76   4.607   1.519   1.519
  591    HD2  PHE  76           HD1      PHE  76   2.511   4.617   4.617
  592    HE1  PHE  76           HE2      PHE  76   4.094   2.579   2.579
  593    HE2  PHE  76           HE1      PHE  76   1.994   5.681   5.681
  594    HZ   PHE  76           HZ       PHE  76   2.787   4.661   4.661
  595    H    LYS  77           H        LYS  77   4.360   3.139   3.139
  596    HA   LYS  77           HA       LYS  77   4.200   5.950   5.950
  597   1HB   LYS  77          2HB       LYS  77   4.329   4.105   4.105
  598   2HB   LYS  77          1HB       LYS  77   3.826   5.789   5.789
  599   1HG   LYS  77          2HG       LYS  77   1.819   5.356   5.356
  600   2HG   LYS  77          1HG       LYS  77   2.410   3.876   3.876
  601   1HD   LYS  77          2HD       LYS  77   2.561   3.591   3.591
  602   2HD   LYS  77          1HD       LYS  77   0.946   4.154   4.154
  603   1HE   LYS  77          2HE       LYS  77   0.596   2.305   2.305
  604   2HE   LYS  77          1HE       LYS  77   2.294   1.836   1.836
  605   1HZ   LYS  77          1HZ       LYS  77   1.629   1.722   1.722
  606   2HZ   LYS  77          3HZ       LYS  77   0.139   1.324   1.324
  607   3HZ   LYS  77          2HZ       LYS  77   1.511   0.400   0.400
  608    H    LYS  78           H        LYS  78   6.864   3.867   3.867
  609    HA   LYS  78           HA       LYS  78   8.414   5.836   5.836
  610   1HB   LYS  78          2HB       LYS  78   8.446   3.157   3.157
  611   2HB   LYS  78          1HB       LYS  78   9.693   3.396   3.396
  612   1HG   LYS  78          2HG       LYS  78   9.684   4.658   4.658
  613   2HG   LYS  78          1HG       LYS  78  10.598   3.218   3.218
  614   1HD   LYS  78          2HD       LYS  78  11.523   4.775   4.775
  615   2HD   LYS  78          1HD       LYS  78  11.006   6.065   6.065
  616   1HE   LYS  78          2HE       LYS  78  13.051   5.806   5.806
  617   2HE   LYS  78          1HE       LYS  78  12.312   4.434   4.434
  618   1HZ   LYS  78          2HZ       LYS  78  13.087   3.010   3.010
  619   2HZ   LYS  78          1HZ       LYS  78  13.869   4.336   4.336
  620   3HZ   LYS  78          3HZ       LYS  78  14.367   3.762   3.762
  621    H    LYS  79           H        LYS  79   7.862   4.865   4.865
  622    HA   LYS  79           HA       LYS  79  10.323   6.142   6.142
  623   1HB   LYS  79          2HB       LYS  79   8.988   3.883   3.883
  624   2HB   LYS  79          1HB       LYS  79   8.530   5.084   5.084
  625   1HG   LYS  79          2HG       LYS  79  11.090   5.586   5.586
  626   2HG   LYS  79          1HG       LYS  79  11.217   3.967   3.967
  627   1HD   LYS  79          2HD       LYS  79  10.833   3.026   3.026
  628   2HD   LYS  79          1HD       LYS  79   9.372   3.986   3.986
  629   1HE   LYS  79          2HE       LYS  79  12.195   4.858   4.858
  630   2HE   LYS  79          1HE       LYS  79  10.976   4.385   4.385
  631   1HZ   LYS  79          3HZ       LYS  79  10.144   6.483   6.483
  632   2HZ   LYS  79          2HZ       LYS  79  11.433   6.908   6.908
  633   3HZ   LYS  79          1HZ       LYS  79   9.979   6.369   6.369
  634    H    PHE  80           H        PHE  80   6.805   6.315   6.315
  635    HA   PHE  80           HA       PHE  80   7.206   9.025   9.025
  636   1HB   PHE  80          2HB       PHE  80   4.673   7.537   7.537
  637   2HB   PHE  80          1HB       PHE  80   5.505   8.716   8.716
  638    HD1  PHE  80           HD1      PHE  80   5.607   5.212   5.212
  639    HD2  PHE  80           HD2      PHE  80   6.965   8.036   8.036
  640    HE1  PHE  80           HE1      PHE  80   6.564   3.381   3.381
  641    HE2  PHE  80           HE2      PHE  80   7.924   6.211   6.211
  642    HZ   PHE  80           HZ       PHE  80   7.725   3.881   3.881
  643    H    ALA  81           H        ALA  81   5.757   7.194   7.194
  644    HA   ALA  81           HA       ALA  81   4.648   7.861   7.861
  645   1HB   ALA  81          2HB       ALA  81   6.010  10.096  10.096
  646   2HB   ALA  81          1HB       ALA  81   4.355  10.689  10.689
  647   3HB   ALA  81          3HB       ALA  81   4.913   9.978   9.978
  648    H    CYS  82           H        CYS  82   3.272   6.844   6.844
  649    HA   CYS  82           HA       CYS  82   0.784   8.415   8.415
  650   1HB   CYS  82          2HB       CYS  82   2.104   6.619   6.619
  651   2HB   CYS  82          1HB       CYS  82   0.345   6.581   6.581
  652    HG   CYS  82           HG       CYS  82   1.884   8.605   8.605
  653    H    ASN  83           H        ASN  83  -1.190   7.429   7.429
  654    HA   ASN  83           HA       ASN  83  -1.113   5.382   5.382
  655   1HB   ASN  83          2HB       ASN  83  -2.991   7.284   7.284
  656   2HB   ASN  83          1HB       ASN  83  -3.757   5.704   5.704
  657   1HD2  ASN  83          2HD2      ASN  83  -2.376   6.688   6.688
  658   2HD2  ASN  83          1HD2      ASN  83  -1.383   6.910   6.910
  659    H    GLY  84           H        GLY  84  -0.518   3.380   3.380
  660   1HA   GLY  84          2HA       GLY  84  -1.660   2.239   2.239
  661   2HA   GLY  84          1HA       GLY  84  -0.255   1.623   1.623
  662    H    THR  85           H        THR  85  -3.576   1.304   1.304
  663    HA   THR  85           HA       THR  85  -3.883  -0.362  -0.362
  664    HB   THR  85           HB       THR  85  -6.294  -0.148  -0.148
  665    HG1  THR  85           HG1      THR  85  -5.553   1.327   1.327
  666   1HG2  THR  85          1HG2      THR  85  -4.689   1.881   1.881
  667   2HG2  THR  85          3HG2      THR  85  -5.664   2.669   2.669
  668   3HG2  THR  85          2HG2      THR  85  -6.449   1.851   1.851
  669    H    VAL  86           H        VAL  86  -5.177  -2.360  -2.360
  670    HA   VAL  86           HA       VAL  86  -4.608  -3.649  -3.649
  671    HB   VAL  86           HB       VAL  86  -3.312  -4.595  -4.595
  672   1HG1  VAL  86          2HG1      VAL  86  -5.553  -4.164  -4.164
  673   2HG1  VAL  86          1HG1      VAL  86  -5.566  -5.913  -5.913
  674   3HG1  VAL  86          3HG1      VAL  86  -4.154  -5.121  -5.121
  675   1HG2  VAL  86          3HG2      VAL  86  -5.451  -6.377  -6.377
  676   2HG2  VAL  86          2HG2      VAL  86  -3.838  -6.078  -6.078
  677   3HG2  VAL  86          1HG2      VAL  86  -4.033  -6.970  -6.970
  678    H    ILE  87           H        ILE  87  -6.791  -2.583  -2.583
  679    HA   ILE  87           HA       ILE  87  -9.135  -3.688  -3.688
  680    HB   ILE  87           HB       ILE  87 -10.389  -2.528  -2.528
  681   1HG1  ILE  87          2HG1      ILE  87  -8.110  -1.234  -1.234
  682   2HG1  ILE  87          1HG1      ILE  87  -8.174  -2.965  -2.965
  683   1HG2  ILE  87          2HG2      ILE  87  -9.572  -1.256  -1.256
  684   2HG2  ILE  87          1HG2      ILE  87  -8.114  -0.838  -0.838
  685   3HG2  ILE  87          3HG2      ILE  87  -9.686  -0.253  -0.253
  686   1HD1  ILE  87          3HD1      ILE  87 -10.715  -1.516  -1.516
  687   2HD1  ILE  87          2HD1      ILE  87  -9.454  -1.140  -1.140
  688   3HD1  ILE  87          1HD1      ILE  87 -10.009  -2.803  -2.803
  689    H    GLU  88           H        GLU  88 -10.752  -4.961  -4.961
  690    HA   GLU  88           HA       GLU  88  -9.593  -6.886  -6.886
  691   1HB   GLU  88          2HB       GLU  88 -10.484  -7.571  -7.571
  692   2HB   GLU  88          1HB       GLU  88 -12.065  -7.435  -7.435
  693   1HG   GLU  88          2HG       GLU  88 -11.296  -9.032  -9.032
  694   2HG   GLU  88          1HG       GLU  88  -9.808  -9.243  -9.243
  695    H    HIS  89           H        HIS  89 -10.136  -5.238  -5.238
  696    HA   HIS  89           HA       HIS  89 -12.677  -4.330  -4.330
  697   1HB   HIS  89          2HB       HIS  89 -10.278  -3.938  -3.938
  698   2HB   HIS  89          1HB       HIS  89 -10.922  -5.080  -5.080
  699    HD1  HIS  89           HD1      HIS  89 -12.338  -4.113  -4.113
  700    HD2  HIS  89           HD2      HIS  89 -12.026  -1.581  -1.581
  701    HE1  HIS  89           HE1      HIS  89 -13.522  -1.998  -1.998
  702    HE2  HIS  89           HE2      HIS  89 -13.288  -0.464  -0.464
  703    HA   PRO  90           HA       PRO  90 -14.737  -8.065  -8.065
  704   1HB   PRO  90          2HB       PRO  90 -17.046  -6.985  -6.985
  705   2HB   PRO  90          1HB       PRO  90 -16.615  -7.030  -7.030
  706   1HG   PRO  90          2HG       PRO  90 -16.407  -4.766  -4.766
  707   2HG   PRO  90          1HG       PRO  90 -16.975  -4.749  -4.749
  708   1HD   PRO  90          2HD       PRO  90 -14.457  -3.986  -3.986
  709   2HD   PRO  90          1HD       PRO  90 -14.849  -4.626  -4.626
  710    H    GLU  91           H        GLU  91 -13.928  -5.435  -5.435
  711    HA   GLU  91           HA       GLU  91 -14.864  -6.713  -6.713
  712   1HB   GLU  91          2HB       GLU  91 -14.037  -4.095  -4.095
  713   2HB   GLU  91          1HB       GLU  91 -13.059  -4.606  -4.606
  714   1HG   GLU  91          2HG       GLU  91 -15.080  -3.370  -3.370
  715   2HG   GLU  91          1HG       GLU  91 -15.018  -5.001  -5.001
  716    H    TYR  92           H        TYR  92 -11.977  -6.590  -6.590
  717    HA   TYR  92           HA       TYR  92 -10.554  -8.085  -8.085
  718   1HB   TYR  92          2HB       TYR  92  -9.082  -6.538  -6.538
  719   2HB   TYR  92          1HB       TYR  92  -8.554  -7.006  -7.006
  720    HD1  TYR  92           HD2      TYR  92 -10.690  -6.022  -6.022
  721    HD2  TYR  92           HD1      TYR  92  -8.929  -4.222  -4.222
  722    HE1  TYR  92           HE2      TYR  92 -11.321  -3.804  -3.804
  723    HE2  TYR  92           HE1      TYR  92  -9.558  -1.998  -1.998
  724    HH   TYR  92           HH       TYR  92 -11.257  -1.023  -1.023
  725    H    GLY  93           H        GLY  93 -10.625  -7.526  -7.526
  726   1HA   GLY  93          2HA       GLY  93 -10.991  -9.332  -9.332
  727   2HA   GLY  93          1HA       GLY  93 -10.284 -10.428 -10.428
  728    H    GLU  94           H        GLU  94  -9.702  -8.322  -8.322
  729    HA   GLU  94           HA       GLU  94  -7.894  -8.002  -8.002
  730   1HB   GLU  94          2HB       GLU  94  -7.739 -10.533 -10.533
  731   2HB   GLU  94          1HB       GLU  94  -6.476 -10.178 -10.178
  732   1HG   GLU  94          2HG       GLU  94  -5.034 -10.229 -10.229
  733   2HG   GLU  94          1HG       GLU  94  -5.756  -8.728  -8.728
  734    H    VAL  95           H        VAL  95  -7.327  -5.976  -5.976
  735    HA   VAL  95           HA       VAL  95  -4.927  -5.842  -5.842
  736    HB   VAL  95           HB       VAL  95  -5.825  -3.848  -3.848
  737   1HG1  VAL  95          2HG1      VAL  95  -5.903  -6.386  -6.386
  738   2HG1  VAL  95          1HG1      VAL  95  -7.643  -6.098  -6.098
  739   3HG1  VAL  95          3HG1      VAL  95  -6.616  -5.115  -5.115
  740   1HG2  VAL  95          1HG2      VAL  95  -8.386  -4.733  -4.733
  741   2HG2  VAL  95          3HG2      VAL  95  -7.614  -3.149  -3.149
  742   3HG2  VAL  95          2HG2      VAL  95  -8.341  -3.703  -3.703
  743    H    ILE  96           H        ILE  96  -3.571  -4.114  -4.114
  744    HA   ILE  96           HA       ILE  96  -4.032  -2.941  -2.941
  745    HB   ILE  96           HB       ILE  96  -1.705  -3.111  -3.111
  746   1HG1  ILE  96          2HG1      ILE  96  -2.293  -4.728  -4.728
  747   2HG1  ILE  96          1HG1      ILE  96  -0.643  -4.109  -4.109
  748   1HG2  ILE  96          1HG2      ILE  96  -2.166  -0.893  -0.893
  749   2HG2  ILE  96          3HG2      ILE  96  -0.544  -1.577  -1.577
  750   3HG2  ILE  96          2HG2      ILE  96  -1.324  -0.887  -0.887
  751   1HD1  ILE  96          1HD1      ILE  96  -2.094  -2.329  -2.329
  752   2HD1  ILE  96          3HD1      ILE  96  -2.656  -3.935  -3.935
  753   3HD1  ILE  96          2HD1      ILE  96  -0.939  -3.547  -3.547
  754    H    GLN  97           H        GLN  97  -4.766  -0.981  -0.981
  755    HA   GLN  97           HA       GLN  97  -5.239   0.829   0.829
  756   1HB   GLN  97          2HB       GLN  97  -6.828  -0.004  -0.004
  757   2HB   GLN  97          1HB       GLN  97  -6.590   1.734   1.734
  758   1HG   GLN  97          2HG       GLN  97  -7.370   1.887   1.887
  759   2HG   GLN  97          1HG       GLN  97  -7.788   0.176   0.176
  760   1HE2  GLN  97          2HE2      GLN  97  -9.869   2.724   2.724
  761   2HE2  GLN  97          1HE2      GLN  97  -8.169   2.927   2.927
  762    H    LEU  98           H        LEU  98  -3.719   2.326   2.326
  763    HA   LEU  98           HA       LEU  98  -2.404   3.439   3.439
  764   1HB   LEU  98          2HB       LEU  98  -1.797   3.954   3.954
  765   2HB   LEU  98          1HB       LEU  98  -0.819   4.424   4.424
  766    HG   LEU  98           HG       LEU  98  -1.375   1.524   1.524
  767   1HD1  LEU  98          2HD1      LEU  98  -0.576   2.825   2.825
  768   2HD1  LEU  98          1HD1      LEU  98   0.988   2.669   2.669
  769   3HD1  LEU  98          3HD1      LEU  98   0.044   1.229   1.229
  770   1HD2  LEU  98          1HD2      LEU  98   0.066   2.942   2.942
  771   2HD2  LEU  98          3HD2      LEU  98   0.337   1.246   1.246
  772   3HD2  LEU  98          2HD2      LEU  98   1.309   2.500   2.500
  773    H    GLN  99           H        GLN  99  -2.202   5.785   5.785
  774    HA   GLN  99           HA       GLN  99  -4.690   7.079   7.079
  775   1HB   GLN  99          2HB       GLN  99  -2.981   7.230   7.230
  776   2HB   GLN  99          1HB       GLN  99  -3.061   8.827   8.827
  777   1HG   GLN  99          2HG       GLN  99  -5.562   7.274   7.274
  778   2HG   GLN  99          1HG       GLN  99  -4.780   8.154   8.154
  779   1HE2  GLN  99          2HE2      GLN  99  -6.908  10.083  10.083
  780   2HE2  GLN  99          1HE2      GLN  99  -6.642   8.377   8.377
  781    H    GLY 100           H        GLY 100  -4.841   8.843   8.843
  782   1HA   GLY 100          2HA       GLY 100  -4.180  10.537  10.537
  783   2HA   GLY 100          1HA       GLY 100  -2.540  10.350  10.350
  784    H    ASP 101           H        ASP 101  -2.730  10.855  10.855
  785    HA   ASP 101           HA       ASP 101  -2.977   8.508   8.508
  786   1HB   ASP 101          2HB       ASP 101  -2.012   9.954   9.954
  787   2HB   ASP 101          1HB       ASP 101  -3.409  10.673  10.673
  788    H    GLN 102           H        GLN 102  -1.590   6.934   6.934
  789    HA   GLN 102           HA       GLN 102   1.275   7.560   7.560
  790   1HB   GLN 102          2HB       GLN 102  -0.470   5.693   5.693
  791   2HB   GLN 102          1HB       GLN 102   1.059   4.999   4.999
  792   1HG   GLN 102          2HG       GLN 102   0.965   6.024   6.024
  793   2HG   GLN 102          1HG       GLN 102   2.308   6.498   6.498
  794   1HE2  GLN 102          2HE2      GLN 102  -0.666   9.281   9.281
  795   2HE2  GLN 102          1HE2      GLN 102  -1.020   7.633   7.633
  796    H    ARG 103           H        ARG 103  -0.761   6.721   6.721
  797    HA   ARG 103           HA       ARG 103  -0.115   4.301   4.301
  798   1HB   ARG 103          2HB       ARG 103  -0.542   5.360   5.360
  799   2HB   ARG 103          1HB       ARG 103  -1.782   5.687   5.687
  800   1HG   ARG 103          2HG       ARG 103  -0.930   7.900   7.900
  801   2HG   ARG 103          1HG       ARG 103   0.454   7.580   7.580
  802   1HD   ARG 103          2HD       ARG 103  -0.721   7.963   7.963
  803   2HD   ARG 103          1HD       ARG 103  -2.126   7.076   7.076
  804    HE   ARG 103           HE       ARG 103  -3.054   9.067   9.067
  805   1HH1  ARG 103          2HH1      ARG 103   0.392   9.519   9.519
  806   2HH1  ARG 103          1HH1      ARG 103   0.318  11.229  11.229
  807   1HH2  ARG 103          1HH2      ARG 103  -3.153  11.316  11.316
  808   2HH2  ARG 103          2HH2      ARG 103  -1.694  12.250  12.250
  809    H    LYS 104           H        LYS 104   1.884   7.150   7.150
  810    HA   LYS 104           HA       LYS 104   3.897   5.919   5.919
  811   1HB   LYS 104          2HB       LYS 104   3.231   8.302   8.302
  812   2HB   LYS 104          1HB       LYS 104   3.904   8.681   8.681
  813   1HG   LYS 104          2HG       LYS 104   5.740   7.250   7.250
  814   2HG   LYS 104          1HG       LYS 104   5.250   8.842   8.842
  815   1HD   LYS 104          2HD       LYS 104   6.285   8.343   8.343
  816   2HD   LYS 104          1HD       LYS 104   7.321   8.806   8.806
  817   1HE   LYS 104          2HE       LYS 104   6.536  10.936  10.936
  818   2HE   LYS 104          1HE       LYS 104   4.919  10.467  10.467
  819   1HZ   LYS 104          1HZ       LYS 104   5.835  10.135  10.135
  820   2HZ   LYS 104          3HZ       LYS 104   7.330  10.722  10.722
  821   3HZ   LYS 104          2HZ       LYS 104   5.976  11.735  11.735
  822    H    ASN 105           H        ASN 105   3.204   6.530   6.530
  823    HA   ASN 105           HA       ASN 105   5.981   6.201   6.201
  824   1HB   ASN 105          2HB       ASN 105   3.426   6.946   6.946
  825   2HB   ASN 105          1HB       ASN 105   4.693   6.219   6.219
  826   1HD2  ASN 105          2HD2      ASN 105   4.853  10.070  10.070
  827   2HD2  ASN 105          1HD2      ASN 105   3.467   9.060   9.060
  828    H    ILE 106           H        ILE 106   2.923   4.412   4.412
  829    HA   ILE 106           HA       ILE 106   3.835   2.296   2.296
  830    HB   ILE 106           HB       ILE 106   1.441   2.736   2.736
  831   1HG1  ILE 106          2HG1      ILE 106   0.787   0.394   0.394
  832   2HG1  ILE 106          1HG1      ILE 106   2.358  -0.070  -0.070
  833   1HG2  ILE 106          3HG2      ILE 106   1.765   3.080   3.080
  834   2HG2  ILE 106          2HG2      ILE 106   1.984   1.339   1.339
  835   3HG2  ILE 106          1HG2      ILE 106   0.446   1.983   1.983
  836   1HD1  ILE 106          2HD1      ILE 106   2.430   1.444   1.444
  837   2HD1  ILE 106          1HD1      ILE 106   1.701  -0.159  -0.159
  838   3HD1  ILE 106          3HD1      ILE 106   3.350   0.028   0.028
  839    H    CYS 107           H        CYS 107   3.637   2.529   2.529
  840    HA   CYS 107           HA       CYS 107   4.791   0.035   0.035
  841   1HB   CYS 107          2HB       CYS 107   5.506   1.155   1.155
  842   2HB   CYS 107          1HB       CYS 107   3.785   1.227   1.227
  843    HG   CYS 107           HG       CYS 107   5.506   3.586   3.586
  844    H    GLN 108           H        GLN 108   6.098   3.104   3.104
  845    HA   GLN 108           HA       GLN 108   8.846   2.507   2.507
  846   1HB   GLN 108          2HB       GLN 108   8.360   4.789   4.789
  847   2HB   GLN 108          1HB       GLN 108   7.324   4.666   4.666
  848   1HG   GLN 108          2HG       GLN 108   9.103   5.730   5.730
  849   2HG   GLN 108          1HG       GLN 108   9.584   4.062   4.062
  850   1HE2  GLN 108          2HE2      GLN 108  12.226   4.075   4.075
  851   2HE2  GLN 108          1HE2      GLN 108  11.065   3.083   3.083
  852    H    PHE 109           H        PHE 109   6.623   2.171   2.171
  853    HA   PHE 109           HA       PHE 109   8.603   1.518   1.518
  854   1HB   PHE 109          2HB       PHE 109   6.407   2.436   2.436
  855   2HB   PHE 109          1HB       PHE 109   5.620   1.000   1.000
  856    HD1  PHE 109           HD1      PHE 109   8.212   1.989   1.989
  857    HD2  PHE 109           HD2      PHE 109   5.117  -0.735  -0.735
  858    HE1  PHE 109           HE1      PHE 109   8.433   0.896   0.896
  859    HE2  PHE 109           HE2      PHE 109   5.333  -1.835  -1.835
  860    HZ   PHE 109           HZ       PHE 109   6.992  -1.016  -1.016
  861    H    LEU 110           H        LEU 110   6.342  -0.322  -0.322
  862    HA   LEU 110           HA       LEU 110   6.877  -2.873  -2.873
  863   1HB   LEU 110          2HB       LEU 110   5.836  -1.792  -1.792
  864   2HB   LEU 110          1HB       LEU 110   6.281  -3.486  -3.486
  865    HG   LEU 110           HG       LEU 110   4.613  -3.979  -3.979
  866   1HD1  LEU 110          2HD1      LEU 110   5.054  -1.994  -1.994
  867   2HD1  LEU 110          1HD1      LEU 110   4.074  -1.034  -1.034
  868   3HD1  LEU 110          3HD1      LEU 110   3.343  -2.365  -2.365
  869   1HD2  LEU 110          3HD2      LEU 110   3.758  -3.628  -3.628
  870   2HD2  LEU 110          2HD2      LEU 110   2.558  -3.203  -3.203
  871   3HD2  LEU 110          1HD2      LEU 110   3.449  -1.934  -1.934
  872    H    VAL 111           H        VAL 111   8.662  -0.851  -0.851
  873    HA   VAL 111           HA       VAL 111  10.464  -3.026  -3.026
  874    HB   VAL 111           HB       VAL 111  10.543  -0.121  -0.121
  875   1HG1  VAL 111          3HG1      VAL 111  12.535  -2.015  -2.015
  876   2HG1  VAL 111          2HG1      VAL 111  11.760  -2.097  -2.097
  877   3HG1  VAL 111          1HG1      VAL 111  12.396  -0.562  -0.562
  878   1HG2  VAL 111          2HG2      VAL 111   8.548  -1.753  -1.753
  879   2HG2  VAL 111          1HG2      VAL 111   9.211  -0.579  -0.579
  880   3HG2  VAL 111          3HG2      VAL 111   9.712  -2.268  -2.268
  881    H    GLU 112           H        GLU 112  10.338  -0.169  -0.169
  882    HA   GLU 112           HA       GLU 112  13.122   0.027   0.027
  883   1HB   GLU 112          2HB       GLU 112  10.656   1.096   1.096
  884   2HB   GLU 112          1HB       GLU 112  12.232   1.292   1.292
  885   1HG   GLU 112          2HG       GLU 112  12.229   2.067   2.067
  886   2HG   GLU 112          1HG       GLU 112  11.073   2.984   2.984
  887    H    ILE 113           H        ILE 113  10.440  -1.582  -1.582
  888    HA   ILE 113           HA       ILE 113  12.241  -2.648  -2.648
  889    HB   ILE 113           HB       ILE 113  10.337  -3.376  -3.376
  890   1HG1  ILE 113          2HG1      ILE 113   8.740  -2.913  -2.913
  891   2HG1  ILE 113          1HG1      ILE 113   9.127  -4.473  -4.473
  892   1HG2  ILE 113          3HG2      ILE 113  10.738  -0.828  -0.828
  893   2HG2  ILE 113          2HG2      ILE 113   9.199  -0.910  -0.910
  894   3HG2  ILE 113          1HG2      ILE 113   9.288  -1.381  -1.381
  895   1HD1  ILE 113          2HD1      ILE 113   7.775  -2.729  -2.729
  896   2HD1  ILE 113          1HD1      ILE 113   6.835  -3.000  -3.000
  897   3HD1  ILE 113          3HD1      ILE 113   7.384  -4.372  -4.372
  898    H    GLY 114           H        GLY 114  10.816  -3.591  -3.591
  899   1HA   GLY 114          2HA       GLY 114  11.410  -5.502  -5.502
  900   2HA   GLY 114          1HA       GLY 114  12.039  -6.227  -6.227
  901    H    LEU 115           H        LEU 115   8.892  -4.745  -4.745
  902    HA   LEU 115           HA       LEU 115   7.616  -7.126  -7.126
  903   1HB   LEU 115          2HB       LEU 115   7.052  -4.518  -4.518
  904   2HB   LEU 115          1HB       LEU 115   6.003  -4.886  -4.886
  905    HG   LEU 115           HG       LEU 115   4.791  -6.507  -6.507
  906   1HD1  LEU 115          2HD1      LEU 115   7.033  -6.177  -6.177
  907   2HD1  LEU 115          1HD1      LEU 115   5.436  -6.636  -6.636
  908   3HD1  LEU 115          3HD1      LEU 115   6.266  -7.648  -7.648
  909   1HD2  LEU 115          3HD2      LEU 115   4.614  -3.879  -3.879
  910   2HD2  LEU 115          2HD2      LEU 115   3.588  -5.052  -5.052
  911   3HD2  LEU 115          1HD2      LEU 115   5.010  -4.391  -4.391
  912    H    ALA 116           H        ALA 116   6.857  -5.141  -5.141
  913    HA   ALA 116           HA       ALA 116   5.853  -7.545  -7.545
  914   1HB   ALA 116          3HB       ALA 116   4.510  -5.394  -5.394
  915   2HB   ALA 116          2HB       ALA 116   5.641  -4.732  -4.732
  916   3HB   ALA 116          1HB       ALA 116   4.653  -6.131  -6.131
  917    H    LYS 117           H        LYS 117   6.221  -7.377  -7.377
  918    HA   LYS 117           HA       LYS 117   9.129  -7.148  -7.148
  919   1HB   LYS 117          2HB       LYS 117   7.025  -8.904  -8.904
  920   2HB   LYS 117          1HB       LYS 117   8.384  -8.480  -8.480
  921   1HG   LYS 117          2HG       LYS 117   9.194  -9.339  -9.339
  922   2HG   LYS 117          1HG       LYS 117   8.296 -10.569 -10.569
  923   1HD   LYS 117          2HD       LYS 117  10.551 -10.929 -10.929
  924   2HD   LYS 117          1HD       LYS 117   9.866 -10.073 -10.073
  925   1HE   LYS 117          2HE       LYS 117  11.077  -8.195  -8.195
  926   2HE   LYS 117          1HE       LYS 117  11.046  -8.407  -8.407
  927   1HZ   LYS 117          3HZ       LYS 117  12.606 -10.289 -10.289
  928   2HZ   LYS 117          2HZ       LYS 117  13.239  -8.747  -8.747
  929   3HZ   LYS 117          1HZ       LYS 117  12.870  -9.758  -9.758
  930    H    ASP 118           H        ASP 118  10.001  -6.058  -6.058
  931    HA   ASP 118           HA       ASP 118   8.762  -3.699  -3.699
  932   1HB   ASP 118          2HB       ASP 118  10.516  -3.470  -3.470
  933   2HB   ASP 118          1HB       ASP 118  11.191  -4.092  -4.092
  934    H    ASP 119           H        ASP 119   8.586  -6.882  -6.882
  935    HA   ASP 119           HA       ASP 119   7.322  -6.012  -6.012
  936   1HB   ASP 119          2HB       ASP 119   8.715  -8.147  -8.147
  937   2HB   ASP 119          1HB       ASP 119   7.279  -8.818  -8.818
  938    H    GLN 120           H        GLN 120   6.344  -6.817  -6.817
  939    HA   GLN 120           HA       GLN 120   3.575  -7.282  -7.282
  940   1HB   GLN 120          2HB       GLN 120   5.006  -7.137  -7.137
  941   2HB   GLN 120          1HB       GLN 120   3.276  -7.396  -7.396
  942   1HG   GLN 120          2HG       GLN 120   3.768  -9.438  -9.438
  943   2HG   GLN 120          1HG       GLN 120   5.478  -9.199  -9.199
  944   1HE2  GLN 120          2HE2      GLN 120   3.009  -9.969  -9.969
  945   2HE2  GLN 120          1HE2      GLN 120   2.505  -8.916  -8.916
  946    H    LEU 121           H        LEU 121   5.544  -4.620  -4.620
  947    HA   LEU 121           HA       LEU 121   4.053  -2.864  -2.864
  948   1HB   LEU 121          2HB       LEU 121   5.874  -2.442  -2.442
  949   2HB   LEU 121          1HB       LEU 121   5.085  -1.086  -1.086
  950    HG   LEU 121           HG       LEU 121   6.819  -3.046  -3.046
  951   1HD1  LEU 121          3HD1      LEU 121   7.573  -0.469  -0.469
  952   2HD1  LEU 121          2HD1      LEU 121   8.549  -1.238  -1.238
  953   3HD1  LEU 121          1HD1      LEU 121   8.251  -2.075  -2.075
  954   1HD2  LEU 121          2HD2      LEU 121   5.267  -0.654  -0.654
  955   2HD2  LEU 121          1HD2      LEU 121   5.837  -1.966  -1.966
  956   3HD2  LEU 121          3HD2      LEU 121   6.922  -0.643  -0.643
  957    H    LYS 122           H        LYS 122   1.856  -3.124  -3.124
  958    HA   LYS 122           HA       LYS 122   0.830  -2.134  -2.134
  959   1HB   LYS 122          2HB       LYS 122  -0.022  -4.303  -4.303
  960   2HB   LYS 122          1HB       LYS 122  -1.327  -3.302  -3.302
  961   1HG   LYS 122          2HG       LYS 122   0.737  -4.668  -4.668
  962   2HG   LYS 122          1HG       LYS 122  -0.876  -5.301  -5.301
  963   1HD   LYS 122          2HD       LYS 122  -1.898  -3.787  -3.787
  964   2HD   LYS 122          1HD       LYS 122  -0.697  -2.533  -2.533
  965   1HE   LYS 122          2HE       LYS 122   0.890  -3.635  -3.635
  966   2HE   LYS 122          1HE       LYS 122  -0.223  -4.980  -4.980
  967   1HZ   LYS 122          2HZ       LYS 122  -1.704  -2.839  -2.839
  968   2HZ   LYS 122          1HZ       LYS 122  -0.164  -2.394  -2.394
  969   3HZ   LYS 122          3HZ       LYS 122  -0.861  -3.842  -3.842
  970    H    VAL 123           H        VAL 123   1.134   0.041   0.041
  971    HA   VAL 123           HA       VAL 123  -0.505   0.881   0.881
  972    HB   VAL 123           HB       VAL 123   1.788   1.733   1.733
  973   1HG1  VAL 123          2HG1      VAL 123   1.324   1.940   1.940
  974   2HG1  VAL 123          1HG1      VAL 123   1.240   3.623   3.623
  975   3HG1  VAL 123          3HG1      VAL 123   2.684   2.668   2.668
  976   1HG2  VAL 123          1HG2      VAL 123  -0.485   3.681   3.681
  977   2HG2  VAL 123          3HG2      VAL 123   0.386   3.129   3.129
  978   3HG2  VAL 123          2HG2      VAL 123   1.169   4.220   4.220
  979    H    HIS 124           H        HIS 124  -2.405   1.849   1.849
  980    HA   HIS 124           HA       HIS 124  -3.130   3.299   3.299
  981   1HB   HIS 124          2HB       HIS 124  -5.123   1.337   1.337
  982   2HB   HIS 124          1HB       HIS 124  -5.055   2.089   2.089
  983    HD1  HIS 124           HD1      HIS 124  -4.236   0.616   0.616
  984    HD2  HIS 124           HD2      HIS 124  -2.884  -0.612  -0.612
  985    HE1  HIS 124           HE1      HIS 124  -2.990  -1.527  -1.527
  986    HE2  HIS 124           HE2      HIS 124  -2.348  -2.337  -2.337
  987    H    GLY 125           H        GLY 125  -3.147   5.188   5.188
  988   1HA   GLY 125          2HA       GLY 125  -4.180   5.630   5.630
  989   2HA   GLY 125          1HA       GLY 125  -4.250   6.821   6.821
  990    H    PHE 126           HN       PHE 126  -6.157   7.129   7.129
  991    HA   PHE 126           HA       PHE 126  -8.406   5.492   5.492
  992   1HB   PHE 126          2HB       PHE 126  -9.843   6.431   6.431
  993   2HB   PHE 126          1HB       PHE 126  -8.320   6.108   6.108
  994    HD1  PHE 126           HD1      PHE 126  -6.623   8.280   8.280
  995    HD2  PHE 126           HD2      PHE 126 -10.867   8.324   8.324
  996    HE1  PHE 126           HE1      PHE 126  -6.540  10.621  10.621
  997    HE2  PHE 126           HE2      PHE 126 -10.791  10.665  10.665
  998    HZ   PHE 126           HZ       PHE 126  -8.627  11.817  11.817

  Start of MODEL    8
    1   1H    MET   1          3H        MET   1  17.530 -51.027 -51.027
    2   2H    MET   1          2H        MET   1  15.970 -50.799 -50.799
    3   3H    MET   1          1H        MET   1  16.748 -52.322 -52.322
    4    HA   MET   1           HA       MET   1  18.331 -51.519 -51.519
    5   1HB   MET   1          2HB       MET   1  15.947 -51.941 -51.941
    6   2HB   MET   1          1HB       MET   1  15.735 -50.195 -50.195
    7   1HG   MET   1          2HG       MET   1  17.027 -49.899 -49.899
    8   2HG   MET   1          1HG       MET   1  18.066 -51.273 -51.273
    9   1HE   MET   1          1HE       MET   1  14.885 -49.961 -49.961
   10   2HE   MET   1          3HE       MET   1  16.233 -50.152 -50.152
   11   3HE   MET   1          2HE       MET   1  14.775 -51.124 -51.124
   12    H    ARG   2           H        ARG   2  16.150 -48.764 -48.764
   13    HA   ARG   2           HA       ARG   2  18.212 -46.882 -46.882
   14   1HB   ARG   2          2HB       ARG   2  15.815 -46.507 -46.507
   15   2HB   ARG   2          1HB       ARG   2  15.477 -46.364 -46.364
   16   1HG   ARG   2          2HG       ARG   2  15.842 -44.189 -44.189
   17   2HG   ARG   2          1HG       ARG   2  17.547 -44.566 -44.566
   18   1HD   ARG   2          2HD       ARG   2  16.356 -45.013 -45.013
   19   2HD   ARG   2          1HD       ARG   2  15.572 -43.557 -43.557
   20    HE   ARG   2           HE       ARG   2  18.415 -43.470 -43.470
   21   1HH1  ARG   2          2HH1      ARG   2  15.790 -42.979 -42.979
   22   2HH1  ARG   2          1HH1      ARG   2  16.678 -41.871 -41.871
   23   1HH2  ARG   2          1HH2      ARG   2  19.584 -42.011 -42.011
   24   2HH2  ARG   2          2HH2      ARG   2  18.833 -41.321 -41.321
   25    H    GLY   3           H        GLY   3  19.283 -45.458 -45.458
   26   1HA   GLY   3          2HA       GLY   3  19.881 -46.364 -46.364
   27   2HA   GLY   3          1HA       GLY   3  20.371 -44.822 -44.822
   28    H    SER   4           H        SER   4  19.312 -42.986 -42.986
   29    HA   SER   4           HA       SER   4  17.096 -43.306 -43.306
   30   1HB   SER   4          2HB       SER   4  17.859 -41.269 -41.269
   31   2HB   SER   4          1HB       SER   4  19.186 -42.427 -42.427
   32    HG   SER   4           HG       SER   4  20.251 -41.087 -41.087
   33    H    HIS   5           H        HIS   5  15.818 -41.148 -41.148
   34    HA   HIS   5           HA       HIS   5  15.612 -39.439 -39.439
   35   1HB   HIS   5          2HB       HIS   5  14.346 -41.992 -41.992
   36   2HB   HIS   5          1HB       HIS   5  13.105 -40.746 -40.746
   37    HD1  HIS   5           HD1      HIS   5  14.333 -38.480 -38.480
   38    HD2  HIS   5           HD2      HIS   5  14.672 -42.451 -42.451
   39    HE1  HIS   5           HE1      HIS   5  14.802 -38.411 -38.411
   40    HE2  HIS   5           HE2      HIS   5  15.091 -40.822 -40.822
   41    H    HIS   6           H        HIS   6  13.631 -41.088 -41.088
   42    HA   HIS   6           HA       HIS   6  12.226 -40.299 -40.299
   43   1HB   HIS   6          2HB       HIS   6  14.448 -38.574 -38.574
   44   2HB   HIS   6          1HB       HIS   6  13.035 -37.528 -37.528
   45    HD1  HIS   6           HD1      HIS   6  11.682 -37.577 -37.577
   46    HD2  HIS   6           HD2      HIS   6  14.849 -40.266 -40.266
   47    HE1  HIS   6           HE1      HIS   6  11.915 -38.386 -38.386
   48    HE2  HIS   6           HE2      HIS   6  13.893 -39.945 -39.945
   49    H    HIS   7           H        HIS   7  10.197 -40.250 -40.250
   50    HA   HIS   7           HA       HIS   7   9.338 -38.464 -38.464
   51   1HB   HIS   7          2HB       HIS   7   8.324 -40.794 -40.794
   52   2HB   HIS   7          1HB       HIS   7   7.101 -39.534 -39.534
   53    HD1  HIS   7           HD1      HIS   7   6.246 -38.525 -38.525
   54    HD2  HIS   7           HD2      HIS   7   8.582 -41.949 -41.949
   55    HE1  HIS   7           HE1      HIS   7   5.867 -39.401 -39.401
   56    HE2  HIS   7           HE2      HIS   7   7.346 -41.434 -41.434
   57    H    HIS   8           H        HIS   8   9.929 -36.426 -36.426
   58    HA   HIS   8           HA       HIS   8   7.754 -35.137 -35.137
   59   1HB   HIS   8          2HB       HIS   8  10.048 -36.027 -36.027
   60   2HB   HIS   8          1HB       HIS   8   9.427 -34.406 -34.406
   61    HD1  HIS   8           HD1      HIS   8   9.142 -37.427 -37.427
   62    HD2  HIS   8           HD2      HIS   8   6.260 -34.889 -34.889
   63    HE1  HIS   8           HE1      HIS   8   6.997 -38.038 -38.038
   64    HE2  HIS   8           HE2      HIS   8   5.288 -36.425 -36.425
   65    H    HIS   9           H        HIS   9   9.398 -34.823 -34.823
   66    HA   HIS   9           HA       HIS   9  10.671 -32.228 -32.228
   67   1HB   HIS   9          2HB       HIS   9  11.843 -34.400 -34.400
   68   2HB   HIS   9          1HB       HIS   9  11.287 -33.518 -33.518
   69    HD1  HIS   9           HD1      HIS   9  14.277 -33.920 -33.920
   70    HD2  HIS   9           HD2      HIS   9  12.032 -30.489 -30.489
   71    HE1  HIS   9           HE1      HIS   9  15.919 -32.017 -32.017
   72    HE2  HIS   9           HE2      HIS   9  14.525 -29.944 -29.944
   73    H    HIS  10           H        HIS  10   7.810 -33.219 -33.219
   74    HA   HIS  10           HA       HIS  10   6.122 -32.460 -32.460
   75   1HB   HIS  10          2HB       HIS  10   7.416 -30.266 -30.266
   76   2HB   HIS  10          1HB       HIS  10   7.295 -29.857 -29.857
   77    HD1  HIS  10           HD1      HIS  10   5.027 -31.005 -31.005
   78    HD2  HIS  10           HD2      HIS  10   4.887 -28.829 -28.829
   79    HE1  HIS  10           HE1      HIS  10   2.695 -30.072 -30.072
   80    HE2  HIS  10           HE2      HIS  10   2.663 -28.685 -28.685
   81    H    THR  11           H        THR  11   7.463 -34.083 -34.083
   82    HA   THR  11           HA       THR  11   8.840 -33.135 -33.135
   83    HB   THR  11           HB       THR  11   7.793 -35.350 -35.350
   84    HG1  THR  11           HG1      THR  11   7.145 -36.762 -36.762
   85   1HG2  THR  11          3HG2      THR  11  10.142 -34.817 -34.817
   86   2HG2  THR  11          2HG2      THR  11   9.486 -36.058 -36.058
   87   3HG2  THR  11          1HG2      THR  11   9.691 -36.391 -36.391
   88    H    ASP  12           H        ASP  12   8.194 -31.909 -31.909
   89    HA   ASP  12           HA       ASP  12   5.395 -32.090 -32.090
   90   1HB   ASP  12          2HB       ASP  12   5.879 -30.024 -30.024
   91   2HB   ASP  12          1HB       ASP  12   6.945 -29.500 -29.500
   92    HA   PRO  13           HA       PRO  13   8.560 -32.341 -32.341
   93   1HB   PRO  13          2HB       PRO  13   8.311 -34.940 -34.940
   94   2HB   PRO  13          1HB       PRO  13   9.415 -34.392 -34.392
   95   1HG   PRO  13          2HG       PRO  13   6.681 -35.584 -35.584
   96   2HG   PRO  13          1HG       PRO  13   8.143 -35.923 -35.923
   97   1HD   PRO  13          2HD       PRO  13   6.145 -34.276 -34.276
   98   2HD   PRO  13          1HD       PRO  13   7.841 -34.095 -34.095
   99    H    MET  14           H        MET  14   5.268 -32.789 -32.789
  100    HA   MET  14           HA       MET  14   4.455 -33.597 -33.597
  101   1HB   MET  14          2HB       MET  14   2.791 -32.076 -32.076
  102   2HB   MET  14          1HB       MET  14   2.226 -33.141 -33.141
  103   1HG   MET  14          2HG       MET  14   3.985 -34.619 -34.619
  104   2HG   MET  14          1HG       MET  14   2.835 -33.769 -33.769
  105   1HE   MET  14          2HE       MET  14   0.348 -34.186 -34.186
  106   2HE   MET  14          1HE       MET  14  -0.189 -35.852 -35.852
  107   3HE   MET  14          3HE       MET  14   1.200 -35.498 -35.498
  108    H    SER  15           H        SER  15   5.747 -30.706 -30.706
  109    HA   SER  15           HA       SER  15   4.290 -29.046 -29.046
  110   1HB   SER  15          2HB       SER  15   5.360 -28.540 -28.540
  111   2HB   SER  15          1HB       SER  15   6.448 -27.707 -27.707
  112    HG   SER  15           HG       SER  15   4.518 -26.760 -26.760
  113    H    ALA  16           H        ALA  16   5.904 -31.049 -31.049
  114    HA   ALA  16           HA       ALA  16   7.329 -29.623 -29.623
  115   1HB   ALA  16          2HB       ALA  16   8.940 -30.509 -30.509
  116   2HB   ALA  16          1HB       ALA  16   9.654 -30.612 -30.612
  117   3HB   ALA  16          3HB       ALA  16   9.092 -29.059 -29.059
  118    H    ILE  17           H        ILE  17   5.495 -31.760 -31.760
  119    HA   ILE  17           HA       ILE  17   6.986 -34.169 -34.169
  120    HB   ILE  17           HB       ILE  17   3.999 -33.804 -33.804
  121   1HG1  ILE  17          2HG1      ILE  17   5.655 -34.727 -34.727
  122   2HG1  ILE  17          1HG1      ILE  17   4.821 -33.180 -33.180
  123   1HG2  ILE  17          3HG2      ILE  17   5.832 -36.181 -36.181
  124   2HG2  ILE  17          2HG2      ILE  17   4.108 -36.290 -36.290
  125   3HG2  ILE  17          1HG2      ILE  17   4.643 -35.777 -35.777
  126   1HD1  ILE  17          3HD1      ILE  17   3.255 -35.686 -35.686
  127   2HD1  ILE  17          2HD1      ILE  17   3.758 -35.191 -35.191
  128   3HD1  ILE  17          1HD1      ILE  17   2.759 -34.118 -34.118
  129    H    GLN  18           H        GLN  18   6.631 -35.311 -35.311
  130    HA   GLN  18           HA       GLN  18   5.624 -33.702 -33.702
  131   1HB   GLN  18          2HB       GLN  18   7.648 -34.402 -34.402
  132   2HB   GLN  18          1HB       GLN  18   7.940 -33.194 -33.194
  133   1HG   GLN  18          2HG       GLN  18   8.640 -35.139 -35.139
  134   2HG   GLN  18          1HG       GLN  18   8.675 -36.099 -36.099
  135   1HE2  GLN  18          2HE2      GLN  18  11.378 -34.132 -34.132
  136   2HE2  GLN  18          1HE2      GLN  18   9.812 -34.714 -34.714
  137    H    ASN  19           H        ASN  19   4.548 -34.859 -34.859
  138    HA   ASN  19           HA       ASN  19   4.091 -37.656 -37.656
  139   1HB   ASN  19          2HB       ASN  19   2.462 -35.740 -35.740
  140   2HB   ASN  19          1HB       ASN  19   3.013 -36.366 -36.366
  141   1HD2  ASN  19          2HD2      ASN  19   1.585 -39.619 -39.619
  142   2HD2  ASN  19          1HD2      ASN  19   3.045 -38.885 -38.885
  143    H    LEU  20           H        LEU  20   6.534 -37.948 -37.948
  144    HA   LEU  20           HA       LEU  20   8.150 -38.910 -38.910
  145   1HB   LEU  20          2HB       LEU  20   6.086 -40.375 -40.375
  146   2HB   LEU  20          1HB       LEU  20   6.053 -39.538 -39.538
  147    HG   LEU  20           HG       LEU  20   8.371 -40.329 -40.329
  148   1HD1  LEU  20          2HD1      LEU  20   7.918 -41.792 -41.792
  149   2HD1  LEU  20          1HD1      LEU  20   9.148 -42.255 -42.255
  150   3HD1  LEU  20          3HD1      LEU  20   9.220 -40.672 -40.672
  151   1HD2  LEU  20          1HD2      LEU  20   6.183 -42.332 -42.332
  152   2HD2  LEU  20          3HD2      LEU  20   6.643 -41.563 -41.563
  153   3HD2  LEU  20          2HD2      LEU  20   7.708 -42.758 -42.758
  154    H    HIS  21           H        HIS  21   9.022 -36.780 -36.780
  155    HA   HIS  21           HA       HIS  21   9.211 -36.189 -36.189
  156   1HB   HIS  21          2HB       HIS  21   7.928 -34.308 -34.308
  157   2HB   HIS  21          1HB       HIS  21   8.796 -33.683 -33.683
  158    HD1  HIS  21           HD1      HIS  21   5.532 -34.005 -34.005
  159    HD2  HIS  21           HD2      HIS  21   7.687 -35.598 -35.598
  160    HE1  HIS  21           HE1      HIS  21   3.828 -34.533 -34.533
  161    HE2  HIS  21           HE2      HIS  21   5.147 -35.559 -35.559
  162    H    SER  22           H        SER  22  10.757 -34.242 -34.242
  163    HA   SER  22           HA       SER  22  13.020 -34.677 -34.677
  164   1HB   SER  22          2HB       SER  22  14.448 -34.076 -34.076
  165   2HB   SER  22          1HB       SER  22  13.164 -34.988 -34.988
  166    HG   SER  22           HG       SER  22  13.884 -32.384 -32.384
  167    H    PHE  23           H        PHE  23  14.543 -32.538 -32.538
  168    HA   PHE  23           HA       PHE  23  13.185 -30.589 -30.589
  169   1HB   PHE  23          2HB       PHE  23  15.838 -31.317 -31.317
  170   2HB   PHE  23          1HB       PHE  23  15.727 -29.685 -29.685
  171    HD1  PHE  23           HD2      PHE  23  14.259 -31.430 -31.430
  172    HD2  PHE  23           HD1      PHE  23  16.508 -28.131 -28.131
  173    HE1  PHE  23           HE2      PHE  23  14.415 -30.524 -30.524
  174    HE2  PHE  23           HE1      PHE  23  16.669 -27.219 -27.219
  175    HZ   PHE  23           HZ       PHE  23  15.622 -28.417 -28.417
  176    H    ASP  24           H        ASP  24  12.722 -28.432 -28.432
  177    HA   ASP  24           HA       ASP  24  12.825 -27.681 -27.681
  178   1HB   ASP  24          2HB       ASP  24  10.426 -27.571 -27.571
  179   2HB   ASP  24          1HB       ASP  24  10.530 -26.633 -26.633
  180    HA   PRO  25           HA       PRO  25  14.540 -24.401 -24.401
  181   1HB   PRO  25          2HB       PRO  25  16.473 -24.202 -24.202
  182   2HB   PRO  25          1HB       PRO  25  16.768 -24.273 -24.273
  183   1HG   PRO  25          2HG       PRO  25  17.293 -26.366 -26.366
  184   2HG   PRO  25          1HG       PRO  25  16.645 -26.584 -26.584
  185   1HD   PRO  25          2HD       PRO  25  15.237 -26.754 -26.754
  186   2HD   PRO  25          1HD       PRO  25  15.041 -27.761 -27.761
  187    H    PHE  26           H        PHE  26  13.914 -24.539 -24.539
  188    HA   PHE  26           HA       PHE  26  13.037 -21.732 -21.732
  189   1HB   PHE  26          2HB       PHE  26  14.111 -22.826 -22.826
  190   2HB   PHE  26          1HB       PHE  26  14.088 -21.167 -21.167
  191    HD1  PHE  26           HD2      PHE  26  15.835 -24.391 -24.391
  192    HD2  PHE  26           HD1      PHE  26  15.867 -20.303 -20.303
  193    HE1  PHE  26           HE2      PHE  26  18.184 -24.615 -24.615
  194    HE2  PHE  26           HE1      PHE  26  18.217 -20.521 -20.521
  195    HZ   PHE  26           HZ       PHE  26  19.378 -22.678 -22.678
  196    H    ALA  27           H        ALA  27  11.201 -23.569 -23.569
  197    HA   ALA  27           HA       ALA  27   9.493 -23.453 -23.453
  198   1HB   ALA  27          3HB       ALA  27  10.842 -25.830 -25.830
  199   2HB   ALA  27          2HB       ALA  27   9.158 -26.062 -26.062
  200   3HB   ALA  27          1HB       ALA  27   9.556 -25.609 -25.609
  201    H    ASP  28           H        ASP  28   7.947 -22.219 -22.219
  202    HA   ASP  28           HA       ASP  28   6.889 -22.984 -22.984
  203   1HB   ASP  28          2HB       ASP  28   6.982 -20.421 -20.421
  204   2HB   ASP  28          1HB       ASP  28   5.667 -20.669 -20.669
  205    H    ALA  29           H        ALA  29   5.932 -24.831 -24.831
  206    HA   ALA  29           HA       ALA  29   3.174 -24.121 -24.121
  207   1HB   ALA  29          2HB       ALA  29   4.739 -24.148 -24.148
  208   2HB   ALA  29          1HB       ALA  29   4.479 -25.888 -25.888
  209   3HB   ALA  29          3HB       ALA  29   3.101 -24.800 -24.800
  210    H    SER  30           H        SER  30   4.057 -25.432 -25.432
  211    HA   SER  30           HA       SER  30   3.992 -28.279 -28.279
  212   1HB   SER  30          2HB       SER  30   4.121 -26.406 -26.406
  213   2HB   SER  30          1HB       SER  30   3.620 -28.072 -28.072
  214    HG   SER  30           HG       SER  30   5.629 -28.623 -28.623
  215    H    LYS  31           H        LYS  31   2.012 -28.535 -28.535
  216    HA   LYS  31           HA       LYS  31  -0.489 -27.764 -27.764
  217   1HB   LYS  31          2HB       LYS  31   0.367 -29.346 -29.346
  218   2HB   LYS  31          1HB       LYS  31  -1.285 -29.528 -29.528
  219   1HG   LYS  31          2HG       LYS  31  -0.398 -26.749 -26.749
  220   2HG   LYS  31          1HG       LYS  31  -0.442 -27.652 -27.652
  221   1HD   LYS  31          2HD       LYS  31  -2.783 -28.026 -28.026
  222   2HD   LYS  31          1HD       LYS  31  -2.578 -26.391 -26.391
  223   1HE   LYS  31          2HE       LYS  31  -2.348 -28.745 -28.745
  224   2HE   LYS  31          1HE       LYS  31  -3.939 -28.144 -28.144
  225   1HZ   LYS  31          2HZ       LYS  31  -2.583 -25.898 -25.898
  226   2HZ   LYS  31          1HZ       LYS  31  -2.040 -27.038 -27.038
  227   3HZ   LYS  31          3HZ       LYS  31  -3.695 -26.728 -26.728
  228    H    GLY  32           H        GLY  32  -1.993 -29.016 -29.016
  229   1HA   GLY  32          2HA       GLY  32  -2.429 -31.577 -31.577
  230   2HA   GLY  32          1HA       GLY  32  -0.908 -31.437 -31.437
  231    H    ASP  33           H        ASP  33  -1.501 -31.715 -31.715
  232    HA   ASP  33           HA       ASP  33  -3.876 -30.423 -30.423
  233   1HB   ASP  33          2HB       ASP  33  -1.799 -32.089 -32.089
  234   2HB   ASP  33          1HB       ASP  33  -3.374 -31.614 -31.614
  235    H    ASP  34           H        ASP  34  -2.628 -28.339 -28.339
  236    HA   ASP  34           HA       ASP  34  -1.790 -27.045 -27.045
  237   1HB   ASP  34          2HB       ASP  34   0.327 -28.082 -28.082
  238   2HB   ASP  34          1HB       ASP  34   0.170 -27.188 -27.188
  239    H    LEU  35           H        LEU  35  -2.997 -25.273 -25.273
  240    HA   LEU  35           HA       LEU  35  -4.076 -24.162 -24.162
  241   1HB   LEU  35          2HB       LEU  35  -3.858 -23.265 -23.265
  242   2HB   LEU  35          1HB       LEU  35  -4.400 -22.124 -22.124
  243    HG   LEU  35           HG       LEU  35  -5.717 -24.767 -24.767
  244   1HD1  LEU  35          1HD1      LEU  35  -6.139 -21.990 -21.990
  245   2HD1  LEU  35          3HD1      LEU  35  -7.572 -22.951 -22.951
  246   3HD1  LEU  35          2HD1      LEU  35  -6.404 -23.524 -23.524
  247   1HD2  LEU  35          3HD2      LEU  35  -6.267 -22.637 -22.637
  248   2HD2  LEU  35          2HD2      LEU  35  -6.167 -24.384 -24.384
  249   3HD2  LEU  35          1HD2      LEU  35  -7.555 -23.678 -23.678
  250    H    LEU  36           H        LEU  36  -3.749 -21.848 -21.848
  251    HA   LEU  36           HA       LEU  36  -1.101 -21.469 -21.469
  252   1HB   LEU  36          2HB       LEU  36  -3.593 -19.832 -19.832
  253   2HB   LEU  36          1HB       LEU  36  -2.071 -19.046 -19.046
  254    HG   LEU  36           HG       LEU  36  -2.684 -21.569 -21.569
  255   1HD1  LEU  36          3HD1      LEU  36  -4.150 -18.982 -18.982
  256   2HD1  LEU  36          2HD1      LEU  36  -3.910 -20.127 -20.127
  257   3HD1  LEU  36          1HD1      LEU  36  -4.802 -20.616 -20.616
  258   1HD2  LEU  36          2HD2      LEU  36  -1.449 -18.935 -18.935
  259   2HD2  LEU  36          1HD2      LEU  36  -0.580 -20.410 -20.410
  260   3HD2  LEU  36          3HD2      LEU  36  -1.577 -20.359 -20.359
  261    HA   PRO  37           HA       PRO  37   1.007 -19.548 -19.548
  262   1HB   PRO  37          2HB       PRO  37   2.044 -17.621 -17.621
  263   2HB   PRO  37          1HB       PRO  37   2.927 -18.642 -18.642
  264   1HG   PRO  37          2HG       PRO  37   2.840 -19.258 -19.258
  265   2HG   PRO  37          1HG       PRO  37   2.758 -20.522 -20.522
  266   1HD   PRO  37          2HD       PRO  37   0.574 -19.369 -19.369
  267   2HD   PRO  37          1HD       PRO  37   0.819 -21.041 -21.041
  268    H    ALA  38           H        ALA  38  -0.106 -18.348 -18.348
  269    HA   ALA  38           HA       ALA  38  -1.830 -16.215 -16.215
  270   1HB   ALA  38          2HB       ALA  38  -0.832 -17.032 -17.032
  271   2HB   ALA  38          1HB       ALA  38  -2.125 -15.873 -15.873
  272   3HB   ALA  38          3HB       ALA  38  -2.325 -17.562 -17.562
  273    H    GLY  39           H        GLY  39  -1.441 -14.092 -14.092
  274   1HA   GLY  39          2HA       GLY  39   1.289 -13.165 -13.165
  275   2HA   GLY  39          1HA       GLY  39   0.104 -12.359 -12.359
  276    H    THR  40           H        THR  40  -0.158 -13.527 -13.527
  277    HA   THR  40           HA       THR  40  -0.886 -10.786 -10.786
  278    HB   THR  40           HB       THR  40  -1.836 -12.110 -12.110
  279    HG1  THR  40           HG1      THR  40  -1.872 -14.184 -14.184
  280   1HG2  THR  40          1HG2      THR  40  -3.236 -10.902 -10.902
  281   2HG2  THR  40          3HG2      THR  40  -3.225 -12.326 -12.326
  282   3HG2  THR  40          2HG2      THR  40  -3.973 -12.406 -12.406
  283    H    GLU  41           H        GLU  41   1.045 -13.600 -13.600
  284    HA   GLU  41           HA       GLU  41   2.780 -13.894 -13.894
  285   1HB   GLU  41          2HB       GLU  41   3.195 -11.414 -11.414
  286   2HB   GLU  41          1HB       GLU  41   3.887 -11.319 -11.319
  287   1HG   GLU  41          2HG       GLU  41   5.609 -12.571 -12.571
  288   2HG   GLU  41          1HG       GLU  41   4.547 -13.833 -13.833
  289    H    ASP  42           H        ASP  42   0.149 -12.890 -12.890
  290    HA   ASP  42           HA       ASP  42  -0.771 -12.114 -12.114
  291   1HB   ASP  42          2HB       ASP  42   0.685 -14.243 -14.243
  292   2HB   ASP  42          1HB       ASP  42   1.648 -13.080 -13.080
  293    H    TYR  43           H        TYR  43  -0.033  -9.931  -9.931
  294    HA   TYR  43           HA       TYR  43   2.093  -8.510  -8.510
  295   1HB   TYR  43          2HB       TYR  43  -0.386  -7.414  -7.414
  296   2HB   TYR  43          1HB       TYR  43   1.096  -6.522  -6.522
  297    HD1  TYR  43           HD2      TYR  43   2.926  -8.947  -8.947
  298    HD2  TYR  43           HD1      TYR  43  -0.339  -6.976  -6.976
  299    HE1  TYR  43           HE2      TYR  43   3.803  -9.606  -9.606
  300    HE2  TYR  43           HE1      TYR  43   0.531  -7.637  -7.637
  301    HH   TYR  43           HH       TYR  43   2.753  -9.990  -9.990
  302    H    ILE  44           H        ILE  44   1.539  -6.319  -6.319
  303    HA   ILE  44           HA       ILE  44  -0.340  -6.921  -6.921
  304    HB   ILE  44           HB       ILE  44   2.146  -5.206  -5.206
  305   1HG1  ILE  44          2HG1      ILE  44   2.859  -7.456  -7.456
  306   2HG1  ILE  44          1HG1      ILE  44   2.834  -6.973  -6.973
  307   1HG2  ILE  44          3HG2      ILE  44  -0.018  -5.736  -5.736
  308   2HG2  ILE  44          2HG2      ILE  44   1.614  -5.307  -5.307
  309   3HG2  ILE  44          1HG2      ILE  44   0.686  -4.196  -4.196
  310   1HD1  ILE  44          3HD1      ILE  44   0.510  -8.016  -8.016
  311   2HD1  ILE  44          2HD1      ILE  44   0.935  -8.766  -8.766
  312   3HD1  ILE  44          1HD1      ILE  44   1.896  -9.102  -9.102
  313    H    HIS  45           H        HIS  45  -2.165  -5.937  -5.937
  314    HA   HIS  45           HA       HIS  45  -2.236  -3.424  -3.424
  315   1HB   HIS  45          2HB       HIS  45  -4.067  -5.494  -5.494
  316   2HB   HIS  45          1HB       HIS  45  -4.737  -3.987  -3.987
  317    HD1  HIS  45           HD1      HIS  45  -3.586  -5.588  -5.588
  318    HD2  HIS  45           HD2      HIS  45  -5.766  -2.300  -2.300
  319    HE1  HIS  45           HE1      HIS  45  -4.630  -4.614  -4.614
  320    HE2  HIS  45           HE2      HIS  45  -6.025  -2.684  -2.684
  321    H    ILE  46           H        ILE  46  -2.332  -1.428  -1.428
  322    HA   ILE  46           HA       ILE  46  -2.245  -1.018  -1.018
  323    HB   ILE  46           HB       ILE  46  -1.802   0.957   0.957
  324   1HG1  ILE  46          2HG1      ILE  46  -0.128  -0.886  -0.886
  325   2HG1  ILE  46          1HG1      ILE  46   0.552   0.712   0.712
  326   1HG2  ILE  46          1HG2      ILE  46  -1.522   1.214   1.214
  327   2HG2  ILE  46          3HG2      ILE  46  -0.745   2.316   2.316
  328   3HG2  ILE  46          2HG2      ILE  46  -2.504   2.193   2.193
  329   1HD1  ILE  46          1HD1      ILE  46   0.086   0.103   0.103
  330   2HD1  ILE  46          3HD1      ILE  46   0.130  -1.546  -1.546
  331   3HD1  ILE  46          2HD1      ILE  46   1.527  -0.487  -0.487
  332    H    ARG  47           H        ARG  47  -3.536   1.561   1.561
  333    HA   ARG  47           HA       ARG  47  -5.702   2.246   2.246
  334   1HB   ARG  47          2HB       ARG  47  -6.400  -0.183  -0.183
  335   2HB   ARG  47          1HB       ARG  47  -6.755   0.407   0.407
  336   1HG   ARG  47          2HG       ARG  47  -8.762   0.389   0.389
  337   2HG   ARG  47          1HG       ARG  47  -8.307   2.052   2.052
  338   1HD   ARG  47          2HD       ARG  47  -7.544   2.458   2.458
  339   2HD   ARG  47          1HD       ARG  47  -7.465   0.740   0.740
  340    HE   ARG  47           HE       ARG  47  -9.746   2.452   2.452
  341   1HH1  ARG  47          2HH1      ARG  47  -8.732  -0.843  -0.843
  342   2HH1  ARG  47          1HH1      ARG  47 -10.216  -1.526  -1.526
  343   1HH2  ARG  47          1HH2      ARG  47 -11.698   1.555   1.555
  344   2HH2  ARG  47          2HH2      ARG  47 -11.900  -0.166  -0.166
  345    H    ILE  48           H        ILE  48  -6.443   4.074   4.074
  346    HA   ILE  48           HA       ILE  48  -5.904   4.832   4.832
  347    HB   ILE  48           HB       ILE  48  -5.504   6.191   6.191
  348   1HG1  ILE  48          2HG1      ILE  48  -4.993   6.952   6.952
  349   2HG1  ILE  48          1HG1      ILE  48  -3.862   6.207   6.207
  350   1HG2  ILE  48          1HG2      ILE  48  -7.761   7.098   7.098
  351   2HG2  ILE  48          3HG2      ILE  48  -7.293   7.719   7.719
  352   3HG2  ILE  48          2HG2      ILE  48  -6.520   8.345   8.345
  353   1HD1  ILE  48          2HD1      ILE  48  -4.828   8.640   8.640
  354   2HD1  ILE  48          1HD1      ILE  48  -4.261   8.945   8.945
  355   3HD1  ILE  48          3HD1      ILE  48  -3.179   8.200   8.200
  356    H    GLN  49           H        GLN  49  -7.541   6.417   6.417
  357    HA   GLN  49           HA       GLN  49 -10.175   6.338   6.338
  358   1HB   GLN  49          2HB       GLN  49 -11.305   5.153   5.153
  359   2HB   GLN  49          1HB       GLN  49 -10.000   4.129   4.129
  360   1HG   GLN  49          2HG       GLN  49  -8.673   5.181   5.181
  361   2HG   GLN  49          1HG       GLN  49 -10.278   5.558   5.558
  362   1HE2  GLN  49          2HE2      GLN  49 -11.171   2.182   2.182
  363   2HE2  GLN  49          1HE2      GLN  49 -11.796   3.733   3.733
  364    H    GLN  50           H        GLN  50 -10.311   8.500   8.500
  365    HA   GLN  50           HA       GLN  50  -9.827   9.883   9.883
  366   1HB   GLN  50          2HB       GLN  50  -9.041  10.549  10.549
  367   2HB   GLN  50          1HB       GLN  50 -10.556  11.437  11.437
  368   1HG   GLN  50          2HG       GLN  50  -9.807  12.753  12.753
  369   2HG   GLN  50          1HG       GLN  50  -8.479  11.654  11.654
  370   1HE2  GLN  50          2HE2      GLN  50  -6.445  13.967  13.967
  371   2HE2  GLN  50          1HE2      GLN  50  -6.927  13.249  13.249
  372    H    ARG  51           H        ARG  51 -11.664   9.438   9.438
  373    HA   ARG  51           HA       ARG  51 -14.287   9.395   9.395
  374   1HB   ARG  51          2HB       ARG  51 -12.932   9.515   9.515
  375   2HB   ARG  51          1HB       ARG  51 -14.384  10.505  10.505
  376   1HG   ARG  51          2HG       ARG  51 -15.461   8.622   8.622
  377   2HG   ARG  51          1HG       ARG  51 -15.258   8.208   8.208
  378   1HD   ARG  51          2HD       ARG  51 -13.731   6.620   6.620
  379   2HD   ARG  51          1HD       ARG  51 -12.939   7.591   7.591
  380    HE   ARG  51           HE       ARG  51 -15.302   6.816   6.816
  381   1HH1  ARG  51          2HH1      ARG  51 -12.589   5.153   5.153
  382   2HH1  ARG  51          1HH1      ARG  51 -12.775   3.740   3.740
  383   1HH2  ARG  51          1HH2      ARG  51 -15.547   4.960   4.960
  384   2HH2  ARG  51          2HH2      ARG  51 -14.454   3.630   3.630
  385    H    ASN  52           H        ASN  52 -12.589  12.126  12.126
  386    HA   ASN  52           HA       ASN  52 -14.591  13.943  13.943
  387   1HB   ASN  52          2HB       ASN  52 -12.554  14.812  14.812
  388   2HB   ASN  52          1HB       ASN  52 -14.172  15.440  15.440
  389   1HD2  ASN  52          2HD2      ASN  52 -13.667  13.054  13.054
  390   2HD2  ASN  52          1HD2      ASN  52 -12.506  14.102  14.102
  391    H    GLY  53           H        GLY  53 -12.715  16.233  16.233
  392   1HA   GLY  53          2HA       GLY  53 -11.305  15.906  15.906
  393   2HA   GLY  53          1HA       GLY  53 -11.572  17.419  17.419
  394    H    ARG  54           H        ARG  54 -10.232  14.452  14.452
  395    HA   ARG  54           HA       ARG  54  -7.531  14.951  14.951
  396   1HB   ARG  54          2HB       ARG  54  -7.053  15.868  15.868
  397   2HB   ARG  54          1HB       ARG  54  -7.678  17.008  17.008
  398   1HG   ARG  54          2HG       ARG  54  -9.991  16.370  16.370
  399   2HG   ARG  54          1HG       ARG  54  -9.013  15.843  15.843
  400   1HD   ARG  54          2HD       ARG  54  -9.117  17.968  17.968
  401   2HD   ARG  54          1HD       ARG  54  -7.946  18.301  18.301
  402    HE   ARG  54           HE       ARG  54  -9.584  19.384  19.384
  403   1HH1  ARG  54          2HH1      ARG  54 -11.073  17.476  17.476
  404   2HH1  ARG  54          1HH1      ARG  54 -12.652  18.136  18.136
  405   1HH2  ARG  54          1HH2      ARG  54 -11.660  20.257  20.257
  406   2HH2  ARG  54          2HH2      ARG  54 -12.986  19.715  19.715
  407    H    LYS  55           H        LYS  55 -10.131  13.728  13.728
  408    HA   LYS  55           HA       LYS  55  -8.613  12.028  12.028
  409   1HB   LYS  55          2HB       LYS  55 -11.422  12.498  12.498
  410   2HB   LYS  55          1HB       LYS  55 -11.091  10.792  10.792
  411   1HG   LYS  55          2HG       LYS  55 -11.758  12.018  12.018
  412   2HG   LYS  55          1HG       LYS  55 -10.181  11.238  11.238
  413   1HD   LYS  55          2HD       LYS  55  -9.977  13.947  13.947
  414   2HD   LYS  55          1HD       LYS  55 -10.767  13.893  13.893
  415   1HE   LYS  55          2HE       LYS  55  -8.913  12.965  12.965
  416   2HE   LYS  55          1HE       LYS  55  -8.246  12.356  12.356
  417   1HZ   LYS  55          3HZ       LYS  55  -8.104  14.890  14.890
  418   2HZ   LYS  55          2HZ       LYS  55  -8.111  15.055  15.055
  419   3HZ   LYS  55          1HZ       LYS  55  -6.902  14.144  14.144
  420    H    THR  56           H        THR  56  -7.148  11.376  11.376
  421    HA   THR  56           HA       THR  56  -8.171   9.265   9.265
  422    HB   THR  56           HB       THR  56  -5.263   9.804   9.804
  423    HG1  THR  56           HG1      THR  56  -5.364  11.810  11.810
  424   1HG2  THR  56          3HG2      THR  56  -7.254   9.076   9.076
  425   2HG2  THR  56          2HG2      THR  56  -5.988  10.180  10.180
  426   3HG2  THR  56          1HG2      THR  56  -5.559   8.616   8.616
  427    H    LEU  57           H        LEU  57  -7.423   7.119   7.119
  428    HA   LEU  57           HA       LEU  57  -5.820   6.265   6.265
  429   1HB   LEU  57          2HB       LEU  57  -8.691   5.853   5.853
  430   2HB   LEU  57          1HB       LEU  57  -7.818   4.346   4.346
  431    HG   LEU  57           HG       LEU  57  -6.750   5.382   5.382
  432   1HD1  LEU  57          1HD1      LEU  57  -8.466   7.590   7.590
  433   2HD1  LEU  57          3HD1      LEU  57  -8.584   7.198   7.198
  434   3HD1  LEU  57          2HD1      LEU  57  -7.020   7.602   7.602
  435   1HD2  LEU  57          2HD2      LEU  57  -9.584   4.580   4.580
  436   2HD2  LEU  57          1HD2      LEU  57  -8.292   3.838   3.838
  437   3HD2  LEU  57          3HD2      LEU  57  -9.109   5.279   5.279
  438    H    THR  58           H        THR  58  -4.236   5.740   5.740
  439    HA   THR  58           HA       THR  58  -4.705   4.116   4.116
  440    HB   THR  58           HB       THR  58  -2.098   4.187   4.187
  441    HG1  THR  58           HG1      THR  58  -3.320   6.220   6.220
  442   1HG2  THR  58          1HG2      THR  58  -2.267   2.792   2.792
  443   2HG2  THR  58          3HG2      THR  58  -2.634   4.257   4.257
  444   3HG2  THR  58          2HG2      THR  58  -1.075   4.088   4.088
  445    H    THR  59           H        THR  59  -5.177   2.018   2.018
  446    HA   THR  59           HA       THR  59  -4.738   0.329   0.329
  447    HB   THR  59           HB       THR  59  -6.180  -1.212  -1.212
  448    HG1  THR  59           HG1      THR  59  -7.145   1.442   1.442
  449   1HG2  THR  59          3HG2      THR  59  -6.617   0.001   0.001
  450   2HG2  THR  59          2HG2      THR  59  -8.000   0.439   0.439
  451   3HG2  THR  59          1HG2      THR  59  -7.581  -1.259  -1.259
  452    H    VAL  60           H        VAL  60  -4.213  -2.001  -2.001
  453    HA   VAL  60           HA       VAL  60  -2.410  -2.316  -2.316
  454    HB   VAL  60           HB       VAL  60  -1.669  -3.083  -3.083
  455   1HG1  VAL  60          2HG1      VAL  60  -0.825  -4.585  -4.585
  456   2HG1  VAL  60          1HG1      VAL  60   0.009  -3.196  -3.196
  457   3HG1  VAL  60          3HG1      VAL  60   0.446  -3.773  -3.773
  458   1HG2  VAL  60          3HG2      VAL  60  -1.004  -0.732  -0.732
  459   2HG2  VAL  60          2HG2      VAL  60  -1.332  -0.813  -0.813
  460   3HG2  VAL  60          1HG2      VAL  60   0.220  -1.364  -1.364
  461    H    GLN  61           H        GLN  61  -3.122  -4.009  -4.009
  462    HA   GLN  61           HA       GLN  61  -4.205  -6.308  -6.308
  463   1HB   GLN  61          2HB       GLN  61  -4.991  -6.340  -6.340
  464   2HB   GLN  61          1HB       GLN  61  -5.999  -6.345  -6.345
  465   1HG   GLN  61          2HG       GLN  61  -5.704  -3.849  -3.849
  466   2HG   GLN  61          1HG       GLN  61  -4.957  -3.968  -3.968
  467   1HE2  GLN  61          2HE2      GLN  61  -8.264  -5.429  -5.429
  468   2HE2  GLN  61          1HE2      GLN  61  -6.738  -6.165  -6.165
  469    H    GLY  62           H        GLY  62  -3.494  -8.338  -8.338
  470   1HA   GLY  62          2HA       GLY  62  -2.432  -9.855  -9.855
  471   2HA   GLY  62          1HA       GLY  62  -1.379  -8.520  -8.520
  472    H    ILE  63           H        ILE  63  -1.034  -7.673  -7.673
  473    HA   ILE  63           HA       ILE  63   1.303  -9.092  -9.092
  474    HB   ILE  63           HB       ILE  63  -0.396  -7.230  -7.230
  475   1HG1  ILE  63          2HG1      ILE  63   0.631  -5.890  -5.890
  476   2HG1  ILE  63          1HG1      ILE  63   1.867  -5.893  -5.893
  477   1HG2  ILE  63          3HG2      ILE  63   1.808  -8.925  -8.925
  478   2HG2  ILE  63          2HG2      ILE  63   2.034  -7.218  -7.218
  479   3HG2  ILE  63          1HG2      ILE  63   0.595  -8.063  -8.063
  480   1HD1  ILE  63          2HD1      ILE  63   2.877  -7.860  -7.860
  481   2HD1  ILE  63          1HD1      ILE  63   1.837  -7.321  -7.321
  482   3HD1  ILE  63          3HD1      ILE  63   3.053  -6.232  -6.232
  483    H    ALA  64           H        ALA  64   1.800 -10.600 -10.600
  484    HA   ALA  64           HA       ALA  64  -0.305 -12.468 -12.468
  485   1HB   ALA  64          1HB       ALA  64   2.215 -12.897 -12.897
  486   2HB   ALA  64          3HB       ALA  64   2.432 -12.765 -12.765
  487   3HB   ALA  64          2HB       ALA  64   1.344 -13.985 -13.985
  488    H    ASP  65           H        ASP  65  -0.975 -13.134 -13.134
  489    HA   ASP  65           HA       ASP  65  -1.102 -11.049 -11.049
  490   1HB   ASP  65          2HB       ASP  65  -2.454 -12.638 -12.638
  491   2HB   ASP  65          1HB       ASP  65  -2.996 -12.556 -12.556
  492    H    ASP  66           H        ASP  66   1.245 -13.332 -13.332
  493    HA   ASP  66           HA       ASP  66   2.054 -13.682 -13.682
  494   1HB   ASP  66          2HB       ASP  66   2.078 -15.609 -15.609
  495   2HB   ASP  66          1HB       ASP  66   3.362 -14.790 -14.790
  496    H    TYR  67           H        TYR  67   2.231 -11.075 -11.075
  497    HA   TYR  67           HA       TYR  67   5.098 -10.657 -10.657
  498   1HB   TYR  67          2HB       TYR  67   2.682  -8.974  -8.974
  499   2HB   TYR  67          1HB       TYR  67   4.287  -8.258  -8.258
  500    HD1  TYR  67           HD1      TYR  67   4.089 -11.666 -11.666
  501    HD2  TYR  67           HD2      TYR  67   3.916  -7.570  -7.570
  502    HE1  TYR  67           HE1      TYR  67   4.473 -12.297 -12.297
  503    HE2  TYR  67           HE2      TYR  67   4.296  -8.181  -8.181
  504    HH   TYR  67           HH       TYR  67   5.560 -10.558 -10.558
  505    H    ASP  68           H        ASP  68   3.656 -11.184 -11.184
  506    HA   ASP  68           HA       ASP  68   4.102 -10.627 -10.627
  507   1HB   ASP  68          2HB       ASP  68   6.224  -9.562  -9.562
  508   2HB   ASP  68          1HB       ASP  68   5.404  -8.048  -8.048
  509    H    LYS  69           H        LYS  69   2.466  -8.615  -8.615
  510    HA   LYS  69           HA       LYS  69   0.702  -7.206  -7.206
  511   1HB   LYS  69          2HB       LYS  69  -0.266  -8.947  -8.947
  512   2HB   LYS  69          1HB       LYS  69   0.609  -8.357  -8.357
  513   1HG   LYS  69          2HG       LYS  69  -0.672  -6.306  -6.306
  514   2HG   LYS  69          1HG       LYS  69  -1.502  -6.814  -6.814
  515   1HD   LYS  69          2HD       LYS  69  -2.065  -8.927  -8.927
  516   2HD   LYS  69          1HD       LYS  69  -1.842  -7.748  -7.748
  517   1HE   LYS  69          2HE       LYS  69  -3.782  -6.740  -6.740
  518   2HE   LYS  69          1HE       LYS  69  -3.456  -6.713  -6.713
  519   1HZ   LYS  69          2HZ       LYS  69  -4.276  -9.212  -9.212
  520   2HZ   LYS  69          1HZ       LYS  69  -5.433  -8.074  -8.074
  521   3HZ   LYS  69          3HZ       LYS  69  -4.418  -8.780  -8.780
  522    H    LYS  70           H        LYS  70   1.890  -6.978  -6.978
  523    HA   LYS  70           HA       LYS  70   1.662  -4.234  -4.234
  524   1HB   LYS  70          2HB       LYS  70   3.338  -6.279  -6.279
  525   2HB   LYS  70          1HB       LYS  70   3.575  -4.573  -4.573
  526   1HG   LYS  70          2HG       LYS  70   0.856  -4.833  -4.833
  527   2HG   LYS  70          1HG       LYS  70   1.429  -6.375  -6.375
  528   1HD   LYS  70          2HD       LYS  70   2.632  -3.796  -3.796
  529   2HD   LYS  70          1HD       LYS  70   1.116  -4.381  -4.381
  530   1HE   LYS  70          2HE       LYS  70   3.114  -6.474  -6.474
  531   2HE   LYS  70          1HE       LYS  70   3.687  -5.083  -5.083
  532   1HZ   LYS  70          2HZ       LYS  70   1.661  -5.213  -5.213
  533   2HZ   LYS  70          1HZ       LYS  70   1.168  -6.582  -6.582
  534   3HZ   LYS  70          3HZ       LYS  70   2.563  -6.640  -6.640
  535    H    LYS  71           H        LYS  71   4.700  -6.022  -6.022
  536    HA   LYS  71           HA       LYS  71   6.349  -3.840  -3.840
  537   1HB   LYS  71          2HB       LYS  71   6.502  -6.666  -6.666
  538   2HB   LYS  71          1HB       LYS  71   7.175  -5.888  -5.888
  539   1HG   LYS  71          2HG       LYS  71   8.762  -4.685  -4.685
  540   2HG   LYS  71          1HG       LYS  71   8.004  -5.235  -5.235
  541   1HD   LYS  71          2HD       LYS  71   9.693  -6.753  -6.753
  542   2HD   LYS  71          1HD       LYS  71   8.515  -7.612  -7.612
  543   1HE   LYS  71          2HE       LYS  71   9.542  -6.683  -6.683
  544   2HE   LYS  71          1HE       LYS  71  10.714  -5.819  -5.819
  545   1HZ   LYS  71          3HZ       LYS  71  10.509  -8.709  -8.709
  546   2HZ   LYS  71          2HZ       LYS  71  11.236  -8.163  -8.163
  547   3HZ   LYS  71          1HZ       LYS  71  11.868  -7.703  -7.703
  548    H    LEU  72           H        LEU  72   3.917  -5.138  -5.138
  549    HA   LEU  72           HA       LEU  72   4.883  -4.131  -4.131
  550   1HB   LEU  72          2HB       LEU  72   2.955  -5.827  -5.827
  551   2HB   LEU  72          1HB       LEU  72   1.958  -4.384  -4.384
  552    HG   LEU  72           HG       LEU  72   3.563  -5.506  -5.506
  553   1HD1  LEU  72          3HD1      LEU  72   0.681  -5.361  -5.361
  554   2HD1  LEU  72          2HD1      LEU  72   1.134  -5.246  -5.246
  555   3HD1  LEU  72          1HD1      LEU  72   1.595  -6.665  -6.665
  556   1HD2  LEU  72          2HD2      LEU  72   2.243  -2.834  -2.834
  557   2HD2  LEU  72          1HD2      LEU  72   3.861  -3.202  -3.202
  558   3HD2  LEU  72          3HD2      LEU  72   2.451  -3.562  -3.562
  559    H    VAL  73           H        VAL  73   2.294  -2.867  -2.867
  560    HA   VAL  73           HA       VAL  73   2.385  -0.319  -0.319
  561    HB   VAL  73           HB       VAL  73   0.606   0.295   0.295
  562   1HG1  VAL  73          1HG1      VAL  73   0.183  -1.796  -1.796
  563   2HG1  VAL  73          3HG1      VAL  73  -1.140  -0.998  -0.998
  564   3HG1  VAL  73          2HG1      VAL  73  -0.028  -0.052  -0.052
  565   1HG2  VAL  73          1HG2      VAL  73   1.279  -1.740  -1.740
  566   2HG2  VAL  73          3HG2      VAL  73  -0.442  -1.404  -1.404
  567   3HG2  VAL  73          2HG2      VAL  73   0.324  -2.680  -2.680
  568    H    LYS  74           H        LYS  74   3.468  -1.700  -1.700
  569    HA   LYS  74           HA       LYS  74   3.838   0.570   0.570
  570   1HB   LYS  74          2HB       LYS  74   4.144  -1.773  -1.773
  571   2HB   LYS  74          1HB       LYS  74   5.659  -1.839  -1.839
  572   1HG   LYS  74          2HG       LYS  74   6.544  -1.263  -1.263
  573   2HG   LYS  74          1HG       LYS  74   6.077   0.367   0.367
  574   1HD   LYS  74          2HD       LYS  74   3.772  -0.512  -0.512
  575   2HD   LYS  74          1HD       LYS  74   4.966  -1.376  -1.376
  576   1HE   LYS  74          2HE       LYS  74   5.759   1.367   1.367
  577   2HE   LYS  74          1HE       LYS  74   4.132   1.280   1.280
  578   1HZ   LYS  74          1HZ       LYS  74   6.115  -0.473  -0.473
  579   2HZ   LYS  74          3HZ       LYS  74   6.324   1.182   1.182
  580   3HZ   LYS  74          2HZ       LYS  74   4.880   0.425   0.425
  581    H    ALA  75           H        ALA  75   5.988  -0.851  -0.851
  582    HA   ALA  75           HA       ALA  75   8.090   1.027   1.027
  583   1HB   ALA  75          2HB       ALA  75   7.495  -1.162  -1.162
  584   2HB   ALA  75          1HB       ALA  75   8.541   0.114   0.114
  585   3HB   ALA  75          3HB       ALA  75   8.992  -0.759  -0.759
  586    H    PHE  76           H        PHE  76   5.214   0.946   0.946
  587    HA   PHE  76           HA       PHE  76   5.901   2.982   2.982
  588   1HB   PHE  76          2HB       PHE  76   3.877   1.296   1.296
  589   2HB   PHE  76          1HB       PHE  76   3.073   2.608   2.608
  590    HD1  PHE  76           HD2      PHE  76   2.567   4.702   4.702
  591    HD2  PHE  76           HD1      PHE  76   4.440   1.485   1.485
  592    HE1  PHE  76           HE2      PHE  76   2.046   5.779   5.779
  593    HE2  PHE  76           HE1      PHE  76   3.923   2.557   2.557
  594    HZ   PHE  76           HZ       PHE  76   2.724   4.702   4.702
  595    H    LYS  77           H        LYS  77   4.143   3.080   3.080
  596    HA   LYS  77           HA       LYS  77   3.659   5.858   5.858
  597   1HB   LYS  77          2HB       LYS  77   3.916   4.035   4.035
  598   2HB   LYS  77          1HB       LYS  77   3.099   5.592   5.592
  599   1HG   LYS  77          2HG       LYS  77   1.214   4.625   4.625
  600   2HG   LYS  77          1HG       LYS  77   2.014   3.909   3.909
  601   1HD   LYS  77          2HD       LYS  77   1.345   2.004   2.004
  602   2HD   LYS  77          1HD       LYS  77   2.921   2.227   2.227
  603   1HE   LYS  77          2HE       LYS  77   2.023   2.782   2.782
  604   2HE   LYS  77          1HE       LYS  77   0.640   3.598   3.598
  605   1HZ   LYS  77          2HZ       LYS  77  -0.310   1.419   1.419
  606   2HZ   LYS  77          1HZ       LYS  77   1.004   0.661   0.661
  607   3HZ   LYS  77          3HZ       LYS  77  -0.057   1.614   1.614
  608    H    LYS  78           H        LYS  78   6.539   4.121   4.121
  609    HA   LYS  78           HA       LYS  78   7.768   6.277   6.277
  610   1HB   LYS  78          2HB       LYS  78   8.036   3.790   3.790
  611   2HB   LYS  78          1HB       LYS  78   9.098   3.705   3.705
  612   1HG   LYS  78          2HG       LYS  78  10.618   4.068   4.068
  613   2HG   LYS  78          1HG       LYS  78  10.285   5.729   5.729
  614   1HD   LYS  78          2HD       LYS  78   9.257   6.238   6.238
  615   2HD   LYS  78          1HD       LYS  78   8.497   4.651   4.651
  616   1HE   LYS  78          2HE       LYS  78  11.433   5.093   5.093
  617   2HE   LYS  78          1HE       LYS  78  10.228   5.230   5.230
  618   1HZ   LYS  78          2HZ       LYS  78   9.554   2.932   2.932
  619   2HZ   LYS  78          1HZ       LYS  78  10.798   2.817   2.817
  620   3HZ   LYS  78          3HZ       LYS  78  11.169   3.037   3.037
  621    H    LYS  79           H        LYS  79   7.559   5.045   5.045
  622    HA   LYS  79           HA       LYS  79  10.006   6.418   6.418
  623   1HB   LYS  79          2HB       LYS  79   9.367   4.046   4.046
  624   2HB   LYS  79          1HB       LYS  79   8.189   4.831   4.831
  625   1HG   LYS  79          2HG       LYS  79  10.493   6.217   6.217
  626   2HG   LYS  79          1HG       LYS  79  11.071   4.568   4.568
  627   1HD   LYS  79          2HD       LYS  79   9.064   3.949   3.949
  628   2HD   LYS  79          1HD       LYS  79   9.187   5.637   5.637
  629   1HE   LYS  79          2HE       LYS  79  11.578   3.821   3.821
  630   2HE   LYS  79          1HE       LYS  79  10.496   3.893   3.893
  631   1HZ   LYS  79          3HZ       LYS  79  10.963   6.478   6.478
  632   2HZ   LYS  79          2HZ       LYS  79  12.427   5.844   5.844
  633   3HZ   LYS  79          1HZ       LYS  79  11.911   5.508   5.508
  634    H    PHE  80           H        PHE  80   6.510   6.504   6.504
  635    HA   PHE  80           HA       PHE  80   6.863   9.005   9.005
  636   1HB   PHE  80          2HB       PHE  80   4.383   7.297   7.297
  637   2HB   PHE  80          1HB       PHE  80   4.871   8.552   8.552
  638    HD1  PHE  80           HD2      PHE  80   5.394   5.090   5.090
  639    HD2  PHE  80           HD1      PHE  80   6.460   8.100   8.100
  640    HE1  PHE  80           HE2      PHE  80   6.432   3.380   3.380
  641    HE2  PHE  80           HE1      PHE  80   7.501   6.396   6.396
  642    HZ   PHE  80           HZ       PHE  80   7.489   4.032   4.032
  643    H    ALA  81           H        ALA  81   5.593   7.632   7.632
  644    HA   ALA  81           HA       ALA  81   4.647   8.623   8.623
  645   1HB   ALA  81          1HB       ALA  81   6.039  10.629  10.629
  646   2HB   ALA  81          3HB       ALA  81   4.510  11.250  11.250
  647   3HB   ALA  81          2HB       ALA  81   4.697  10.933  10.933
  648    H    CYS  82           H        CYS  82   3.139   7.395   7.395
  649    HA   CYS  82           HA       CYS  82   0.622   8.918   8.918
  650   1HB   CYS  82          2HB       CYS  82   1.703   6.902   6.902
  651   2HB   CYS  82          1HB       CYS  82  -0.029   7.196   7.196
  652    HG   CYS  82           HG       CYS  82   1.792   9.623   9.623
  653    H    ASN  83           H        ASN  83  -1.325   7.213   7.213
  654    HA   ASN  83           HA       ASN  83  -0.986   5.438   5.438
  655   1HB   ASN  83          2HB       ASN  83  -3.064   6.011   6.011
  656   2HB   ASN  83          1HB       ASN  83  -2.922   7.321   7.321
  657   1HD2  ASN  83          2HD2      ASN  83  -5.164   4.033   4.033
  658   2HD2  ASN  83          1HD2      ASN  83  -3.823   3.889   3.889
  659    H    GLY  84           H        GLY  84  -0.710   3.354   3.354
  660   1HA   GLY  84          2HA       GLY  84  -1.633   2.245   2.245
  661   2HA   GLY  84          1HA       GLY  84  -0.331   1.585   1.585
  662    H    THR  85           H        THR  85  -3.617   1.408   1.408
  663    HA   THR  85           HA       THR  85  -4.207  -0.182  -0.182
  664    HB   THR  85           HB       THR  85  -6.592  -0.001  -0.001
  665    HG1  THR  85           HG1      THR  85  -7.030   1.531   1.531
  666   1HG2  THR  85          1HG2      THR  85  -4.956   2.265   2.265
  667   2HG2  THR  85          3HG2      THR  85  -6.552   2.655   2.655
  668   3HG2  THR  85          2HG2      THR  85  -6.393   1.530   1.530
  669    H    VAL  86           H        VAL  86  -5.348  -2.201  -2.201
  670    HA   VAL  86           HA       VAL  86  -4.715  -3.573  -3.573
  671    HB   VAL  86           HB       VAL  86  -3.358  -4.383  -4.383
  672   1HG1  VAL  86          3HG1      VAL  86  -5.607  -3.968  -3.968
  673   2HG1  VAL  86          2HG1      VAL  86  -5.500  -5.726  -5.726
  674   3HG1  VAL  86          1HG1      VAL  86  -4.135  -4.790  -4.790
  675   1HG2  VAL  86          3HG2      VAL  86  -4.356  -5.893  -5.893
  676   2HG2  VAL  86          2HG2      VAL  86  -3.605  -6.651  -6.651
  677   3HG2  VAL  86          1HG2      VAL  86  -5.361  -6.541  -6.541
  678    H    ILE  87           H        ILE  87  -6.915  -2.689  -2.689
  679    HA   ILE  87           HA       ILE  87  -9.198  -3.921  -3.921
  680    HB   ILE  87           HB       ILE  87 -10.518  -2.803  -2.803
  681   1HG1  ILE  87          2HG1      ILE  87  -8.312  -1.185  -1.185
  682   2HG1  ILE  87          1HG1      ILE  87  -8.162  -2.887  -2.887
  683   1HG2  ILE  87          3HG2      ILE  87  -9.880  -1.651  -1.651
  684   2HG2  ILE  87          2HG2      ILE  87  -8.504  -0.945  -0.945
  685   3HG2  ILE  87          1HG2      ILE  87 -10.147  -0.551  -0.551
  686   1HD1  ILE  87          3HD1      ILE  87 -10.520  -2.764  -2.764
  687   2HD1  ILE  87          2HD1      ILE  87 -10.422  -1.017  -1.017
  688   3HD1  ILE  87          1HD1      ILE  87  -9.327  -1.828  -1.828
  689    H    GLU  88           H        GLU  88 -10.630  -5.398  -5.398
  690    HA   GLU  88           HA       GLU  88  -9.379  -7.091  -7.091
  691   1HB   GLU  88          2HB       GLU  88 -10.148  -7.955  -7.955
  692   2HB   GLU  88          1HB       GLU  88 -11.759  -7.906  -7.906
  693   1HG   GLU  88          2HG       GLU  88 -10.700  -9.282  -9.282
  694   2HG   GLU  88          1HG       GLU  88  -9.429  -9.615  -9.615
  695    H    HIS  89           H        HIS  89 -10.094  -5.437  -5.437
  696    HA   HIS  89           HA       HIS  89 -12.749  -4.809  -4.809
  697   1HB   HIS  89          2HB       HIS  89 -10.427  -4.016  -4.016
  698   2HB   HIS  89          1HB       HIS  89 -10.898  -5.161  -5.161
  699    HD1  HIS  89           HD1      HIS  89 -12.523  -4.349  -4.349
  700    HD2  HIS  89           HD2      HIS  89 -12.397  -1.898  -1.898
  701    HE1  HIS  89           HE1      HIS  89 -13.961  -2.367  -2.367
  702    HE2  HIS  89           HE2      HIS  89 -13.935  -0.933  -0.933
  703    HA   PRO  90           HA       PRO  90 -14.276  -8.682  -8.682
  704   1HB   PRO  90          2HB       PRO  90 -16.675  -7.866  -7.866
  705   2HB   PRO  90          1HB       PRO  90 -16.295  -7.935  -7.935
  706   1HG   PRO  90          2HG       PRO  90 -16.327  -5.575  -5.575
  707   2HG   PRO  90          1HG       PRO  90 -16.936  -5.708  -5.708
  708   1HD   PRO  90          2HD       PRO  90 -14.515  -4.599  -4.599
  709   2HD   PRO  90          1HD       PRO  90 -14.870  -5.338  -5.338
  710    H    GLU  91           H        GLU  91 -13.882  -5.830  -5.830
  711    HA   GLU  91           HA       GLU  91 -14.529  -7.097  -7.097
  712   1HB   GLU  91          2HB       GLU  91 -14.137  -4.454  -4.454
  713   2HB   GLU  91          1HB       GLU  91 -12.944  -4.735  -4.735
  714   1HG   GLU  91          2HG       GLU  91 -15.777  -5.508  -5.508
  715   2HG   GLU  91          1HG       GLU  91 -15.313  -3.810  -3.810
  716    H    TYR  92           H        TYR  92 -11.718  -6.737  -6.737
  717    HA   TYR  92           HA       TYR  92 -10.073  -7.909  -7.909
  718   1HB   TYR  92          2HB       TYR  92  -8.836  -6.416  -6.416
  719   2HB   TYR  92          1HB       TYR  92  -8.230  -6.659  -6.659
  720    HD1  TYR  92           HD2      TYR  92 -10.468  -5.748  -5.748
  721    HD2  TYR  92           HD1      TYR  92  -8.899  -4.111  -4.111
  722    HE1  TYR  92           HE2      TYR  92 -11.316  -3.536  -3.536
  723    HE2  TYR  92           HE1      TYR  92  -9.743  -1.890  -1.890
  724    HH   TYR  92           HH       TYR  92 -11.998  -1.389  -1.389
  725    H    GLY  93           H        GLY  93 -10.450  -7.715  -7.715
  726   1HA   GLY  93          2HA       GLY  93 -10.610  -9.650  -9.650
  727   2HA   GLY  93          1HA       GLY  93  -9.759 -10.564 -10.564
  728    H    GLU  94           H        GLU  94  -9.463  -8.563  -8.563
  729    HA   GLU  94           HA       GLU  94  -7.728  -8.108  -8.108
  730   1HB   GLU  94          2HB       GLU  94  -7.387 -10.687 -10.687
  731   2HB   GLU  94          1HB       GLU  94  -5.898 -10.030 -10.030
  732   1HG   GLU  94          2HG       GLU  94  -5.639  -8.921  -8.921
  733   2HG   GLU  94          1HG       GLU  94  -6.817 -10.127 -10.127
  734    H    VAL  95           H        VAL  95  -7.330  -6.034  -6.034
  735    HA   VAL  95           HA       VAL  95  -4.877  -5.780  -5.780
  736    HB   VAL  95           HB       VAL  95  -5.852  -3.809  -3.809
  737   1HG1  VAL  95          2HG1      VAL  95  -5.762  -6.213  -6.213
  738   2HG1  VAL  95          1HG1      VAL  95  -7.500  -6.244  -6.244
  739   3HG1  VAL  95          3HG1      VAL  95  -6.816  -5.067  -5.067
  740   1HG2  VAL  95          3HG2      VAL  95  -7.737  -3.659  -3.659
  741   2HG2  VAL  95          2HG2      VAL  95  -8.093  -3.244  -3.244
  742   3HG2  VAL  95          1HG2      VAL  95  -8.567  -4.819  -4.819
  743    H    ILE  96           H        ILE  96  -3.568  -4.055  -4.055
  744    HA   ILE  96           HA       ILE  96  -4.085  -2.892  -2.892
  745    HB   ILE  96           HB       ILE  96  -1.727  -3.148  -3.148
  746   1HG1  ILE  96          2HG1      ILE  96  -2.320  -4.583  -4.583
  747   2HG1  ILE  96          1HG1      ILE  96  -0.679  -3.944  -3.944
  748   1HG2  ILE  96          2HG2      ILE  96  -2.071  -0.840  -0.840
  749   2HG2  ILE  96          1HG2      ILE  96  -0.488  -1.451  -1.451
  750   3HG2  ILE  96          3HG2      ILE  96  -1.587  -0.803  -0.803
  751   1HD1  ILE  96          1HD1      ILE  96  -2.061  -2.025  -2.025
  752   2HD1  ILE  96          3HD1      ILE  96  -2.806  -3.531  -3.531
  753   3HD1  ILE  96          2HD1      ILE  96  -1.066  -3.303  -3.303
  754    H    GLN  97           H        GLN  97  -4.861  -0.930  -0.930
  755    HA   GLN  97           HA       GLN  97  -5.284   0.850   0.850
  756   1HB   GLN  97          2HB       GLN  97  -6.875   0.099   0.099
  757   2HB   GLN  97          1HB       GLN  97  -6.656   1.842   1.842
  758   1HG   GLN  97          2HG       GLN  97  -7.451   1.848   1.848
  759   2HG   GLN  97          1HG       GLN  97  -7.816   0.131   0.131
  760   1HE2  GLN  97          2HE2      GLN  97 -11.017   1.500   1.500
  761   2HE2  GLN  97          1HE2      GLN  97  -9.982   0.966   0.966
  762    H    LEU  98           H        LEU  98  -3.649   2.236   2.236
  763    HA   LEU  98           HA       LEU  98  -2.321   3.370   3.370
  764   1HB   LEU  98          2HB       LEU  98  -1.777   3.882   3.882
  765   2HB   LEU  98          1HB       LEU  98  -0.749   4.310   4.310
  766    HG   LEU  98           HG       LEU  98  -1.427   1.437   1.437
  767   1HD1  LEU  98          3HD1      LEU  98  -0.559   2.696   2.696
  768   2HD1  LEU  98          2HD1      LEU  98   0.990   2.613   2.613
  769   3HD1  LEU  98          1HD1      LEU  98   0.114   1.130   1.130
  770   1HD2  LEU  98          3HD2      LEU  98   0.607   3.029   3.029
  771   2HD2  LEU  98          2HD2      LEU  98  -0.220   1.543   1.543
  772   3HD2  LEU  98          1HD2      LEU  98   1.119   1.483   1.483
  773    H    GLN  99           H        GLN  99  -2.014   5.725   5.725
  774    HA   GLN  99           HA       GLN  99  -4.513   7.085   7.085
  775   1HB   GLN  99          2HB       GLN  99  -3.115   7.044   7.044
  776   2HB   GLN  99          1HB       GLN  99  -2.398   8.467   8.467
  777   1HG   GLN  99          2HG       GLN  99  -5.363   8.216   8.216
  778   2HG   GLN  99          1HG       GLN  99  -4.474   8.676   8.676
  779   1HE2  GLN  99          2HE2      GLN  99  -5.200  11.893  11.893
  780   2HE2  GLN  99          1HE2      GLN  99  -5.833  10.631  10.631
  781    H    GLY 100           H        GLY 100  -4.668   8.920   8.920
  782   1HA   GLY 100          2HA       GLY 100  -4.048  10.599  10.599
  783   2HA   GLY 100          1HA       GLY 100  -2.387  10.377  10.377
  784    H    ASP 101           H        ASP 101  -2.430  10.920  10.920
  785    HA   ASP 101           HA       ASP 101  -2.875   8.624   8.624
  786   1HB   ASP 101          2HB       ASP 101  -1.958  10.074  10.074
  787   2HB   ASP 101          1HB       ASP 101  -3.286  10.832  10.832
  788    H    GLN 102           H        GLN 102  -1.508   7.041   7.041
  789    HA   GLN 102           HA       GLN 102   1.370   7.576   7.576
  790   1HB   GLN 102          2HB       GLN 102  -0.343   5.702   5.702
  791   2HB   GLN 102          1HB       GLN 102   1.231   5.095   5.095
  792   1HG   GLN 102          2HG       GLN 102   0.937   6.247   6.247
  793   2HG   GLN 102          1HG       GLN 102   2.373   6.568   6.568
  794   1HE2  GLN 102          2HE2      GLN 102  -0.508   9.478   9.478
  795   2HE2  GLN 102          1HE2      GLN 102  -0.945   7.810   7.810
  796    H    ARG 103           H        ARG 103  -0.721   6.845   6.845
  797    HA   ARG 103           HA       ARG 103  -0.267   4.359   4.359
  798   1HB   ARG 103          2HB       ARG 103  -0.754   5.355   5.355
  799   2HB   ARG 103          1HB       ARG 103  -1.872   5.905   5.905
  800   1HG   ARG 103          2HG       ARG 103  -0.707   8.013   8.013
  801   2HG   ARG 103          1HG       ARG 103   0.511   7.462   7.462
  802   1HD   ARG 103          2HD       ARG 103  -2.408   7.988   7.988
  803   2HD   ARG 103          1HD       ARG 103  -1.024   8.861   8.861
  804    HE   ARG 103           HE       ARG 103  -2.158   6.442   6.442
  805   1HH1  ARG 103          2HH1      ARG 103   0.833   8.213   8.213
  806   2HH1  ARG 103          1HH1      ARG 103   1.569   7.463   7.463
  807   1HH2  ARG 103          1HH2      ARG 103  -1.193   5.455   5.455
  808   2HH2  ARG 103          2HH2      ARG 103   0.418   5.899   5.899
  809    H    LYS 104           H        LYS 104   1.910   7.062   7.062
  810    HA   LYS 104           HA       LYS 104   3.815   5.673   5.673
  811   1HB   LYS 104          2HB       LYS 104   3.165   8.151   8.151
  812   2HB   LYS 104          1HB       LYS 104   4.174   8.451   8.451
  813   1HG   LYS 104          2HG       LYS 104   5.623   6.819   6.819
  814   2HG   LYS 104          1HG       LYS 104   4.959   8.205   8.205
  815   1HD   LYS 104          2HD       LYS 104   6.511   8.410   8.410
  816   2HD   LYS 104          1HD       LYS 104   7.231   8.580   8.580
  817   1HE   LYS 104          2HE       LYS 104   6.059  10.553  10.553
  818   2HE   LYS 104          1HE       LYS 104   4.888  10.253  10.253
  819   1HZ   LYS 104          2HZ       LYS 104   7.132  10.385  10.385
  820   2HZ   LYS 104          1HZ       LYS 104   7.539  11.431  11.431
  821   3HZ   LYS 104          3HZ       LYS 104   6.164  11.733  11.733
  822    H    ASN 105           H        ASN 105   3.199   6.504   6.504
  823    HA   ASN 105           HA       ASN 105   5.951   6.133   6.133
  824   1HB   ASN 105          2HB       ASN 105   3.378   6.838   6.838
  825   2HB   ASN 105          1HB       ASN 105   4.716   6.225   6.225
  826   1HD2  ASN 105          2HD2      ASN 105   4.652  10.025  10.025
  827   2HD2  ASN 105          1HD2      ASN 105   3.346   8.919   8.919
  828    H    ILE 106           H        ILE 106   2.911   4.333   4.333
  829    HA   ILE 106           HA       ILE 106   3.772   2.251   2.251
  830    HB   ILE 106           HB       ILE 106   1.402   2.643   2.643
  831   1HG1  ILE 106          2HG1      ILE 106   0.766   0.307   0.307
  832   2HG1  ILE 106          1HG1      ILE 106   2.334  -0.140  -0.140
  833   1HG2  ILE 106          1HG2      ILE 106   1.828   3.038   3.038
  834   2HG2  ILE 106          3HG2      ILE 106   1.977   1.291   1.291
  835   3HG2  ILE 106          2HG2      ILE 106   0.455   1.995   1.995
  836   1HD1  ILE 106          1HD1      ILE 106   2.298   1.269   1.269
  837   2HD1  ILE 106          3HD1      ILE 106   1.757  -0.408  -0.408
  838   3HD1  ILE 106          2HD1      ILE 106   3.378   0.011   0.011
  839    H    CYS 107           H        CYS 107   3.674   2.407   2.407
  840    HA   CYS 107           HA       CYS 107   4.880  -0.088  -0.088
  841   1HB   CYS 107          2HB       CYS 107   5.026   2.449   2.449
  842   2HB   CYS 107          1HB       CYS 107   5.507   0.852   0.852
  843    HG   CYS 107           HG       CYS 107   2.642   0.767   0.767
  844    H    GLN 108           H        GLN 108   6.095   3.017   3.017
  845    HA   GLN 108           HA       GLN 108   8.869   2.486   2.486
  846   1HB   GLN 108          2HB       GLN 108   8.315   4.759   4.759
  847   2HB   GLN 108          1HB       GLN 108   7.282   4.622   4.622
  848   1HG   GLN 108          2HG       GLN 108   9.075   5.769   5.769
  849   2HG   GLN 108          1HG       GLN 108   9.500   4.112   4.112
  850   1HE2  GLN 108          2HE2      GLN 108  12.251   3.918   3.918
  851   2HE2  GLN 108          1HE2      GLN 108  11.074   3.029   3.029
  852    H    PHE 109           H        PHE 109   6.605   2.101   2.101
  853    HA   PHE 109           HA       PHE 109   8.575   1.514   1.514
  854   1HB   PHE 109          2HB       PHE 109   6.359   2.416   2.416
  855   2HB   PHE 109          1HB       PHE 109   5.601   0.957   0.957
  856    HD1  PHE 109           HD1      PHE 109   8.166   2.024   2.024
  857    HD2  PHE 109           HD2      PHE 109   5.105  -0.750  -0.750
  858    HE1  PHE 109           HE1      PHE 109   8.387   0.972   0.972
  859    HE2  PHE 109           HE2      PHE 109   5.319  -1.808  -1.808
  860    HZ   PHE 109           HZ       PHE 109   6.961  -0.943  -0.943
  861    H    LEU 110           H        LEU 110   6.354  -0.375  -0.375
  862    HA   LEU 110           HA       LEU 110   6.905  -2.911  -2.911
  863   1HB   LEU 110          2HB       LEU 110   5.898  -1.852  -1.852
  864   2HB   LEU 110          1HB       LEU 110   6.395  -3.531  -3.531
  865    HG   LEU 110           HG       LEU 110   4.729  -4.071  -4.071
  866   1HD1  LEU 110          3HD1      LEU 110   5.016  -2.017  -2.017
  867   2HD1  LEU 110          2HD1      LEU 110   4.041  -1.145  -1.145
  868   3HD1  LEU 110          1HD1      LEU 110   3.331  -2.470  -2.470
  869   1HD2  LEU 110          2HD2      LEU 110   4.103  -3.428  -3.428
  870   2HD2  LEU 110          1HD2      LEU 110   2.871  -3.885  -3.885
  871   3HD2  LEU 110          3HD2      LEU 110   3.158  -2.183  -2.183
  872    H    VAL 111           H        VAL 111   8.701  -0.890  -0.890
  873    HA   VAL 111           HA       VAL 111  10.547  -3.038  -3.038
  874    HB   VAL 111           HB       VAL 111  10.589  -0.126  -0.126
  875   1HG1  VAL 111          2HG1      VAL 111  12.208  -2.498  -2.498
  876   2HG1  VAL 111          1HG1      VAL 111  12.108  -0.986  -0.986
  877   3HG1  VAL 111          3HG1      VAL 111  12.794  -1.001  -1.001
  878   1HG2  VAL 111          1HG2      VAL 111   8.671  -1.779  -1.779
  879   2HG2  VAL 111          3HG2      VAL 111   9.390  -0.643  -0.643
  880   3HG2  VAL 111          2HG2      VAL 111   9.900  -2.332  -2.332
  881    H    GLU 112           H        GLU 112  10.362  -0.195  -0.195
  882    HA   GLU 112           HA       GLU 112  13.137  -0.004  -0.004
  883   1HB   GLU 112          2HB       GLU 112  10.644   1.075   1.075
  884   2HB   GLU 112          1HB       GLU 112  12.207   1.271   1.271
  885   1HG   GLU 112          2HG       GLU 112  12.257   2.035   2.035
  886   2HG   GLU 112          1HG       GLU 112  11.083   2.955   2.955
  887    H    ILE 113           H        ILE 113  10.405  -1.589  -1.589
  888    HA   ILE 113           HA       ILE 113  12.150  -2.670  -2.670
  889    HB   ILE 113           HB       ILE 113  10.214  -3.394  -3.394
  890   1HG1  ILE 113          2HG1      ILE 113   8.676  -2.919  -2.919
  891   2HG1  ILE 113          1HG1      ILE 113   9.050  -4.483  -4.483
  892   1HG2  ILE 113          2HG2      ILE 113  10.626  -0.832  -0.832
  893   2HG2  ILE 113          1HG2      ILE 113   9.070  -0.941  -0.941
  894   3HG2  ILE 113          3HG2      ILE 113   9.203  -1.395  -1.395
  895   1HD1  ILE 113          1HD1      ILE 113   7.656  -2.751  -2.751
  896   2HD1  ILE 113          3HD1      ILE 113   6.747  -3.018  -3.018
  897   3HD1  ILE 113          2HD1      ILE 113   7.280  -4.394  -4.394
  898    H    GLY 114           H        GLY 114  10.797  -3.601  -3.601
  899   1HA   GLY 114          2HA       GLY 114  11.377  -5.509  -5.509
  900   2HA   GLY 114          1HA       GLY 114  12.034  -6.225  -6.225
  901    H    LEU 115           H        LEU 115   8.852  -4.798  -4.798
  902    HA   LEU 115           HA       LEU 115   7.620  -7.193  -7.193
  903   1HB   LEU 115          2HB       LEU 115   7.032  -4.562  -4.562
  904   2HB   LEU 115          1HB       LEU 115   5.927  -5.018  -5.018
  905    HG   LEU 115           HG       LEU 115   4.822  -6.603  -6.603
  906   1HD1  LEU 115          1HD1      LEU 115   7.203  -6.224  -6.224
  907   2HD1  LEU 115          3HD1      LEU 115   5.657  -6.570  -6.570
  908   3HD1  LEU 115          2HD1      LEU 115   6.323  -7.695  -7.695
  909   1HD2  LEU 115          1HD2      LEU 115   4.731  -3.915  -3.915
  910   2HD2  LEU 115          3HD2      LEU 115   3.640  -5.083  -5.083
  911   3HD2  LEU 115          2HD2      LEU 115   5.051  -4.501  -4.501
  912    H    ALA 116           H        ALA 116   6.705  -5.216  -5.216
  913    HA   ALA 116           HA       ALA 116   5.733  -7.624  -7.624
  914   1HB   ALA 116          3HB       ALA 116   4.365  -5.523  -5.523
  915   2HB   ALA 116          2HB       ALA 116   5.533  -4.784  -4.784
  916   3HB   ALA 116          1HB       ALA 116   4.592  -6.179  -6.179
  917    H    LYS 117           H        LYS 117   6.068  -7.376  -7.376
  918    HA   LYS 117           HA       LYS 117   8.980  -7.292  -7.292
  919   1HB   LYS 117          2HB       LYS 117   7.067  -9.178  -9.178
  920   2HB   LYS 117          1HB       LYS 117   7.497  -8.353  -8.353
  921   1HG   LYS 117          2HG       LYS 117   9.019 -10.066 -10.066
  922   2HG   LYS 117          1HG       LYS 117   9.939  -8.763  -8.763
  923   1HD   LYS 117          2HD       LYS 117   8.420 -10.911 -10.911
  924   2HD   LYS 117          1HD       LYS 117  10.163 -10.905 -10.905
  925   1HE   LYS 117          2HE       LYS 117  10.199  -8.657  -8.657
  926   2HE   LYS 117          1HE       LYS 117   8.536  -8.989  -8.989
  927   1HZ   LYS 117          1HZ       LYS 117  10.854 -10.738 -10.738
  928   2HZ   LYS 117          3HZ       LYS 117  10.177  -9.621  -9.621
  929   3HZ   LYS 117          2HZ       LYS 117   9.265 -10.942 -10.942
  930    H    ASP 118           H        ASP 118   9.867  -6.345  -6.345
  931    HA   ASP 118           HA       ASP 118   8.793  -3.807  -3.807
  932   1HB   ASP 118          2HB       ASP 118  10.782  -5.244  -5.244
  933   2HB   ASP 118          1HB       ASP 118  10.611  -3.510  -3.510
  934    H    ASP 119           H        ASP 119   8.421  -6.930  -6.930
  935    HA   ASP 119           HA       ASP 119   7.208  -5.909  -5.909
  936   1HB   ASP 119          2HB       ASP 119   7.274  -8.739  -8.739
  937   2HB   ASP 119          1HB       ASP 119   6.834  -8.254  -8.254
  938    H    GLN 120           H        GLN 120   6.220  -7.025  -7.025
  939    HA   GLN 120           HA       GLN 120   3.446  -7.340  -7.340
  940   1HB   GLN 120          2HB       GLN 120   4.818  -7.154  -7.154
  941   2HB   GLN 120          1HB       GLN 120   3.131  -7.575  -7.575
  942   1HG   GLN 120          2HG       GLN 120   3.851  -9.553  -9.553
  943   2HG   GLN 120          1HG       GLN 120   5.526  -9.146  -9.146
  944   1HE2  GLN 120          2HE2      GLN 120   3.141 -10.157 -10.157
  945   2HE2  GLN 120          1HE2      GLN 120   2.543  -9.142  -9.142
  946    H    LEU 121           H        LEU 121   5.428  -4.681  -4.681
  947    HA   LEU 121           HA       LEU 121   3.934  -2.937  -2.937
  948   1HB   LEU 121          2HB       LEU 121   5.691  -2.427  -2.427
  949   2HB   LEU 121          1HB       LEU 121   4.982  -1.130  -1.130
  950    HG   LEU 121           HG       LEU 121   6.745  -3.240  -3.240
  951   1HD1  LEU 121          3HD1      LEU 121   7.466  -0.702  -0.702
  952   2HD1  LEU 121          2HD1      LEU 121   8.442  -1.283  -1.283
  953   3HD1  LEU 121          1HD1      LEU 121   8.237  -2.286  -2.286
  954   1HD2  LEU 121          2HD2      LEU 121   5.125  -1.226  -1.226
  955   2HD2  LEU 121          1HD2      LEU 121   6.337  -2.200  -2.200
  956   3HD2  LEU 121          3HD2      LEU 121   6.783  -0.641  -0.641
  957    H    LYS 122           H        LYS 122   1.736  -3.229  -3.229
  958    HA   LYS 122           HA       LYS 122   0.716  -2.260  -2.260
  959   1HB   LYS 122          2HB       LYS 122  -0.223  -4.328  -4.328
  960   2HB   LYS 122          1HB       LYS 122  -1.461  -3.378  -3.378
  961   1HG   LYS 122          2HG       LYS 122   0.732  -4.806  -4.806
  962   2HG   LYS 122          1HG       LYS 122  -0.832  -5.540  -5.540
  963   1HD   LYS 122          2HD       LYS 122  -1.883  -4.359  -4.359
  964   2HD   LYS 122          1HD       LYS 122  -0.995  -2.881  -2.881
  965   1HE   LYS 122          2HE       LYS 122   0.668  -3.340  -3.340
  966   2HE   LYS 122          1HE       LYS 122   0.509  -5.085  -5.085
  967   1HZ   LYS 122          3HZ       LYS 122  -1.808  -4.531  -4.531
  968   2HZ   LYS 122          2HZ       LYS 122  -0.875  -3.285  -3.285
  969   3HZ   LYS 122          1HZ       LYS 122  -0.408  -4.896  -4.896
  970    H    VAL 123           H        VAL 123   0.810  -0.060  -0.060
  971    HA   VAL 123           HA       VAL 123  -0.668   0.866   0.866
  972    HB   VAL 123           HB       VAL 123   1.542   1.854   1.854
  973   1HG1  VAL 123          2HG1      VAL 123   1.184   1.741   1.741
  974   2HG1  VAL 123          1HG1      VAL 123   0.305   3.258   3.258
  975   3HG1  VAL 123          3HG1      VAL 123   2.005   3.162   3.162
  976   1HG2  VAL 123          3HG2      VAL 123  -0.777   3.772   3.772
  977   2HG2  VAL 123          2HG2      VAL 123  -0.077   3.126   3.126
  978   3HG2  VAL 123          1HG2      VAL 123   0.869   4.207   4.207
  979    H    HIS 124           H        HIS 124  -2.679   1.584   1.584
  980    HA   HIS 124           HA       HIS 124  -3.726   2.663   2.663
  981   1HB   HIS 124          2HB       HIS 124  -5.282   0.747   0.747
  982   2HB   HIS 124          1HB       HIS 124  -5.775   1.412   1.412
  983    HD1  HIS 124           HD1      HIS 124  -5.261   0.024   0.024
  984    HD2  HIS 124           HD2      HIS 124  -2.966  -1.054  -1.054
  985    HE1  HIS 124           HE1      HIS 124  -3.979  -2.017  -2.017
  986    HE2  HIS 124           HE2      HIS 124  -2.706  -2.728  -2.728
  987    H    GLY 125           H        GLY 125  -2.753   3.996   3.996
  988   1HA   GLY 125          2HA       GLY 125  -4.656   4.727   4.727
  989   2HA   GLY 125          1HA       GLY 125  -3.319   5.741   5.741
  990    H    PHE 126           HN       PHE 126  -6.694   4.967   4.967
  991    HA   PHE 126           HA       PHE 126  -8.422   6.164   6.164
  992   1HB   PHE 126          2HB       PHE 126  -6.768   7.984   7.984
  993   2HB   PHE 126          1HB       PHE 126  -7.113   8.744   8.744
  994    HD1  PHE 126           HD1      PHE 126  -9.909   7.528   7.528
  995    HD2  PHE 126           HD2      PHE 126  -7.946   9.478   9.478
  996    HE1  PHE 126           HE1      PHE 126 -12.090   8.265   8.265
  997    HE2  PHE 126           HE2      PHE 126 -10.128  10.217  10.217
  998    HZ   PHE 126           HZ       PHE 126 -12.201   9.611   9.611

  Start of MODEL    9
    1   1H    MET   1          3H        MET   1 -39.309  -4.464  -4.464
    2   2H    MET   1          2H        MET   1 -40.375  -5.809  -5.809
    3   3H    MET   1          1H        MET   1 -38.754  -6.008  -6.008
    4    HA   MET   1           HA       MET   1 -38.798  -6.851  -6.851
    5   1HB   MET   1          2HB       MET   1 -39.820  -5.624  -5.624
    6   2HB   MET   1          1HB       MET   1 -40.991  -5.964  -5.964
    7   1HG   MET   1          2HG       MET   1 -40.422  -3.592  -3.592
    8   2HG   MET   1          1HG       MET   1 -39.754  -3.358  -3.358
    9   1HE   MET   1          1HE       MET   1 -41.325  -1.335  -1.335
   10   2HE   MET   1          3HE       MET   1 -41.305  -2.104  -2.104
   11   3HE   MET   1          2HE       MET   1 -42.827  -1.532  -1.532
   12    H    ARG   2           H        ARG   2 -37.523  -6.107  -6.107
   13    HA   ARG   2           HA       ARG   2 -35.637  -5.193  -5.193
   14   1HB   ARG   2          2HB       ARG   2 -37.156  -3.064  -3.064
   15   2HB   ARG   2          1HB       ARG   2 -35.750  -2.751  -2.751
   16   1HG   ARG   2          2HG       ARG   2 -34.530  -3.309  -3.309
   17   2HG   ARG   2          1HG       ARG   2 -36.048  -2.639  -2.639
   18   1HD   ARG   2          2HD       ARG   2 -35.661  -0.568  -0.568
   19   2HD   ARG   2          1HD       ARG   2 -34.550  -1.217  -1.217
   20    HE   ARG   2           HE       ARG   2 -33.520  -1.517  -1.517
   21   1HH1  ARG   2          2HH1      ARG   2 -33.986   0.821   0.821
   22   2HH1  ARG   2          1HH1      ARG   2 -32.655   1.812   1.812
   23   1HH2  ARG   2          1HH2      ARG   2 -31.769  -0.214  -0.214
   24   2HH2  ARG   2          2HH2      ARG   2 -31.396   1.225   1.225
   25    H    GLY   3           H        GLY   3 -33.694  -5.943  -5.943
   26   1HA   GLY   3          2HA       GLY   3 -31.959  -5.061  -5.061
   27   2HA   GLY   3          1HA       GLY   3 -32.892  -6.283  -6.283
   28    H    SER   4           H        SER   4 -33.150  -8.371  -8.371
   29    HA   SER   4           HA       SER   4 -30.700  -8.967  -8.967
   30   1HB   SER   4          2HB       SER   4 -30.016  -9.602  -9.602
   31   2HB   SER   4          1HB       SER   4 -31.556 -10.395 -10.395
   32    HG   SER   4           HG       SER   4 -29.488 -11.613 -11.613
   33    H    HIS   5           H        HIS   5 -30.816 -11.357 -11.357
   34    HA   HIS   5           HA       HIS   5 -33.278 -11.613 -11.613
   35   1HB   HIS   5          2HB       HIS   5 -30.769 -13.291 -13.291
   36   2HB   HIS   5          1HB       HIS   5 -32.154 -13.698 -13.698
   37    HD1  HIS   5           HD1      HIS   5 -29.943 -10.636 -10.636
   38    HD2  HIS   5           HD2      HIS   5 -31.884 -12.718 -12.718
   39    HE1  HIS   5           HE1      HIS   5 -29.343  -9.441  -9.441
   40    HE2  HIS   5           HE2      HIS   5 -30.599 -10.668 -10.668
   41    H    HIS   6           H        HIS   6 -31.558 -14.196 -14.196
   42    HA   HIS   6           HA       HIS   6 -32.290 -15.901 -15.901
   43   1HB   HIS   6          2HB       HIS   6 -32.938 -14.031 -14.031
   44   2HB   HIS   6          1HB       HIS   6 -34.519 -13.983 -13.983
   45    HD1  HIS   6           HD1      HIS   6 -32.385 -16.376 -16.376
   46    HD2  HIS   6           HD2      HIS   6 -36.371 -15.621 -15.621
   47    HE1  HIS   6           HE1      HIS   6 -33.710 -17.938 -17.938
   48    HE2  HIS   6           HE2      HIS   6 -36.114 -17.532 -17.532
   49    H    HIS   7           H        HIS   7 -32.757 -17.225 -17.225
   50    HA   HIS   7           HA       HIS   7 -35.640 -17.571 -17.571
   51   1HB   HIS   7          2HB       HIS   7 -35.093 -18.285 -18.285
   52   2HB   HIS   7          1HB       HIS   7 -34.597 -16.623 -16.623
   53    HD1  HIS   7           HD1      HIS   7 -31.969 -16.280 -16.280
   54    HD2  HIS   7           HD2      HIS   7 -33.099 -19.946 -19.946
   55    HE1  HIS   7           HE1      HIS   7 -29.861 -17.287 -17.287
   56    HE2  HIS   7           HE2      HIS   7 -30.576 -19.484 -19.484
   57    H    HIS   8           H        HIS   8 -36.133 -19.318 -19.318
   58    HA   HIS   8           HA       HIS   8 -36.204 -21.471 -21.471
   59   1HB   HIS   8          2HB       HIS   8 -34.617 -21.859 -21.859
   60   2HB   HIS   8          1HB       HIS   8 -35.116 -23.202 -23.202
   61    HD1  HIS   8           HD1      HIS   8 -36.085 -21.944 -21.944
   62    HD2  HIS   8           HD2      HIS   8 -38.205 -22.546 -22.546
   63    HE1  HIS   8           HE1      HIS   8 -38.501 -22.081 -22.081
   64    HE2  HIS   8           HE2      HIS   8 -39.771 -22.366 -22.366
   65    H    HIS   9           H        HIS   9 -32.972 -21.773 -21.773
   66    HA   HIS   9           HA       HIS   9 -31.005 -22.454 -22.454
   67   1HB   HIS   9          2HB       HIS   9 -31.313 -19.948 -19.948
   68   2HB   HIS   9          1HB       HIS   9 -31.586 -20.546 -20.546
   69    HD1  HIS   9           HD1      HIS   9 -29.308 -22.898 -22.898
   70    HD2  HIS   9           HD2      HIS   9 -28.925 -18.766 -18.766
   71    HE1  HIS   9           HE1      HIS   9 -26.861 -22.470 -22.470
   72    HE2  HIS   9           HE2      HIS   9 -26.669 -19.967 -19.967
   73    H    HIS  10           H        HIS  10 -32.010 -24.558 -24.558
   74    HA   HIS  10           HA       HIS  10 -32.030 -25.007 -25.007
   75   1HB   HIS  10          2HB       HIS  10 -34.285 -25.182 -25.182
   76   2HB   HIS  10          1HB       HIS  10 -33.681 -26.826 -26.826
   77    HD1  HIS  10           HD1      HIS  10 -34.748 -28.301 -28.301
   78    HD2  HIS  10           HD2      HIS  10 -34.082 -24.497 -24.497
   79    HE1  HIS  10           HE1      HIS  10 -35.579 -28.378 -28.378
   80    HE2  HIS  10           HE2      HIS  10 -35.244 -26.041 -26.041
   81    H    THR  11           H        THR  11 -29.691 -25.357 -25.357
   82    HA   THR  11           HA       THR  11 -29.382 -28.220 -28.220
   83    HB   THR  11           HB       THR  11 -27.337 -27.688 -27.688
   84    HG1  THR  11           HG1      THR  11 -26.715 -25.633 -25.633
   85   1HG2  THR  11          3HG2      THR  11 -29.920 -26.501 -26.501
   86   2HG2  THR  11          2HG2      THR  11 -28.465 -26.277 -26.277
   87   3HG2  THR  11          1HG2      THR  11 -29.050 -27.904 -27.904
   88    H    ASP  12           H        ASP  12 -29.443 -28.096 -28.096
   89    HA   ASP  12           HA       ASP  12 -27.147 -27.035 -27.035
   90   1HB   ASP  12          2HB       ASP  12 -29.475 -28.747 -28.747
   91   2HB   ASP  12          1HB       ASP  12 -28.102 -28.546 -28.546
   92    HA   PRO  13           HA       PRO  13 -24.105 -30.186 -30.186
   93   1HB   PRO  13          2HB       PRO  13 -23.973 -30.205 -30.205
   94   2HB   PRO  13          1HB       PRO  13 -22.673 -30.021 -30.021
   95   1HG   PRO  13          2HG       PRO  13 -23.581 -27.915 -27.915
   96   2HG   PRO  13          1HG       PRO  13 -23.142 -27.779 -27.779
   97   1HD   PRO  13          2HD       PRO  13 -25.842 -27.904 -27.904
   98   2HD   PRO  13          1HD       PRO  13 -25.303 -26.998 -26.998
   99    H    MET  14           H        MET  14 -26.541 -30.662 -30.662
  100    HA   MET  14           HA       MET  14 -26.178 -33.495 -33.495
  101   1HB   MET  14          2HB       MET  14 -28.595 -31.929 -31.929
  102   2HB   MET  14          1HB       MET  14 -28.065 -33.503 -33.503
  103   1HG   MET  14          2HG       MET  14 -26.034 -32.432 -32.432
  104   2HG   MET  14          1HG       MET  14 -26.684 -30.867 -30.867
  105   1HE   MET  14          1HE       MET  14 -26.958 -33.951 -33.951
  106   2HE   MET  14          3HE       MET  14 -28.229 -33.588 -33.588
  107   3HE   MET  14          2HE       MET  14 -28.650 -34.010 -34.010
  108    H    SER  15           H        SER  15 -28.243 -31.320 -31.320
  109    HA   SER  15           HA       SER  15 -30.162 -33.144 -33.144
  110   1HB   SER  15          2HB       SER  15 -30.801 -31.507 -31.507
  111   2HB   SER  15          1HB       SER  15 -30.076 -30.567 -30.567
  112    HG   SER  15           HG       SER  15 -28.082 -30.717 -30.717
  113    H    ALA  16           H        ALA  16 -26.889 -32.535 -32.535
  114    HA   ALA  16           HA       ALA  16 -27.084 -34.850 -34.850
  115   1HB   ALA  16          1HB       ALA  16 -27.342 -32.635 -32.635
  116   2HB   ALA  16          3HB       ALA  16 -25.630 -32.390 -32.390
  117   3HB   ALA  16          2HB       ALA  16 -26.147 -33.787 -33.787
  118    H    ILE  17           H        ILE  17 -25.983 -35.740 -35.740
  119    HA   ILE  17           HA       ILE  17 -23.263 -34.882 -34.882
  120    HB   ILE  17           HB       ILE  17 -24.575 -37.369 -37.369
  121   1HG1  ILE  17          2HG1      ILE  17 -24.624 -34.598 -34.598
  122   2HG1  ILE  17          1HG1      ILE  17 -25.996 -35.372 -35.372
  123   1HG2  ILE  17          1HG2      ILE  17 -22.214 -35.699 -35.699
  124   2HG2  ILE  17          3HG2      ILE  17 -23.007 -36.779 -36.779
  125   3HG2  ILE  17          2HG2      ILE  17 -22.287 -37.430 -37.430
  126   1HD1  ILE  17          2HD1      ILE  17 -25.695 -37.233 -37.233
  127   2HD1  ILE  17          1HD1      ILE  17 -24.669 -36.087 -36.087
  128   3HD1  ILE  17          3HD1      ILE  17 -26.360 -35.696 -35.696
  129    H    GLN  18           H        GLN  18 -22.182 -35.262 -35.262
  130    HA   GLN  18           HA       GLN  18 -21.261 -37.961 -37.961
  131   1HB   GLN  18          2HB       GLN  18 -23.387 -36.946 -36.946
  132   2HB   GLN  18          1HB       GLN  18 -21.961 -37.267 -37.267
  133   1HG   GLN  18          2HG       GLN  18 -22.074 -39.507 -39.507
  134   2HG   GLN  18          1HG       GLN  18 -23.783 -39.118 -39.118
  135   1HE2  GLN  18          2HE2      GLN  18 -21.987 -41.047 -41.047
  136   2HE2  GLN  18          1HE2      GLN  18 -21.499 -40.977 -40.977
  137    H    ASN  19           H        ASN  19 -20.177 -35.313 -35.313
  138    HA   ASN  19           HA       ASN  19 -18.648 -34.532 -34.532
  139   1HB   ASN  19          2HB       ASN  19 -18.774 -33.539 -33.539
  140   2HB   ASN  19          1HB       ASN  19 -17.543 -32.967 -32.967
  141   1HD2  ASN  19          2HD2      ASN  19 -20.651 -30.819 -30.819
  142   2HD2  ASN  19          1HD2      ASN  19 -19.715 -31.520 -31.520
  143    H    LEU  20           H        LEU  20 -17.234 -34.838 -34.838
  144    HA   LEU  20           HA       LEU  20 -15.814 -37.199 -37.199
  145   1HB   LEU  20          2HB       LEU  20 -14.717 -36.249 -36.249
  146   2HB   LEU  20          1HB       LEU  20 -14.342 -34.779 -34.779
  147    HG   LEU  20           HG       LEU  20 -12.733 -35.933 -35.933
  148   1HD1  LEU  20          3HD1      LEU  20 -13.989 -38.349 -38.349
  149   2HD1  LEU  20          2HD1      LEU  20 -12.272 -38.407 -38.407
  150   3HD1  LEU  20          1HD1      LEU  20 -13.456 -38.044 -38.044
  151   1HD2  LEU  20          3HD2      LEU  20 -12.552 -36.313 -36.313
  152   2HD2  LEU  20          2HD2      LEU  20 -11.663 -35.205 -35.205
  153   3HD2  LEU  20          1HD2      LEU  20 -11.272 -36.925 -36.925
  154    H    HIS  21           H        HIS  21 -14.450 -34.017 -34.017
  155    HA   HIS  21           HA       HIS  21 -14.404 -34.850 -34.850
  156   1HB   HIS  21          2HB       HIS  21 -12.298 -33.427 -33.427
  157   2HB   HIS  21          1HB       HIS  21 -12.150 -34.948 -34.948
  158    HD1  HIS  21           HD1      HIS  21 -13.258 -31.490 -31.490
  159    HD2  HIS  21           HD2      HIS  21 -10.495 -34.457 -34.457
  160    HE1  HIS  21           HE1      HIS  21 -12.041 -30.671 -30.671
  161    HE2  HIS  21           HE2      HIS  21 -10.410 -32.506 -32.506
  162    H    SER  22           H        SER  22 -13.727 -32.700 -32.700
  163    HA   SER  22           HA       SER  22 -16.005 -31.078 -31.078
  164   1HB   SER  22          2HB       SER  22 -14.464 -31.439 -31.439
  165   2HB   SER  22          1HB       SER  22 -13.301 -30.370 -30.370
  166    HG   SER  22           HG       SER  22 -15.398 -29.719 -29.719
  167    H    PHE  23           H        PHE  23 -16.577 -29.757 -29.757
  168    HA   PHE  23           HA       PHE  23 -14.849 -28.652 -28.652
  169   1HB   PHE  23          2HB       PHE  23 -16.825 -27.087 -27.087
  170   2HB   PHE  23          1HB       PHE  23 -17.126 -28.815 -28.815
  171    HD1  PHE  23           HD1      PHE  23 -17.431 -25.996 -25.996
  172    HD2  PHE  23           HD2      PHE  23 -18.878 -29.797 -29.797
  173    HE1  PHE  23           HE1      PHE  23 -19.290 -25.812 -25.812
  174    HE2  PHE  23           HE2      PHE  23 -20.740 -29.619 -29.619
  175    HZ   PHE  23           HZ       PHE  23 -20.948 -27.624 -27.624
  176    H    ASP  24           H        ASP  24 -13.963 -26.612 -26.612
  177    HA   ASP  24           HA       ASP  24 -13.892 -24.960 -24.960
  178   1HB   ASP  24          2HB       ASP  24 -11.745 -25.285 -25.285
  179   2HB   ASP  24          1HB       ASP  24 -11.639 -24.245 -24.245
  180    HA   PRO  25           HA       PRO  25 -15.706 -21.555 -21.555
  181   1HB   PRO  25          2HB       PRO  25 -13.564 -19.903 -19.903
  182   2HB   PRO  25          1HB       PRO  25 -15.319 -19.698 -19.698
  183   1HG   PRO  25          2HG       PRO  25 -13.989 -20.623 -20.623
  184   2HG   PRO  25          1HG       PRO  25 -15.585 -21.265 -21.265
  185   1HD   PRO  25          2HD       PRO  25 -12.883 -22.472 -22.472
  186   2HD   PRO  25          1HD       PRO  25 -14.423 -23.257 -23.257
  187    H    PHE  26           H        PHE  26 -12.282 -22.186 -22.186
  188    HA   PHE  26           HA       PHE  26 -12.130 -20.620 -20.620
  189   1HB   PHE  26          2HB       PHE  26  -9.650 -21.680 -21.680
  190   2HB   PHE  26          1HB       PHE  26  -9.924 -20.156 -20.156
  191    HD1  PHE  26           HD1      PHE  26 -10.609 -21.940 -21.940
  192    HD2  PHE  26           HD2      PHE  26 -10.235 -18.189 -18.189
  193    HE1  PHE  26           HE1      PHE  26 -10.743 -20.788 -20.788
  194    HE2  PHE  26           HE2      PHE  26 -10.369 -17.031 -17.031
  195    HZ   PHE  26           HZ       PHE  26 -10.623 -18.331 -18.331
  196    H    ALA  27           H        ALA  27 -13.259 -23.329 -23.329
  197    HA   ALA  27           HA       ALA  27 -11.458 -25.274 -25.274
  198   1HB   ALA  27          1HB       ALA  27 -14.463 -25.152 -25.152
  199   2HB   ALA  27          3HB       ALA  27 -13.476 -26.576 -26.576
  200   3HB   ALA  27          2HB       ALA  27 -13.530 -25.899 -25.899
  201    H    ASP  28           H        ASP  28 -10.351 -24.076 -24.076
  202    HA   ASP  28           HA       ASP  28 -11.894 -23.721 -23.721
  203   1HB   ASP  28          2HB       ASP  28 -10.124 -22.019 -22.019
  204   2HB   ASP  28          1HB       ASP  28  -9.072 -22.859 -22.859
  205    H    ALA  29           H        ALA  29  -9.299 -25.544 -25.544
  206    HA   ALA  29           HA       ALA  29  -8.135 -27.370 -27.370
  207   1HB   ALA  29          3HB       ALA  29 -10.461 -28.110 -28.110
  208   2HB   ALA  29          2HB       ALA  29 -10.099 -27.586 -27.586
  209   3HB   ALA  29          1HB       ALA  29  -9.151 -28.874 -28.874
  210    H    SER  30           H        SER  30  -6.501 -27.988 -27.988
  211    HA   SER  30           HA       SER  30  -4.830 -27.607 -27.607
  212   1HB   SER  30          2HB       SER  30  -5.445 -27.167 -27.167
  213   2HB   SER  30          1HB       SER  30  -6.938 -27.805 -27.805
  214    HG   SER  30           HG       SER  30  -6.283 -25.177 -25.177
  215    H    LYS  31           H        LYS  31  -4.204 -25.507 -25.507
  216    HA   LYS  31           HA       LYS  31  -3.237 -23.448 -23.448
  217   1HB   LYS  31          2HB       LYS  31  -5.779 -23.013 -23.013
  218   2HB   LYS  31          1HB       LYS  31  -4.839 -22.328 -22.328
  219   1HG   LYS  31          2HG       LYS  31  -4.774 -20.469 -20.469
  220   2HG   LYS  31          1HG       LYS  31  -3.593 -21.310 -21.310
  221   1HD   LYS  31          2HD       LYS  31  -5.376 -20.331 -20.331
  222   2HD   LYS  31          1HD       LYS  31  -5.388 -22.092 -22.092
  223   1HE   LYS  31          2HE       LYS  31  -7.416 -22.253 -22.253
  224   2HE   LYS  31          1HE       LYS  31  -7.055 -21.012 -21.012
  225   1HZ   LYS  31          3HZ       LYS  31  -7.285 -19.436 -19.436
  226   2HZ   LYS  31          2HZ       LYS  31  -8.174 -20.710 -20.710
  227   3HZ   LYS  31          1HZ       LYS  31  -8.672 -20.003 -20.003
  228    H    GLY  32           H        GLY  32  -1.238 -23.264 -23.264
  229   1HA   GLY  32          2HA       GLY  32  -0.020 -22.295 -22.295
  230   2HA   GLY  32          1HA       GLY  32  -0.816 -23.551 -23.551
  231    H    ASP  33           H        ASP  33  -0.539 -25.723 -25.723
  232    HA   ASP  33           HA       ASP  33   2.316 -25.974 -25.974
  233   1HB   ASP  33          2HB       ASP  33   0.841 -27.877 -27.877
  234   2HB   ASP  33          1HB       ASP  33   2.514 -28.033 -28.033
  235    H    ASP  34           H        ASP  34  -0.017 -25.859 -25.859
  236    HA   ASP  34           HA       ASP  34   0.249 -28.479 -28.479
  237   1HB   ASP  34          2HB       ASP  34  -2.225 -27.172 -27.172
  238   2HB   ASP  34          1HB       ASP  34  -2.300 -27.839 -27.839
  239    H    LEU  35           H        LEU  35  -1.295 -25.303 -25.303
  240    HA   LEU  35           HA       LEU  35  -0.095 -25.280 -25.280
  241   1HB   LEU  35          2HB       LEU  35  -2.773 -25.044 -25.044
  242   2HB   LEU  35          1HB       LEU  35  -2.278 -23.406 -23.406
  243    HG   LEU  35           HG       LEU  35  -3.262 -24.528 -24.528
  244   1HD1  LEU  35          2HD1      LEU  35  -0.400 -23.690 -23.690
  245   2HD1  LEU  35          1HD1      LEU  35  -1.148 -24.301 -24.301
  246   3HD1  LEU  35          3HD1      LEU  35  -1.817 -22.882 -22.882
  247   1HD2  LEU  35          2HD2      LEU  35  -2.109 -26.786 -26.786
  248   2HD2  LEU  35          1HD2      LEU  35  -2.625 -26.546 -26.546
  249   3HD2  LEU  35          3HD2      LEU  35  -0.935 -26.310 -26.310
  250    H    LEU  36           H        LEU  36   1.646 -24.015 -24.015
  251    HA   LEU  36           HA       LEU  36   2.146 -21.960 -21.960
  252   1HB   LEU  36          2HB       LEU  36   3.384 -22.702 -22.702
  253   2HB   LEU  36          1HB       LEU  36   3.921 -21.289 -21.289
  254    HG   LEU  36           HG       LEU  36   5.379 -23.186 -23.186
  255   1HD1  LEU  36          3HD1      LEU  36   4.579 -21.471 -21.471
  256   2HD1  LEU  36          2HD1      LEU  36   3.846 -22.902 -22.902
  257   3HD1  LEU  36          1HD1      LEU  36   5.586 -22.850 -22.850
  258   1HD2  LEU  36          1HD2      LEU  36   3.508 -24.876 -24.876
  259   2HD2  LEU  36          3HD2      LEU  36   4.664 -25.226 -25.226
  260   3HD2  LEU  36          2HD2      LEU  36   3.070 -24.588 -24.588
  261    HA   PRO  37           HA       PRO  37  -0.099 -18.575 -18.575
  262   1HB   PRO  37          2HB       PRO  37   1.261 -16.493 -16.493
  263   2HB   PRO  37          1HB       PRO  37   0.229 -17.538 -17.538
  264   1HG   PRO  37          2HG       PRO  37   3.205 -17.583 -17.583
  265   2HG   PRO  37          1HG       PRO  37   2.242 -17.746 -17.746
  266   1HD   PRO  37          2HD       PRO  37   3.308 -19.875 -19.875
  267   2HD   PRO  37          1HD       PRO  37   1.797 -19.970 -19.970
  268    H    ALA  38           H        ALA  38   0.094 -18.311 -18.311
  269    HA   ALA  38           HA       ALA  38   2.447 -16.854 -16.854
  270   1HB   ALA  38          1HB       ALA  38   2.142 -19.505 -19.505
  271   2HB   ALA  38          3HB       ALA  38   1.334 -18.800 -18.800
  272   3HB   ALA  38          2HB       ALA  38   3.012 -18.385 -18.385
  273    H    GLY  39           H        GLY  39   1.813 -15.013 -15.013
  274   1HA   GLY  39          2HA       GLY  39   0.471 -14.281 -14.281
  275   2HA   GLY  39          1HA       GLY  39  -0.904 -14.864 -14.864
  276    H    THR  40           H        THR  40  -0.270 -13.942 -13.942
  277    HA   THR  40           HA       THR  40  -0.443 -11.032 -11.032
  278    HB   THR  40           HB       THR  40  -1.348 -11.655 -11.655
  279    HG1  THR  40           HG1      THR  40  -2.587 -13.343 -13.343
  280   1HG2  THR  40          2HG2      THR  40  -2.199 -10.013 -10.013
  281   2HG2  THR  40          1HG2      THR  40  -3.293 -11.346 -11.346
  282   3HG2  THR  40          3HG2      THR  40  -3.288 -10.631 -10.631
  283    H    GLU  41           H        GLU  41   1.482 -13.494 -13.494
  284    HA   GLU  41           HA       GLU  41   3.375 -13.490 -13.490
  285   1HB   GLU  41          2HB       GLU  41   3.335 -10.947 -10.947
  286   2HB   GLU  41          1HB       GLU  41   4.162 -10.818 -10.818
  287   1HG   GLU  41          2HG       GLU  41   4.810 -12.995 -12.995
  288   2HG   GLU  41          1HG       GLU  41   5.550 -11.399 -11.399
  289    H    ASP  42           H        ASP  42   0.644 -12.706 -12.706
  290    HA   ASP  42           HA       ASP  42  -0.251 -12.067 -12.067
  291   1HB   ASP  42          2HB       ASP  42   1.222 -14.055 -14.055
  292   2HB   ASP  42          1HB       ASP  42   2.412 -12.893 -12.893
  293    H    TYR  43           H        TYR  43   0.161  -9.816  -9.816
  294    HA   TYR  43           HA       TYR  43   2.192  -8.177  -8.177
  295   1HB   TYR  43          2HB       TYR  43  -0.434  -7.378  -7.378
  296   2HB   TYR  43          1HB       TYR  43   0.921  -6.300  -6.300
  297    HD1  TYR  43           HD1      TYR  43   2.987  -8.573  -8.573
  298    HD2  TYR  43           HD2      TYR  43  -0.421  -6.798  -6.798
  299    HE1  TYR  43           HE1      TYR  43   3.914  -9.087  -9.087
  300    HE2  TYR  43           HE2      TYR  43   0.498  -7.318  -7.318
  301    HH   TYR  43           HH       TYR  43   2.476  -9.391  -9.391
  302    H    ILE  44           H        ILE  44   1.510  -6.072  -6.072
  303    HA   ILE  44           HA       ILE  44  -0.293  -6.815  -6.815
  304    HB   ILE  44           HB       ILE  44   2.135  -5.022  -5.022
  305   1HG1  ILE  44          2HG1      ILE  44   2.952  -7.226  -7.226
  306   2HG1  ILE  44          1HG1      ILE  44   2.885  -6.846  -6.846
  307   1HG2  ILE  44          2HG2      ILE  44  -0.019  -5.673  -5.673
  308   2HG2  ILE  44          1HG2      ILE  44   1.611  -5.311  -5.311
  309   3HG2  ILE  44          3HG2      ILE  44   0.721  -4.116  -4.116
  310   1HD1  ILE  44          2HD1      ILE  44   0.571  -7.978  -7.978
  311   2HD1  ILE  44          1HD1      ILE  44   1.140  -8.668  -8.668
  312   3HD1  ILE  44          3HD1      ILE  44   2.021  -8.982  -8.982
  313    H    HIS  45           H        HIS  45  -2.143  -5.884  -5.884
  314    HA   HIS  45           HA       HIS  45  -2.352  -3.363  -3.363
  315   1HB   HIS  45          2HB       HIS  45  -4.085  -5.497  -5.497
  316   2HB   HIS  45          1HB       HIS  45  -4.783  -3.991  -3.991
  317    HD1  HIS  45           HD1      HIS  45  -3.792  -5.747  -5.747
  318    HD2  HIS  45           HD2      HIS  45  -5.827  -2.333  -2.333
  319    HE1  HIS  45           HE1      HIS  45  -4.924  -4.869  -4.869
  320    HE2  HIS  45           HE2      HIS  45  -6.194  -2.832  -2.832
  321    H    ILE  46           H        ILE  46  -2.206  -1.408  -1.408
  322    HA   ILE  46           HA       ILE  46  -2.154  -1.005  -1.005
  323    HB   ILE  46           HB       ILE  46  -1.751   0.946   0.946
  324   1HG1  ILE  46          2HG1      ILE  46  -0.027  -0.840  -0.840
  325   2HG1  ILE  46          1HG1      ILE  46   0.592   0.793   0.793
  326   1HG2  ILE  46          2HG2      ILE  46  -1.790   1.320   1.320
  327   2HG2  ILE  46          1HG2      ILE  46  -0.696   2.291   2.291
  328   3HG2  ILE  46          3HG2      ILE  46  -2.436   2.357   2.357
  329   1HD1  ILE  46          2HD1      ILE  46   0.105   0.321   0.321
  330   2HD1  ILE  46          1HD1      ILE  46   0.172  -1.364  -1.364
  331   3HD1  ILE  46          3HD1      ILE  46   1.564  -0.309  -0.309
  332    H    ARG  47           H        ARG  47  -3.551   1.517   1.517
  333    HA   ARG  47           HA       ARG  47  -5.725   2.186   2.186
  334   1HB   ARG  47          2HB       ARG  47  -6.262  -0.336  -0.336
  335   2HB   ARG  47          1HB       ARG  47  -6.845   0.424   0.424
  336   1HG   ARG  47          2HG       ARG  47  -7.730   1.285   1.285
  337   2HG   ARG  47          1HG       ARG  47  -8.557   0.038   0.038
  338   1HD   ARG  47          2HD       ARG  47  -8.193   2.226   2.226
  339   2HD   ARG  47          1HD       ARG  47  -8.758   2.892   2.892
  340    HE   ARG  47           HE       ARG  47 -10.311   1.489   1.489
  341   1HH1  ARG  47          2HH1      ARG  47  -9.817   1.718   1.718
  342   2HH1  ARG  47          1HH1      ARG  47 -11.433   1.233   1.233
  343   1HH2  ARG  47          1HH2      ARG  47 -12.437   0.854   0.854
  344   2HH2  ARG  47          2HH2      ARG  47 -12.921   0.744   0.744
  345    H    ILE  48           H        ILE  48  -6.336   4.036   4.036
  346    HA   ILE  48           HA       ILE  48  -5.971   4.663   4.663
  347    HB   ILE  48           HB       ILE  48  -5.681   6.308   6.308
  348   1HG1  ILE  48          2HG1      ILE  48  -4.163   6.146   6.146
  349   2HG1  ILE  48          1HG1      ILE  48  -3.675   5.458   5.458
  350   1HG2  ILE  48          1HG2      ILE  48  -6.519   7.411   7.411
  351   2HG2  ILE  48          3HG2      ILE  48  -5.798   8.383   8.383
  352   3HG2  ILE  48          2HG2      ILE  48  -7.348   7.586   7.586
  353   1HD1  ILE  48          1HD1      ILE  48  -4.063   8.403   8.403
  354   2HD1  ILE  48          3HD1      ILE  48  -2.517   7.576   7.576
  355   3HD1  ILE  48          2HD1      ILE  48  -3.306   7.607   7.607
  356    H    GLN  49           H        GLN  49  -7.618   5.990   5.990
  357    HA   GLN  49           HA       GLN  49 -10.167   6.117   6.117
  358   1HB   GLN  49          2HB       GLN  49 -11.385   5.231   5.231
  359   2HB   GLN  49          1HB       GLN  49 -10.282   4.049   4.049
  360   1HG   GLN  49          2HG       GLN  49  -9.126   3.868   3.868
  361   2HG   GLN  49          1HG       GLN  49  -9.074   5.613   5.613
  362   1HE2  GLN  49          2HE2      GLN  49 -12.242   3.492   3.492
  363   2HE2  GLN  49          1HE2      GLN  49 -11.450   2.975   2.975
  364    H    GLN  50           H        GLN  50 -10.106   8.315   8.315
  365    HA   GLN  50           HA       GLN  50  -9.901   9.841   9.841
  366   1HB   GLN  50          2HB       GLN  50  -8.761  10.272  10.272
  367   2HB   GLN  50          1HB       GLN  50 -10.105  11.404  11.404
  368   1HG   GLN  50          2HG       GLN  50  -9.270  12.491  12.491
  369   2HG   GLN  50          1HG       GLN  50  -8.104  11.207  11.207
  370   1HE2  GLN  50          2HE2      GLN  50  -6.060  13.811  13.811
  371   2HE2  GLN  50          1HE2      GLN  50  -6.854  13.357  13.357
  372    H    ARG  51           H        ARG  51 -11.668  10.668  10.668
  373    HA   ARG  51           HA       ARG  51 -14.204  10.455  10.455
  374   1HB   ARG  51          2HB       ARG  51 -13.340  10.579  10.579
  375   2HB   ARG  51          1HB       ARG  51 -14.822  11.462  11.462
  376   1HG   ARG  51          2HG       ARG  51 -15.459   9.289   9.289
  377   2HG   ARG  51          1HG       ARG  51 -15.694   9.370   9.370
  378   1HD   ARG  51          2HD       ARG  51 -13.212   8.441   8.441
  379   2HD   ARG  51          1HD       ARG  51 -13.697   7.843   7.843
  380    HE   ARG  51           HE       ARG  51 -14.489   6.808   6.808
  381   1HH1  ARG  51          2HH1      ARG  51 -15.641   7.365   7.365
  382   2HH1  ARG  51          1HH1      ARG  51 -16.794   6.073   6.073
  383   1HH2  ARG  51          1HH2      ARG  51 -16.004   5.109   5.109
  384   2HH2  ARG  51          2HH2      ARG  51 -17.000   4.792   4.792
  385    H    ASN  52           H        ASN  52 -15.262  12.106  12.106
  386    HA   ASN  52           HA       ASN  52 -15.702  14.202  14.202
  387   1HB   ASN  52          2HB       ASN  52 -16.593  14.312  14.312
  388   2HB   ASN  52          1HB       ASN  52 -15.066  15.032  15.032
  389   1HD2  ASN  52          2HD2      ASN  52 -15.923  18.227  18.227
  390   2HD2  ASN  52          1HD2      ASN  52 -14.828  17.158  17.158
  391    H    GLY  53           H        GLY  53 -12.913  13.284  13.284
  392   1HA   GLY  53          2HA       GLY  53 -11.025  14.230  14.230
  393   2HA   GLY  53          1HA       GLY  53 -11.741  15.817  15.817
  394    H    ARG  54           H        ARG  54 -11.679  13.807  13.807
  395    HA   ARG  54           HA       ARG  54  -9.119  14.842  14.842
  396   1HB   ARG  54          2HB       ARG  54 -10.039  15.808  15.808
  397   2HB   ARG  54          1HB       ARG  54 -10.798  16.552  16.552
  398   1HG   ARG  54          2HG       ARG  54 -12.833  15.579  15.579
  399   2HG   ARG  54          1HG       ARG  54 -12.131  14.226  14.226
  400   1HD   ARG  54          2HD       ARG  54 -11.473  15.932  15.932
  401   2HD   ARG  54          1HD       ARG  54 -12.542  17.056  17.056
  402    HE   ARG  54           HE       ARG  54 -13.963  14.702  14.702
  403   1HH1  ARG  54          2HH1      ARG  54 -12.530  17.351  17.351
  404   2HH1  ARG  54          1HH1      ARG  54 -13.655  17.250  17.250
  405   1HH2  ARG  54          1HH2      ARG  54 -15.446  14.569  14.569
  406   2HH2  ARG  54          2HH2      ARG  54 -15.310  15.671  15.671
  407    H    LYS  55           H        LYS  55  -9.035  14.094  14.094
  408    HA   LYS  55           HA       LYS  55  -8.441  12.198  12.198
  409   1HB   LYS  55          2HB       LYS  55 -11.353  11.617  11.617
  410   2HB   LYS  55          1HB       LYS  55 -10.395  10.878  10.878
  411   1HG   LYS  55          2HG       LYS  55 -11.129  13.789  13.789
  412   2HG   LYS  55          1HG       LYS  55 -11.786  12.623  12.623
  413   1HD   LYS  55          2HD       LYS  55  -8.901  13.493  13.493
  414   2HD   LYS  55          1HD       LYS  55 -10.079  14.065  14.065
  415   1HE   LYS  55          2HE       LYS  55 -10.363  11.475  11.475
  416   2HE   LYS  55          1HE       LYS  55  -8.729  11.423  11.423
  417   1HZ   LYS  55          3HZ       LYS  55  -9.360  13.361  13.361
  418   2HZ   LYS  55          2HZ       LYS  55  -9.102  11.742  11.742
  419   3HZ   LYS  55          1HZ       LYS  55  -7.886  12.617  12.617
  420    H    THR  56           H        THR  56  -7.026  11.399  11.399
  421    HA   THR  56           HA       THR  56  -8.076   9.349   9.349
  422    HB   THR  56           HB       THR  56  -5.172   9.635   9.635
  423    HG1  THR  56           HG1      THR  56  -5.010  11.711  11.711
  424   1HG2  THR  56          2HG2      THR  56  -7.199   9.230   9.230
  425   2HG2  THR  56          1HG2      THR  56  -6.152  10.570  10.570
  426   3HG2  THR  56          3HG2      THR  56  -5.454   8.988   8.988
  427    H    LEU  57           H        LEU  57  -7.337   7.183   7.183
  428    HA   LEU  57           HA       LEU  57  -5.861   6.222   6.222
  429   1HB   LEU  57          2HB       LEU  57  -8.714   5.986   5.986
  430   2HB   LEU  57          1HB       LEU  57  -7.976   4.396   4.396
  431    HG   LEU  57           HG       LEU  57  -6.786   5.170   5.170
  432   1HD1  LEU  57          3HD1      LEU  57  -8.595   7.441   7.441
  433   2HD1  LEU  57          2HD1      LEU  57  -8.500   6.880   6.880
  434   3HD1  LEU  57          1HD1      LEU  57  -7.039   7.398   7.398
  435   1HD2  LEU  57          3HD2      LEU  57  -9.371   4.068   4.068
  436   2HD2  LEU  57          2HD2      LEU  57  -8.271   3.767   3.767
  437   3HD2  LEU  57          1HD2      LEU  57  -9.443   5.082   5.082
  438    H    THR  58           H        THR  58  -4.229   5.662   5.662
  439    HA   THR  58           HA       THR  58  -4.660   4.092   4.092
  440    HB   THR  58           HB       THR  58  -2.056   3.960   3.960
  441    HG1  THR  58           HG1      THR  58  -3.297   6.315   6.315
  442   1HG2  THR  58          2HG2      THR  58  -2.849   3.412   3.412
  443   2HG2  THR  58          1HG2      THR  58  -2.076   4.993   4.993
  444   3HG2  THR  58          3HG2      THR  58  -1.191   3.633   3.633
  445    H    THR  59           H        THR  59  -5.116   1.986   1.986
  446    HA   THR  59           HA       THR  59  -4.673   0.296   0.296
  447    HB   THR  59           HB       THR  59  -6.227  -1.219  -1.219
  448    HG1  THR  59           HG1      THR  59  -7.264   0.006   0.006
  449   1HG2  THR  59          3HG2      THR  59  -6.714   0.451   0.451
  450   2HG2  THR  59          2HG2      THR  59  -8.145   0.141   0.141
  451   3HG2  THR  59          1HG2      THR  59  -7.207  -1.208  -1.208
  452    H    VAL  60           H        VAL  60  -4.009  -1.932  -1.932
  453    HA   VAL  60           HA       VAL  60  -2.356  -2.287  -2.287
  454    HB   VAL  60           HB       VAL  60  -1.597  -3.091  -3.091
  455   1HG1  VAL  60          3HG1      VAL  60  -0.840  -4.685  -4.685
  456   2HG1  VAL  60          2HG1      VAL  60  -0.012  -3.359  -3.359
  457   3HG1  VAL  60          1HG1      VAL  60   0.496  -3.857  -3.857
  458   1HG2  VAL  60          2HG2      VAL  60  -0.815  -0.823  -0.823
  459   2HG2  VAL  60          1HG2      VAL  60  -1.176  -0.828  -0.828
  460   3HG2  VAL  60          3HG2      VAL  60   0.356  -1.480  -1.480
  461    H    GLN  61           H        GLN  61  -3.155  -3.907  -3.907
  462    HA   GLN  61           HA       GLN  61  -4.210  -6.257  -6.257
  463   1HB   GLN  61          2HB       GLN  61  -5.155  -6.155  -6.155
  464   2HB   GLN  61          1HB       GLN  61  -6.080  -6.188  -6.188
  465   1HG   GLN  61          2HG       GLN  61  -5.668  -3.686  -3.686
  466   2HG   GLN  61          1HG       GLN  61  -5.107  -3.802  -3.802
  467   1HE2  GLN  61          2HE2      GLN  61  -8.565  -5.139  -5.139
  468   2HE2  GLN  61          1HE2      GLN  61  -7.037  -5.929  -5.929
  469    H    GLY  62           H        GLY  62  -3.539  -8.264  -8.264
  470   1HA   GLY  62          2HA       GLY  62  -2.569  -9.700  -9.700
  471   2HA   GLY  62          1HA       GLY  62  -1.529  -8.346  -8.346
  472    H    ILE  63           H        ILE  63  -1.129  -7.679  -7.679
  473    HA   ILE  63           HA       ILE  63   1.245  -9.132  -9.132
  474    HB   ILE  63           HB       ILE  63  -0.362  -7.285  -7.285
  475   1HG1  ILE  63          2HG1      ILE  63   0.691  -5.941  -5.941
  476   2HG1  ILE  63          1HG1      ILE  63   1.930  -6.003  -6.003
  477   1HG2  ILE  63          2HG2      ILE  63   1.877  -9.026  -9.026
  478   2HG2  ILE  63          1HG2      ILE  63   2.016  -7.343  -7.343
  479   3HG2  ILE  63          3HG2      ILE  63   0.616  -8.300  -8.300
  480   1HD1  ILE  63          1HD1      ILE  63   3.050  -7.797  -7.797
  481   2HD1  ILE  63          3HD1      ILE  63   1.844  -7.593  -7.593
  482   3HD1  ILE  63          2HD1      ILE  63   2.940  -6.268  -6.268
  483    H    ALA  64           H        ALA  64   1.784 -10.672 -10.672
  484    HA   ALA  64           HA       ALA  64  -0.270 -12.593 -12.593
  485   1HB   ALA  64          3HB       ALA  64   2.298 -12.905 -12.905
  486   2HB   ALA  64          2HB       ALA  64   2.418 -12.817 -12.817
  487   3HB   ALA  64          1HB       ALA  64   1.414 -14.055 -14.055
  488    H    ASP  65           H        ASP  65  -1.087 -13.249 -13.249
  489    HA   ASP  65           HA       ASP  65  -1.311 -11.225 -11.225
  490   1HB   ASP  65          2HB       ASP  65  -3.019 -13.066 -13.066
  491   2HB   ASP  65          1HB       ASP  65  -2.150 -14.071 -14.071
  492    H    ASP  66           H        ASP  66   1.050 -13.538 -13.538
  493    HA   ASP  66           HA       ASP  66   1.738 -13.908 -13.908
  494   1HB   ASP  66          2HB       ASP  66   3.162 -15.003 -15.003
  495   2HB   ASP  66          1HB       ASP  66   3.342 -15.535 -15.535
  496    H    TYR  67           H        TYR  67   1.996 -11.295 -11.295
  497    HA   TYR  67           HA       TYR  67   4.871 -10.881 -10.881
  498   1HB   TYR  67          2HB       TYR  67   2.481  -9.232  -9.232
  499   2HB   TYR  67          1HB       TYR  67   4.052  -8.471  -8.471
  500    HD1  TYR  67           HD2      TYR  67   4.055 -11.861 -11.861
  501    HD2  TYR  67           HD1      TYR  67   3.845  -7.748  -7.748
  502    HE1  TYR  67           HE2      TYR  67   4.639 -12.425 -12.425
  503    HE2  TYR  67           HE1      TYR  67   4.419  -8.291  -8.291
  504    HH   TYR  67           HH       TYR  67   5.700 -10.253 -10.253
  505    H    ASP  68           H        ASP  68   3.181 -11.348 -11.348
  506    HA   ASP  68           HA       ASP  68   3.010 -10.548 -10.548
  507   1HB   ASP  68          2HB       ASP  68   5.699 -10.403 -10.403
  508   2HB   ASP  68          1HB       ASP  68   5.389  -8.920  -8.920
  509    H    LYS  69           H        LYS  69   1.206  -9.200  -9.200
  510    HA   LYS  69           HA       LYS  69   0.919  -6.760  -6.760
  511   1HB   LYS  69          2HB       LYS  69  -0.204  -7.928  -7.928
  512   2HB   LYS  69          1HB       LYS  69  -0.576  -6.259  -6.259
  513   1HG   LYS  69          2HG       LYS  69  -2.351  -7.509  -7.509
  514   2HG   LYS  69          1HG       LYS  69  -1.332  -7.148  -7.148
  515   1HD   LYS  69          2HD       LYS  69  -0.596  -9.322  -9.322
  516   2HD   LYS  69          1HD       LYS  69  -0.886  -9.682  -9.682
  517   1HE   LYS  69          2HE       LYS  69  -3.399  -9.221  -9.221
  518   2HE   LYS  69          1HE       LYS  69  -2.752  -9.737  -9.737
  519   1HZ   LYS  69          3HZ       LYS  69  -2.401 -11.312 -11.312
  520   2HZ   LYS  69          2HZ       LYS  69  -3.706 -11.538 -11.538
  521   3HZ   LYS  69          1HZ       LYS  69  -2.128 -11.813 -11.813
  522    H    LYS  70           H        LYS  70   2.503  -7.404  -7.404
  523    HA   LYS  70           HA       LYS  70   2.822  -4.738  -4.738
  524   1HB   LYS  70          2HB       LYS  70   4.789  -6.957  -6.957
  525   2HB   LYS  70          1HB       LYS  70   4.436  -5.552  -5.552
  526   1HG   LYS  70          2HG       LYS  70   1.992  -6.797  -6.797
  527   2HG   LYS  70          1HG       LYS  70   3.127  -8.145  -8.145
  528   1HD   LYS  70          2HD       LYS  70   4.147  -7.001  -7.001
  529   2HD   LYS  70          1HD       LYS  70   2.792  -5.872  -5.872
  530   1HE   LYS  70          2HE       LYS  70   1.303  -7.415  -7.415
  531   2HE   LYS  70          1HE       LYS  70   2.130  -8.756  -8.756
  532   1HZ   LYS  70          3HZ       LYS  70   3.845  -8.644  -8.644
  533   2HZ   LYS  70          2HZ       LYS  70   3.004  -7.398  -7.398
  534   3HZ   LYS  70          1HZ       LYS  70   2.318  -8.940  -8.940
  535    H    LYS  71           H        LYS  71   5.328  -6.870  -6.870
  536    HA   LYS  71           HA       LYS  71   6.932  -4.607  -4.607
  537   1HB   LYS  71          2HB       LYS  71   7.928  -6.742  -6.742
  538   2HB   LYS  71          1HB       LYS  71   7.303  -7.540  -7.540
  539   1HG   LYS  71          2HG       LYS  71   8.760  -6.373  -6.373
  540   2HG   LYS  71          1HG       LYS  71   9.146  -5.180  -5.180
  541   1HD   LYS  71          2HD       LYS  71  10.454  -6.718  -6.718
  542   2HD   LYS  71          1HD       LYS  71   9.808  -8.095  -8.095
  543   1HE   LYS  71          2HE       LYS  71  11.614  -5.933  -5.933
  544   2HE   LYS  71          1HE       LYS  71  12.067  -7.601  -7.601
  545   1HZ   LYS  71          1HZ       LYS  71  10.239  -8.190  -8.190
  546   2HZ   LYS  71          3HZ       LYS  71  10.333  -6.575  -6.575
  547   3HZ   LYS  71          2HZ       LYS  71  11.690  -7.576  -7.576
  548    H    LEU  72           H        LEU  72   4.784  -4.007  -4.007
  549    HA   LEU  72           HA       LEU  72   5.375  -4.381  -4.381
  550   1HB   LEU  72          2HB       LEU  72   3.834  -6.290  -6.290
  551   2HB   LEU  72          1HB       LEU  72   2.594  -5.057  -5.057
  552    HG   LEU  72           HG       LEU  72   4.041  -5.970  -5.970
  553   1HD1  LEU  72          3HD1      LEU  72   1.933  -7.126  -7.126
  554   2HD1  LEU  72          2HD1      LEU  72   1.108  -5.985  -5.985
  555   3HD1  LEU  72          1HD1      LEU  72   2.215  -7.179  -7.179
  556   1HD2  LEU  72          1HD2      LEU  72   2.185  -3.657  -3.657
  557   2HD2  LEU  72          3HD2      LEU  72   3.753  -3.664  -3.664
  558   3HD2  LEU  72          2HD2      LEU  72   2.356  -4.405  -4.405
  559    H    VAL  73           H        VAL  73   2.557  -3.390  -3.390
  560    HA   VAL  73           HA       VAL  73   2.378  -0.913  -0.913
  561    HB   VAL  73           HB       VAL  73   0.339  -2.230  -2.230
  562   1HG1  VAL  73          2HG1      VAL  73   1.306  -2.704  -2.704
  563   2HG1  VAL  73          1HG1      VAL  73   0.339  -1.282  -1.282
  564   3HG1  VAL  73          3HG1      VAL  73  -0.428  -2.698  -2.698
  565   1HG2  VAL  73          1HG2      VAL  73   0.568   0.410   0.410
  566   2HG2  VAL  73          3HG2      VAL  73  -0.980  -0.382  -0.382
  567   3HG2  VAL  73          2HG2      VAL  73  -0.064   0.303   0.303
  568    H    LYS  74           H        LYS  74   3.201  -2.029  -2.029
  569    HA   LYS  74           HA       LYS  74   3.171   0.453   0.453
  570   1HB   LYS  74          2HB       LYS  74   5.042  -1.855  -1.855
  571   2HB   LYS  74          1HB       LYS  74   4.567  -0.590  -0.590
  572   1HG   LYS  74          2HG       LYS  74   2.474  -2.340  -2.340
  573   2HG   LYS  74          1HG       LYS  74   3.467  -2.945  -2.945
  574   1HD   LYS  74          2HD       LYS  74   2.367  -0.248  -0.248
  575   2HD   LYS  74          1HD       LYS  74   1.165  -1.537  -1.537
  576   1HE   LYS  74          2HE       LYS  74   1.735  -2.345  -2.345
  577   2HE   LYS  74          1HE       LYS  74   3.459  -2.236  -2.236
  578   1HZ   LYS  74          1HZ       LYS  74   2.103   0.288   0.288
  579   2HZ   LYS  74          3HZ       LYS  74   2.231  -0.732  -0.732
  580   3HZ   LYS  74          2HZ       LYS  74   3.623  -0.239  -0.239
  581    H    ALA  75           H        ALA  75   5.661  -1.218  -1.218
  582    HA   ALA  75           HA       ALA  75   7.768   0.581   0.581
  583   1HB   ALA  75          2HB       ALA  75   7.295  -1.713  -1.713
  584   2HB   ALA  75          1HB       ALA  75   8.111  -0.464  -0.464
  585   3HB   ALA  75          3HB       ALA  75   8.824  -1.046  -1.046
  586    H    PHE  76           H        PHE  76   5.037   0.674   0.674
  587    HA   PHE  76           HA       PHE  76   5.918   2.557   2.557
  588   1HB   PHE  76          2HB       PHE  76   3.705   1.185   1.185
  589   2HB   PHE  76          1HB       PHE  76   3.088   2.561   2.561
  590    HD1  PHE  76           HD1      PHE  76   4.442   1.481   1.481
  591    HD2  PHE  76           HD2      PHE  76   2.582   4.629   4.629
  592    HE1  PHE  76           HE1      PHE  76   4.017   2.682   2.682
  593    HE2  PHE  76           HE2      PHE  76   2.153   5.832   5.832
  594    HZ   PHE  76           HZ       PHE  76   2.872   4.857   4.857
  595    H    LYS  77           H        LYS  77   4.064   3.096   3.096
  596    HA   LYS  77           HA       LYS  77   4.138   5.910   5.910
  597   1HB   LYS  77          2HB       LYS  77   3.898   4.167   4.167
  598   2HB   LYS  77          1HB       LYS  77   3.409   5.851   5.851
  599   1HG   LYS  77          2HG       LYS  77   1.381   5.046   5.046
  600   2HG   LYS  77          1HG       LYS  77   2.022   4.670   4.670
  601   1HD   LYS  77          2HD       LYS  77   1.254   2.601   2.601
  602   2HD   LYS  77          1HD       LYS  77   2.846   2.487   2.487
  603   1HE   LYS  77          2HE       LYS  77   1.589   1.822   1.822
  604   2HE   LYS  77          1HE       LYS  77   1.516   3.564   3.564
  605   1HZ   LYS  77          1HZ       LYS  77  -0.530   2.425   2.425
  606   2HZ   LYS  77          3HZ       LYS  77  -0.634   2.034   2.034
  607   3HZ   LYS  77          2HZ       LYS  77  -0.651   3.653   3.653
  608    H    LYS  78           H        LYS  78   6.605   3.686   3.686
  609    HA   LYS  78           HA       LYS  78   8.117   5.572   5.572
  610   1HB   LYS  78          2HB       LYS  78   8.033   3.187   3.187
  611   2HB   LYS  78          1HB       LYS  78   8.810   2.759   2.759
  612   1HG   LYS  78          2HG       LYS  78  10.446   4.707   4.707
  613   2HG   LYS  78          1HG       LYS  78   9.987   3.599   3.599
  614   1HD   LYS  78          2HD       LYS  78  10.586   1.767   1.767
  615   2HD   LYS  78          1HD       LYS  78  11.536   3.073   3.073
  616   1HE   LYS  78          2HE       LYS  78  12.866   3.298   3.298
  617   2HE   LYS  78          1HE       LYS  78  11.753   2.334   2.334
  618   1HZ   LYS  78          1HZ       LYS  78  12.395   0.553   0.553
  619   2HZ   LYS  78          3HZ       LYS  78  13.817   1.469   1.469
  620   3HZ   LYS  78          2HZ       LYS  78  13.300   0.760   0.760
  621    H    LYS  79           H        LYS  79   7.836   4.509   4.509
  622    HA   LYS  79           HA       LYS  79  10.513   5.424   5.424
  623   1HB   LYS  79          2HB       LYS  79   9.101   3.333   3.333
  624   2HB   LYS  79          1HB       LYS  79   8.617   4.547   4.547
  625   1HG   LYS  79          2HG       LYS  79  11.233   4.966   4.966
  626   2HG   LYS  79          1HG       LYS  79  11.257   3.285   3.285
  627   1HD   LYS  79          2HD       LYS  79  10.712   2.552   2.552
  628   2HD   LYS  79          1HD       LYS  79   9.357   3.676   3.676
  629   1HE   LYS  79          2HE       LYS  79  11.204   3.896   3.896
  630   2HE   LYS  79          1HE       LYS  79  10.688   5.368   5.368
  631   1HZ   LYS  79          3HZ       LYS  79  12.956   3.836   3.836
  632   2HZ   LYS  79          2HZ       LYS  79  13.197   4.845   4.845
  633   3HZ   LYS  79          1HZ       LYS  79  12.628   5.493   5.493
  634    H    PHE  80           H        PHE  80   7.121   6.176   6.176
  635    HA   PHE  80           HA       PHE  80   8.055   8.699   8.699
  636   1HB   PHE  80          2HB       PHE  80   5.282   7.623   7.623
  637   2HB   PHE  80          1HB       PHE  80   6.205   8.703   8.703
  638    HD1  PHE  80           HD1      PHE  80   5.809   5.214   5.214
  639    HD2  PHE  80           HD2      PHE  80   7.636   7.857   7.857
  640    HE1  PHE  80           HE1      PHE  80   6.483   3.290   3.290
  641    HE2  PHE  80           HE2      PHE  80   8.313   5.937   5.937
  642    HZ   PHE  80           HZ       PHE  80   7.737   3.651   3.651
  643    H    ALA  81           H        ALA  81   6.397   7.416   7.416
  644    HA   ALA  81           HA       ALA  81   5.547   8.472   8.472
  645   1HB   ALA  81          3HB       ALA  81   7.174  10.360  10.360
  646   2HB   ALA  81          2HB       ALA  81   5.665  11.168  11.168
  647   3HB   ALA  81          1HB       ALA  81   5.968  10.686  10.686
  648    H    CYS  82           H        CYS  82   4.027   7.580   7.580
  649    HA   CYS  82           HA       CYS  82   1.727   9.384   9.384
  650   1HB   CYS  82          2HB       CYS  82   2.210   6.880   6.880
  651   2HB   CYS  82          1HB       CYS  82   0.885   8.019   8.019
  652    HG   CYS  82           HG       CYS  82   3.743   9.100   9.100
  653    H    ASN  83           H        ASN  83  -0.369   7.708   7.708
  654    HA   ASN  83           HA       ASN  83  -0.462   6.220   6.220
  655   1HB   ASN  83          2HB       ASN  83  -2.263   8.133   8.133
  656   2HB   ASN  83          1HB       ASN  83  -3.091   6.615   6.615
  657   1HD2  ASN  83          2HD2      ASN  83  -1.246   8.223   8.223
  658   2HD2  ASN  83          1HD2      ASN  83  -0.391   7.993   7.993
  659    H    GLY  84           H        GLY  84  -0.173   4.134   4.134
  660   1HA   GLY  84          2HA       GLY  84  -1.359   2.925   2.925
  661   2HA   GLY  84          1HA       GLY  84  -0.024   2.250   2.250
  662    H    THR  85           H        THR  85  -2.899   1.403   1.403
  663    HA   THR  85           HA       THR  85  -3.494   0.182   0.182
  664    HB   THR  85           HB       THR  85  -5.807   0.695   0.695
  665    HG1  THR  85           HG1      THR  85  -6.831   1.314   1.314
  666   1HG2  THR  85          3HG2      THR  85  -4.208   2.633   2.633
  667   2HG2  THR  85          2HG2      THR  85  -4.700   3.278   3.278
  668   3HG2  THR  85          1HG2      THR  85  -5.907   2.989   2.989
  669    H    VAL  86           H        VAL  86  -5.135  -1.612  -1.612
  670    HA   VAL  86           HA       VAL  86  -4.759  -3.015  -3.015
  671    HB   VAL  86           HB       VAL  86  -3.432  -4.017  -4.017
  672   1HG1  VAL  86          3HG1      VAL  86  -5.462  -3.409  -3.409
  673   2HG1  VAL  86          2HG1      VAL  86  -5.836  -5.103  -5.103
  674   3HG1  VAL  86          1HG1      VAL  86  -4.268  -4.656  -4.656
  675   1HG2  VAL  86          3HG2      VAL  86  -5.579  -5.458  -5.458
  676   2HG2  VAL  86          2HG2      VAL  86  -3.827  -5.649  -5.649
  677   3HG2  VAL  86          1HG2      VAL  86  -4.727  -6.343  -6.343
  678    H    ILE  87           H        ILE  87  -6.530  -4.019  -4.019
  679    HA   ILE  87           HA       ILE  87  -8.985  -4.262  -4.262
  680    HB   ILE  87           HB       ILE  87 -10.340  -3.068  -3.068
  681   1HG1  ILE  87          2HG1      ILE  87  -7.808  -1.847  -1.847
  682   2HG1  ILE  87          1HG1      ILE  87  -8.459  -3.322  -3.322
  683   1HG2  ILE  87          2HG2      ILE  87  -9.587  -1.958  -1.958
  684   2HG2  ILE  87          1HG2      ILE  87  -8.191  -1.327  -1.327
  685   3HG2  ILE  87          3HG2      ILE  87  -9.819  -0.829  -0.829
  686   1HD1  ILE  87          2HD1      ILE  87 -10.021  -0.770  -0.770
  687   2HD1  ILE  87          1HD1      ILE  87  -9.108  -1.226  -1.226
  688   3HD1  ILE  87          3HD1      ILE  87 -10.466  -2.217  -2.217
  689    H    GLU  88           H        GLU  88 -10.429  -5.766  -5.766
  690    HA   GLU  88           HA       GLU  88  -9.347  -7.434  -7.434
  691   1HB   GLU  88          2HB       GLU  88 -10.044  -8.323  -8.323
  692   2HB   GLU  88          1HB       GLU  88 -11.686  -8.190  -8.190
  693   1HG   GLU  88          2HG       GLU  88 -11.111  -9.672  -9.672
  694   2HG   GLU  88          1HG       GLU  88  -9.467  -9.808  -9.808
  695    H    HIS  89           H        HIS  89 -10.076  -5.663  -5.663
  696    HA   HIS  89           HA       HIS  89 -12.701  -4.942  -4.942
  697   1HB   HIS  89          2HB       HIS  89 -10.402  -4.241  -4.241
  698   2HB   HIS  89          1HB       HIS  89 -10.927  -5.388  -5.388
  699    HD1  HIS  89           HD1      HIS  89 -12.577  -4.559  -4.559
  700    HD2  HIS  89           HD2      HIS  89 -12.286  -2.054  -2.054
  701    HE1  HIS  89           HE1      HIS  89 -13.953  -2.536  -2.536
  702    HE2  HIS  89           HE2      HIS  89 -13.850  -1.081  -1.081
  703    HA   PRO  90           HA       PRO  90 -14.526  -8.662  -8.662
  704   1HB   PRO  90          2HB       PRO  90 -16.838  -7.668  -7.668
  705   2HB   PRO  90          1HB       PRO  90 -16.479  -7.718  -7.718
  706   1HG   PRO  90          2HG       PRO  90 -16.315  -5.419  -5.419
  707   2HG   PRO  90          1HG       PRO  90 -16.916  -5.453  -5.453
  708   1HD   PRO  90          2HD       PRO  90 -14.406  -4.586  -4.586
  709   2HD   PRO  90          1HD       PRO  90 -14.825  -5.190  -5.190
  710    H    GLU  91           H        GLU  91 -14.066  -5.850  -5.850
  711    HA   GLU  91           HA       GLU  91 -14.623  -7.292  -7.292
  712   1HB   GLU  91          2HB       GLU  91 -13.384  -4.558  -4.558
  713   2HB   GLU  91          1HB       GLU  91 -14.197  -5.230  -5.230
  714   1HG   GLU  91          2HG       GLU  91 -16.158  -5.405  -5.405
  715   2HG   GLU  91          1HG       GLU  91 -15.307  -3.960  -3.960
  716    H    TYR  92           H        TYR  92 -11.904  -6.655  -6.655
  717    HA   TYR  92           HA       TYR  92 -10.099  -7.620  -7.620
  718   1HB   TYR  92          2HB       TYR  92  -9.139  -6.140  -6.140
  719   2HB   TYR  92          1HB       TYR  92  -8.361  -6.312  -6.312
  720    HD1  TYR  92           HD1      TYR  92 -10.791  -5.596  -5.596
  721    HD2  TYR  92           HD2      TYR  92  -9.080  -3.769  -3.769
  722    HE1  TYR  92           HE1      TYR  92 -11.720  -3.434  -3.434
  723    HE2  TYR  92           HE2      TYR  92 -10.005  -1.597  -1.597
  724    HH   TYR  92           HH       TYR  92 -12.314  -1.299  -1.299
  725    H    GLY  93           H        GLY  93 -10.627  -7.672  -7.672
  726   1HA   GLY  93          2HA       GLY  93 -10.647  -9.617  -9.617
  727   2HA   GLY  93          1HA       GLY  93  -9.865 -10.491 -10.491
  728    H    GLU  94           H        GLU  94  -9.424  -8.643  -8.643
  729    HA   GLU  94           HA       GLU  94  -7.623  -8.266  -8.266
  730   1HB   GLU  94          2HB       GLU  94  -7.341 -10.807 -10.807
  731   2HB   GLU  94          1HB       GLU  94  -5.875 -10.130 -10.130
  732   1HG   GLU  94          2HG       GLU  94  -5.220 -10.917 -10.917
  733   2HG   GLU  94          1HG       GLU  94  -5.414  -9.179  -9.179
  734    H    VAL  95           H        VAL  95  -7.379  -6.138  -6.138
  735    HA   VAL  95           HA       VAL  95  -4.897  -5.820  -5.820
  736    HB   VAL  95           HB       VAL  95  -5.926  -3.869  -3.869
  737   1HG1  VAL  95          2HG1      VAL  95  -5.708  -6.304  -6.304
  738   2HG1  VAL  95          1HG1      VAL  95  -7.463  -6.340  -6.340
  739   3HG1  VAL  95          3HG1      VAL  95  -6.701  -5.160  -5.160
  740   1HG2  VAL  95          2HG2      VAL  95  -8.066  -4.389  -4.389
  741   2HG2  VAL  95          1HG2      VAL  95  -7.964  -3.152  -3.152
  742   3HG2  VAL  95          3HG2      VAL  95  -8.648  -4.732  -4.732
  743    H    ILE  96           H        ILE  96  -3.627  -4.101  -4.101
  744    HA   ILE  96           HA       ILE  96  -4.225  -2.946  -2.946
  745    HB   ILE  96           HB       ILE  96  -1.855  -3.063  -3.063
  746   1HG1  ILE  96          2HG1      ILE  96  -2.502  -4.487  -4.487
  747   2HG1  ILE  96          1HG1      ILE  96  -0.827  -4.001  -4.001
  748   1HG2  ILE  96          1HG2      ILE  96  -2.420  -0.736  -0.736
  749   2HG2  ILE  96          3HG2      ILE  96  -0.769  -1.340  -1.340
  750   3HG2  ILE  96          2HG2      ILE  96  -1.628  -0.787  -0.787
  751   1HD1  ILE  96          2HD1      ILE  96  -1.393  -2.030  -2.030
  752   2HD1  ILE  96          1HD1      ILE  96  -2.836  -2.950  -2.950
  753   3HD1  ILE  96          3HD1      ILE  96  -1.240  -3.630  -3.630
  754    H    GLN  97           H        GLN  97  -4.688  -0.822  -0.822
  755    HA   GLN  97           HA       GLN  97  -5.361   0.850   0.850
  756   1HB   GLN  97          2HB       GLN  97  -6.955   0.003   0.003
  757   2HB   GLN  97          1HB       GLN  97  -6.681   1.724   1.724
  758   1HG   GLN  97          2HG       GLN  97  -7.451   2.077   2.077
  759   2HG   GLN  97          1HG       GLN  97  -7.889   0.369   0.369
  760   1HE2  GLN  97          2HE2      GLN  97 -10.989   2.007   2.007
  761   2HE2  GLN  97          1HE2      GLN  97  -9.937   1.745   1.745
  762    H    LEU  98           H        LEU  98  -3.673   2.181   2.181
  763    HA   LEU  98           HA       LEU  98  -2.307   3.400   3.400
  764   1HB   LEU  98          2HB       LEU  98  -1.916   3.165   3.165
  765   2HB   LEU  98          1HB       LEU  98  -1.458   4.727   4.727
  766    HG   LEU  98           HG       LEU  98   0.297   3.864   3.864
  767   1HD1  LEU  98          1HD1      LEU  98  -1.415   1.499   1.499
  768   2HD1  LEU  98          3HD1      LEU  98   0.310   1.152   1.152
  769   3HD1  LEU  98          2HD1      LEU  98  -0.284   2.215   2.215
  770   1HD2  LEU  98          3HD2      LEU  98  -0.039   2.147   2.147
  771   2HD2  LEU  98          2HD2      LEU  98   0.902   3.627   3.627
  772   3HD2  LEU  98          1HD2      LEU  98   1.427   2.150   2.150
  773    H    GLN  99           H        GLN  99  -1.960   5.863   5.863
  774    HA   GLN  99           HA       GLN  99  -4.586   7.113   7.113
  775   1HB   GLN  99          2HB       GLN  99  -2.805   7.176   7.176
  776   2HB   GLN  99          1HB       GLN  99  -2.925   8.801   8.801
  777   1HG   GLN  99          2HG       GLN  99  -5.494   7.442   7.442
  778   2HG   GLN  99          1HG       GLN  99  -4.654   7.674   7.674
  779   1HE2  GLN  99          2HE2      GLN  99  -6.228  10.817  10.817
  780   2HE2  GLN  99          1HE2      GLN  99  -6.130   9.241   9.241
  781    H    GLY 100           H        GLY 100  -4.770   8.909   8.909
  782   1HA   GLY 100          2HA       GLY 100  -4.166  10.608  10.608
  783   2HA   GLY 100          1HA       GLY 100  -2.538  10.515  10.515
  784    H    ASP 101           H        ASP 101  -2.792  11.000  11.000
  785    HA   ASP 101           HA       ASP 101  -2.867   8.678   8.678
  786   1HB   ASP 101          2HB       ASP 101  -1.866  10.116  10.116
  787   2HB   ASP 101          1HB       ASP 101  -3.250  10.874  10.874
  788    H    GLN 102           H        GLN 102  -1.529   7.131   7.131
  789    HA   GLN 102           HA       GLN 102   1.344   7.711   7.711
  790   1HB   GLN 102          2HB       GLN 102  -0.443   5.991   5.991
  791   2HB   GLN 102          1HB       GLN 102   1.031   5.181   5.181
  792   1HG   GLN 102          2HG       GLN 102   1.074   6.307   6.307
  793   2HG   GLN 102          1HG       GLN 102   2.395   6.697   6.697
  794   1HE2  GLN 102          2HE2      GLN 102  -0.473   9.588   9.588
  795   2HE2  GLN 102          1HE2      GLN 102  -0.882   7.943   7.943
  796    H    ARG 103           H        ARG 103  -0.788   6.667   6.667
  797    HA   ARG 103           HA       ARG 103  -0.058   4.215   4.215
  798   1HB   ARG 103          2HB       ARG 103  -0.785   4.937   4.937
  799   2HB   ARG 103          1HB       ARG 103  -1.818   5.679   5.679
  800   1HG   ARG 103          2HG       ARG 103  -0.478   7.754   7.754
  801   2HG   ARG 103          1HG       ARG 103   0.430   6.998   6.998
  802   1HD   ARG 103          2HD       ARG 103  -2.504   6.920   6.920
  803   2HD   ARG 103          1HD       ARG 103  -1.773   8.521   8.521
  804    HE   ARG 103           HE       ARG 103  -1.543   6.378   6.378
  805   1HH1  ARG 103          2HH1      ARG 103  -0.165   9.365   9.365
  806   2HH1  ARG 103          1HH1      ARG 103   0.646   9.719   9.719
  807   1HH2  ARG 103          1HH2      ARG 103  -0.473   6.842   6.842
  808   2HH2  ARG 103          2HH2      ARG 103   0.471   8.288   8.288
  809    H    LYS 104           H        LYS 104   1.814   7.145   7.145
  810    HA   LYS 104           HA       LYS 104   3.801   5.982   5.982
  811   1HB   LYS 104          2HB       LYS 104   3.158   8.695   8.695
  812   2HB   LYS 104          1HB       LYS 104   4.869   8.360   8.360
  813   1HG   LYS 104          2HG       LYS 104   4.644   8.749   8.749
  814   2HG   LYS 104          1HG       LYS 104   3.538   7.379   7.379
  815   1HD   LYS 104          2HD       LYS 104   2.509   9.410   9.410
  816   2HD   LYS 104          1HD       LYS 104   1.661   8.847   8.847
  817   1HE   LYS 104          2HE       LYS 104   2.536  10.555  10.555
  818   2HE   LYS 104          1HE       LYS 104   3.840  10.897  10.897
  819   1HZ   LYS 104          1HZ       LYS 104   1.164  11.264  11.264
  820   2HZ   LYS 104          3HZ       LYS 104   1.596  12.337  12.337
  821   3HZ   LYS 104          2HZ       LYS 104   2.536  12.239  12.239
  822    H    ASN 105           H        ASN 105   3.253   6.581   6.581
  823    HA   ASN 105           HA       ASN 105   6.048   6.157   6.157
  824   1HB   ASN 105          2HB       ASN 105   3.585   6.994   6.994
  825   2HB   ASN 105          1HB       ASN 105   4.838   6.188   6.188
  826   1HD2  ASN 105          2HD2      ASN 105   5.173  10.038  10.038
  827   2HD2  ASN 105          1HD2      ASN 105   3.728   9.105   9.105
  828    H    ILE 106           H        ILE 106   2.969   4.442   4.442
  829    HA   ILE 106           HA       ILE 106   3.818   2.293   2.293
  830    HB   ILE 106           HB       ILE 106   1.450   2.755   2.755
  831   1HG1  ILE 106          2HG1      ILE 106   0.739   0.437   0.437
  832   2HG1  ILE 106          1HG1      ILE 106   2.297  -0.010  -0.010
  833   1HG2  ILE 106          2HG2      ILE 106   1.807   3.269   3.269
  834   2HG2  ILE 106          1HG2      ILE 106   1.907   1.532   1.532
  835   3HG2  ILE 106          3HG2      ILE 106   0.420   2.238   2.238
  836   1HD1  ILE 106          3HD1      ILE 106   2.559   1.299   1.299
  837   2HD1  ILE 106          2HD1      ILE 106   1.573  -0.161  -0.161
  838   3HD1  ILE 106          1HD1      ILE 106   3.214  -0.237  -0.237
  839    H    CYS 107           H        CYS 107   3.634   2.556   2.556
  840    HA   CYS 107           HA       CYS 107   4.716   0.043   0.043
  841   1HB   CYS 107          2HB       CYS 107   5.511   1.196   1.196
  842   2HB   CYS 107          1HB       CYS 107   3.783   1.269   1.269
  843    HG   CYS 107           HG       CYS 107   5.301   3.618   3.618
  844    H    GLN 108           H        GLN 108   6.152   3.091   3.091
  845    HA   GLN 108           HA       GLN 108   8.870   2.362   2.362
  846   1HB   GLN 108          2HB       GLN 108   8.562   4.657   4.657
  847   2HB   GLN 108          1HB       GLN 108   7.405   4.609   4.609
  848   1HG   GLN 108          2HG       GLN 108   9.109   5.546   5.546
  849   2HG   GLN 108          1HG       GLN 108   9.589   3.866   3.866
  850   1HE2  GLN 108          2HE2      GLN 108  12.363   4.034   4.034
  851   2HE2  GLN 108          1HE2      GLN 108  11.170   2.989   2.989
  852    H    PHE 109           H        PHE 109   6.609   2.126   2.126
  853    HA   PHE 109           HA       PHE 109   8.508   1.444   1.444
  854   1HB   PHE 109          2HB       PHE 109   6.302   2.357   2.357
  855   2HB   PHE 109          1HB       PHE 109   5.526   0.946   0.946
  856    HD1  PHE 109           HD1      PHE 109   8.039   1.830   1.830
  857    HD2  PHE 109           HD2      PHE 109   4.912  -0.783  -0.783
  858    HE1  PHE 109           HE1      PHE 109   8.144   0.693   0.693
  859    HE2  PHE 109           HE2      PHE 109   5.010  -1.926  -1.926
  860    HZ   PHE 109           HZ       PHE 109   6.627  -1.186  -1.186
  861    H    LEU 110           H        LEU 110   6.335  -0.403  -0.403
  862    HA   LEU 110           HA       LEU 110   6.836  -2.952  -2.952
  863   1HB   LEU 110          2HB       LEU 110   5.858  -1.855  -1.855
  864   2HB   LEU 110          1HB       LEU 110   6.366  -3.532  -3.532
  865    HG   LEU 110           HG       LEU 110   4.674  -4.152  -4.152
  866   1HD1  LEU 110          2HD1      LEU 110   4.475  -1.222  -1.222
  867   2HD1  LEU 110          1HD1      LEU 110   3.153  -2.325  -2.325
  868   3HD1  LEU 110          3HD1      LEU 110   4.742  -2.565  -2.565
  869   1HD2  LEU 110          3HD2      LEU 110   4.031  -3.302  -3.302
  870   2HD2  LEU 110          2HD2      LEU 110   2.793  -3.796  -3.796
  871   3HD2  LEU 110          1HD2      LEU 110   3.142  -2.084  -2.084
  872    H    VAL 111           H        VAL 111   8.699  -0.936  -0.936
  873    HA   VAL 111           HA       VAL 111  10.534  -3.112  -3.112
  874    HB   VAL 111           HB       VAL 111  10.611  -0.219  -0.219
  875   1HG1  VAL 111          1HG1      VAL 111  12.372  -2.548  -2.548
  876   2HG1  VAL 111          3HG1      VAL 111  12.017  -1.515  -1.515
  877   3HG1  VAL 111          2HG1      VAL 111  12.755  -0.828  -0.828
  878   1HG2  VAL 111          3HG2      VAL 111   8.643  -1.720  -1.720
  879   2HG2  VAL 111          2HG2      VAL 111   9.524  -0.814  -0.814
  880   3HG2  VAL 111          1HG2      VAL 111   9.842  -2.533  -2.533
  881    H    GLU 112           H        GLU 112  10.287  -0.323  -0.323
  882    HA   GLU 112           HA       GLU 112  13.075  -0.101  -0.101
  883   1HB   GLU 112          2HB       GLU 112  10.577   1.004   1.004
  884   2HB   GLU 112          1HB       GLU 112  12.148   1.229   1.229
  885   1HG   GLU 112          2HG       GLU 112  12.025   1.925   1.925
  886   2HG   GLU 112          1HG       GLU 112  11.044   2.929   2.929
  887    H    ILE 113           H        ILE 113  10.340  -1.761  -1.761
  888    HA   ILE 113           HA       ILE 113  12.035  -2.765  -2.765
  889    HB   ILE 113           HB       ILE 113  10.068  -3.519  -3.519
  890   1HG1  ILE 113          2HG1      ILE 113   8.624  -3.008  -3.008
  891   2HG1  ILE 113          1HG1      ILE 113   8.934  -4.576  -4.576
  892   1HG2  ILE 113          3HG2      ILE 113  10.515  -0.948  -0.948
  893   2HG2  ILE 113          2HG2      ILE 113   8.960  -1.043  -1.043
  894   3HG2  ILE 113          1HG2      ILE 113   9.088  -1.514  -1.514
  895   1HD1  ILE 113          3HD1      ILE 113   7.531  -2.881  -2.881
  896   2HD1  ILE 113          2HD1      ILE 113   6.677  -2.967  -2.967
  897   3HD1  ILE 113          1HD1      ILE 113   7.066  -4.447  -4.447
  898    H    GLY 114           H        GLY 114  10.787  -3.743  -3.743
  899   1HA   GLY 114          2HA       GLY 114  11.454  -5.667  -5.667
  900   2HA   GLY 114          1HA       GLY 114  11.993  -6.375  -6.375
  901    H    LEU 115           H        LEU 115   8.858  -4.902  -4.902
  902    HA   LEU 115           HA       LEU 115   7.552  -7.320  -7.320
  903   1HB   LEU 115          2HB       LEU 115   6.993  -4.676  -4.676
  904   2HB   LEU 115          1HB       LEU 115   5.915  -5.093  -5.093
  905    HG   LEU 115           HG       LEU 115   4.768  -6.705  -6.705
  906   1HD1  LEU 115          1HD1      LEU 115   7.078  -6.346  -6.346
  907   2HD1  LEU 115          3HD1      LEU 115   5.508  -6.826  -6.826
  908   3HD1  LEU 115          2HD1      LEU 115   6.309  -7.829  -7.829
  909   1HD2  LEU 115          1HD2      LEU 115   4.650  -4.047  -4.047
  910   2HD2  LEU 115          3HD2      LEU 115   3.585  -5.228  -5.228
  911   3HD2  LEU 115          2HD2      LEU 115   5.005  -4.633  -4.633
  912    H    ALA 116           H        ALA 116   6.798  -5.195  -5.195
  913    HA   ALA 116           HA       ALA 116   5.893  -7.537  -7.537
  914   1HB   ALA 116          2HB       ALA 116   4.563  -5.336  -5.336
  915   2HB   ALA 116          1HB       ALA 116   5.651  -4.715  -4.715
  916   3HB   ALA 116          3HB       ALA 116   4.625  -6.107  -6.107
  917    H    LYS 117           H        LYS 117   6.244  -6.675  -6.675
  918    HA   LYS 117           HA       LYS 117   9.174  -6.497  -6.497
  919   1HB   LYS 117          2HB       LYS 117   7.624  -8.652  -8.652
  920   2HB   LYS 117          1HB       LYS 117   7.773  -7.769  -7.769
  921   1HG   LYS 117          2HG       LYS 117   9.613  -9.079  -9.079
  922   2HG   LYS 117          1HG       LYS 117  10.322  -7.713  -7.713
  923   1HD   LYS 117          2HD       LYS 117   9.234 -10.204 -10.204
  924   2HD   LYS 117          1HD       LYS 117  10.940  -9.916  -9.916
  925   1HE   LYS 117          2HE       LYS 117  10.707  -7.791  -7.791
  926   2HE   LYS 117          1HE       LYS 117   9.151  -8.426  -8.426
  927   1HZ   LYS 117          1HZ       LYS 117  10.422 -10.462 -10.462
  928   2HZ   LYS 117          3HZ       LYS 117  11.841  -9.572  -9.572
  929   3HZ   LYS 117          2HZ       LYS 117  10.709  -9.062  -9.062
  930    H    ASP 118           H        ASP 118   9.943  -5.524  -5.524
  931    HA   ASP 118           HA       ASP 118   8.629  -3.100  -3.100
  932   1HB   ASP 118          2HB       ASP 118  10.698  -4.368  -4.368
  933   2HB   ASP 118          1HB       ASP 118  10.378  -2.655  -2.655
  934    H    ASP 119           H        ASP 119   8.432  -6.262  -6.262
  935    HA   ASP 119           HA       ASP 119   7.144  -5.391  -5.391
  936   1HB   ASP 119          2HB       ASP 119   6.798  -7.845  -7.845
  937   2HB   ASP 119          1HB       ASP 119   8.482  -7.397  -7.397
  938    H    GLN 120           H        GLN 120   6.234  -6.551  -6.551
  939    HA   GLN 120           HA       GLN 120   3.475  -6.981  -6.981
  940   1HB   GLN 120          2HB       GLN 120   4.725  -6.663  -6.663
  941   2HB   GLN 120          1HB       GLN 120   3.154  -7.360  -7.360
  942   1HG   GLN 120          2HG       GLN 120   4.249  -9.192  -9.192
  943   2HG   GLN 120          1HG       GLN 120   5.821  -8.499  -8.499
  944   1HE2  GLN 120          2HE2      GLN 120   3.586  -9.859  -9.859
  945   2HE2  GLN 120          1HE2      GLN 120   2.850  -8.970  -8.970
  946    H    LEU 121           H        LEU 121   5.345  -4.245  -4.245
  947    HA   LEU 121           HA       LEU 121   3.789  -2.557  -2.557
  948   1HB   LEU 121          2HB       LEU 121   5.494  -1.988  -1.988
  949   2HB   LEU 121          1HB       LEU 121   4.737  -0.716  -0.716
  950    HG   LEU 121           HG       LEU 121   6.653  -2.735  -2.735
  951   1HD1  LEU 121          3HD1      LEU 121   7.115  -0.031  -0.031
  952   2HD1  LEU 121          2HD1      LEU 121   8.178  -0.665  -0.665
  953   3HD1  LEU 121          1HD1      LEU 121   7.999  -1.535  -1.535
  954   1HD2  LEU 121          3HD2      LEU 121   4.982  -0.616  -0.616
  955   2HD2  LEU 121          2HD2      LEU 121   5.803  -1.950  -1.950
  956   3HD2  LEU 121          1HD2      LEU 121   6.682  -0.466  -0.466
  957    H    LYS 122           H        LYS 122   1.608  -2.826  -2.826
  958    HA   LYS 122           HA       LYS 122   0.514  -2.022  -2.022
  959   1HB   LYS 122          2HB       LYS 122  -0.308  -4.023  -4.023
  960   2HB   LYS 122          1HB       LYS 122  -1.614  -3.096  -3.096
  961   1HG   LYS 122          2HG       LYS 122   0.463  -4.522  -4.522
  962   2HG   LYS 122          1HG       LYS 122  -1.049  -5.276  -5.276
  963   1HD   LYS 122          2HD       LYS 122  -2.275  -4.121  -4.121
  964   2HD   LYS 122          1HD       LYS 122  -1.345  -2.639  -2.639
  965   1HE   LYS 122          2HE       LYS 122   0.129  -3.139  -3.139
  966   2HE   LYS 122          1HE       LYS 122   0.027  -4.876  -4.876
  967   1HZ   LYS 122          3HZ       LYS 122  -2.228  -4.784  -4.784
  968   2HZ   LYS 122          2HZ       LYS 122  -1.918  -3.181  -3.181
  969   3HZ   LYS 122          1HZ       LYS 122  -0.965  -4.429  -4.429
  970    H    VAL 123           H        VAL 123   0.927   0.210   0.210
  971    HA   VAL 123           HA       VAL 123  -0.756   1.233   1.233
  972    HB   VAL 123           HB       VAL 123   1.522   2.113   2.113
  973   1HG1  VAL 123          2HG1      VAL 123   0.996   2.073   2.073
  974   2HG1  VAL 123          1HG1      VAL 123   1.014   3.791   3.791
  975   3HG1  VAL 123          3HG1      VAL 123   2.409   2.785   2.785
  976   1HG2  VAL 123          3HG2      VAL 123  -0.733   3.534   3.534
  977   2HG2  VAL 123          2HG2      VAL 123   0.908   4.149   4.149
  978   3HG2  VAL 123          1HG2      VAL 123  -0.003   4.506   4.506
  979    H    HIS 124           H        HIS 124  -2.838   1.637   1.637
  980    HA   HIS 124           HA       HIS 124  -3.532   2.676   2.676
  981   1HB   HIS 124          2HB       HIS 124  -5.353   1.223   1.223
  982   2HB   HIS 124          1HB       HIS 124  -5.722   1.690   1.690
  983    HD1  HIS 124           HD1      HIS 124  -5.036   0.103   0.103
  984    HD2  HIS 124           HD2      HIS 124  -3.438  -0.916  -0.916
  985    HE1  HIS 124           HE1      HIS 124  -3.974  -2.151  -2.151
  986    HE2  HIS 124           HE2      HIS 124  -3.122  -2.799  -2.799
  987    H    GLY 125           H        GLY 125  -3.928   3.102   3.102
  988   1HA   GLY 125          2HA       GLY 125  -4.703   4.881   4.881
  989   2HA   GLY 125          1HA       GLY 125  -4.353   5.866   5.866
  990    H    PHE 126           HN       PHE 126  -6.028   6.859   6.859
  991    HA   PHE 126           HA       PHE 126  -8.507   5.674   5.674
  992   1HB   PHE 126          2HB       PHE 126  -9.949   6.406   6.406
  993   2HB   PHE 126          1HB       PHE 126  -8.513   6.009   6.009
  994    HD1  PHE 126           HD1      PHE 126  -6.808   8.070   8.070
  995    HD2  PHE 126           HD2      PHE 126 -11.003   8.369   8.369
  996    HE1  PHE 126           HE1      PHE 126  -6.786  10.351  10.351
  997    HE2  PHE 126           HE2      PHE 126 -10.988  10.650  10.650
  998    HZ   PHE 126           HZ       PHE 126  -8.880  11.644  11.644

  Start of MODEL   10
    1   1H    MET   1          2H        MET   1  23.904 -35.753 -35.753
    2   2H    MET   1          1H        MET   1  25.104 -35.165 -35.165
    3   3H    MET   1          3H        MET   1  24.136 -34.062 -34.062
    4    HA   MET   1           HA       MET   1  23.432 -34.189 -34.189
    5   1HB   MET   1          2HB       MET   1  24.155 -36.821 -36.821
    6   2HB   MET   1          1HB       MET   1  22.402 -36.933 -36.933
    7   1HG   MET   1          2HG       MET   1  23.487 -35.203 -35.203
    8   2HG   MET   1          1HG       MET   1  23.856 -36.919 -36.919
    9   1HE   MET   1          1HE       MET   1  22.559 -38.066 -38.066
   10   2HE   MET   1          3HE       MET   1  21.964 -38.833 -38.833
   11   3HE   MET   1          2HE       MET   1  20.837 -38.389 -38.389
   12    H    ARG   2           H        ARG   2  21.836 -32.828 -32.828
   13    HA   ARG   2           HA       ARG   2  19.783 -32.102 -32.102
   14   1HB   ARG   2          2HB       ARG   2  19.362 -34.560 -34.560
   15   2HB   ARG   2          1HB       ARG   2  18.476 -34.689 -34.689
   16   1HG   ARG   2          2HG       ARG   2  17.018 -33.875 -33.875
   17   2HG   ARG   2          1HG       ARG   2  17.293 -32.599 -32.599
   18   1HD   ARG   2          2HD       ARG   2  19.195 -32.627 -32.627
   19   2HD   ARG   2          1HD       ARG   2  17.526 -32.297 -32.297
   20    HE   ARG   2           HE       ARG   2  17.917 -30.640 -30.640
   21   1HH1  ARG   2          2HH1      ARG   2  19.695 -31.205 -31.205
   22   2HH1  ARG   2          1HH1      ARG   2  20.293 -29.583 -29.583
   23   1HH2  ARG   2          1HH2      ARG   2  18.702 -28.506 -28.506
   24   2HH2  ARG   2          2HH2      ARG   2  19.730 -28.051 -28.051
   25    H    GLY   3           H        GLY   3  21.736 -32.688 -32.688
   26   1HA   GLY   3          2HA       GLY   3  20.244 -33.871 -33.871
   27   2HA   GLY   3          1HA       GLY   3  21.926 -33.365 -33.365
   28    H    SER   4           H        SER   4  21.623 -32.263 -32.263
   29    HA   SER   4           HA       SER   4  21.248 -30.437 -30.437
   30   1HB   SER   4          2HB       SER   4  21.809 -29.444 -29.444
   31   2HB   SER   4          1HB       SER   4  20.325 -28.606 -28.606
   32    HG   SER   4           HG       SER   4  21.379 -27.981 -27.981
   33    H    HIS   5           H        HIS   5  19.437 -28.419 -28.419
   34    HA   HIS   5           HA       HIS   5  17.076 -29.697 -29.697
   35   1HB   HIS   5          2HB       HIS   5  17.405 -26.780 -26.780
   36   2HB   HIS   5          1HB       HIS   5  16.177 -27.472 -27.472
   37    HD1  HIS   5           HD1      HIS   5  18.848 -25.424 -25.424
   38    HD2  HIS   5           HD2      HIS   5  17.967 -29.136 -29.136
   39    HE1  HIS   5           HE1      HIS   5  20.189 -25.553 -25.553
   40    HE2  HIS   5           HE2      HIS   5  19.701 -27.840 -27.840
   41    H    HIS   6           H        HIS   6  14.900 -29.379 -29.379
   42    HA   HIS   6           HA       HIS   6  14.852 -29.723 -29.723
   43   1HB   HIS   6          2HB       HIS   6  13.498 -30.975 -30.975
   44   2HB   HIS   6          1HB       HIS   6  12.303 -29.789 -29.789
   45    HD1  HIS   6           HD1      HIS   6  14.088 -32.864 -32.864
   46    HD2  HIS   6           HD2      HIS   6  11.247 -30.194 -30.194
   47    HE1  HIS   6           HE1      HIS   6  13.114 -33.956 -33.956
   48    HE2  HIS   6           HE2      HIS   6  11.340 -32.358 -32.358
   49    H    HIS   7           H        HIS   7  13.805 -28.408 -28.408
   50    HA   HIS   7           HA       HIS   7  13.567 -25.668 -25.668
   51   1HB   HIS   7          2HB       HIS   7  13.317 -27.327 -27.327
   52   2HB   HIS   7          1HB       HIS   7  12.190 -25.975 -25.975
   53    HD1  HIS   7           HD1      HIS   7  15.769 -26.007 -26.007
   54    HD2  HIS   7           HD2      HIS   7  13.428 -24.215 -24.215
   55    HE1  HIS   7           HE1      HIS   7  17.252 -24.294 -24.294
   56    HE2  HIS   7           HE2      HIS   7  15.843 -23.289 -23.289
   57    H    HIS   8           H        HIS   8  11.709 -24.329 -24.329
   58    HA   HIS   8           HA       HIS   8   9.137 -25.695 -25.695
   59   1HB   HIS   8          2HB       HIS   8  10.652 -24.280 -24.280
   60   2HB   HIS   8          1HB       HIS   8   9.027 -23.632 -23.632
   61    HD1  HIS   8           HD1      HIS   8   7.142 -24.943 -24.943
   62    HD2  HIS   8           HD2      HIS   8  10.696 -27.092 -27.092
   63    HE1  HIS   8           HE1      HIS   8   6.702 -27.039 -27.039
   64    HE2  HIS   8           HE2      HIS   8   8.891 -28.285 -28.285
   65    H    HIS   9           H        HIS   9   7.481 -23.668 -23.668
   66    HA   HIS   9           HA       HIS   9   7.841 -21.882 -21.882
   67   1HB   HIS   9          2HB       HIS   9   5.464 -23.255 -23.255
   68   2HB   HIS   9          1HB       HIS   9   5.219 -21.678 -21.678
   69    HD1  HIS   9           HD1      HIS   9   3.933 -24.142 -24.142
   70    HD2  HIS   9           HD2      HIS   9   7.672 -22.694 -22.694
   71    HE1  HIS   9           HE1      HIS   9   4.337 -25.004 -25.004
   72    HE2  HIS   9           HE2      HIS   9   6.568 -24.042 -24.042
   73    H    HIS  10           H        HIS  10   9.178 -20.859 -20.859
   74    HA   HIS  10           HA       HIS  10   7.623 -18.565 -18.565
   75   1HB   HIS  10          2HB       HIS  10   8.271 -20.717 -20.717
   76   2HB   HIS  10          1HB       HIS  10   8.950 -19.181 -19.181
   77    HD1  HIS  10           HD1      HIS  10   5.706 -19.210 -19.210
   78    HD2  HIS  10           HD2      HIS  10   7.069 -18.985 -18.985
   79    HE1  HIS  10           HE1      HIS  10   3.710 -18.525 -18.525
   80    HE2  HIS  10           HE2      HIS  10   4.579 -18.311 -18.311
   81    H    THR  11           H        THR  11  10.731 -20.242 -20.242
   82    HA   THR  11           HA       THR  11  12.190 -17.781 -17.781
   83    HB   THR  11           HB       THR  11  13.196 -20.606 -20.606
   84    HG1  THR  11           HG1      THR  11  12.642 -19.084 -19.084
   85   1HG2  THR  11          2HG2      THR  11  14.593 -18.082 -18.082
   86   2HG2  THR  11          1HG2      THR  11  15.053 -19.205 -19.205
   87   3HG2  THR  11          3HG2      THR  11  15.200 -19.687 -19.687
   88    H    ASP  12           H        ASP  12  13.314 -16.702 -16.702
   89    HA   ASP  12           HA       ASP  12  14.104 -17.813 -17.813
   90   1HB   ASP  12          2HB       ASP  12  11.442 -16.641 -16.641
   91   2HB   ASP  12          1HB       ASP  12  12.448 -15.847 -15.847
   92    HA   PRO  13           HA       PRO  13  16.991 -14.480 -14.480
   93   1HB   PRO  13          2HB       PRO  13  17.007 -14.516 -14.516
   94   2HB   PRO  13          1HB       PRO  13  18.358 -14.623 -14.623
   95   1HG   PRO  13          2HG       PRO  13  17.500 -16.784 -16.784
   96   2HG   PRO  13          1HG       PRO  13  18.020 -16.884 -16.884
   97   1HD   PRO  13          2HD       PRO  13  15.259 -16.885 -16.885
   98   2HD   PRO  13          1HD       PRO  13  15.908 -17.778 -17.778
   99    H    MET  14           H        MET  14  14.576 -14.206 -14.206
  100    HA   MET  14           HA       MET  14  14.673 -11.339 -11.339
  101   1HB   MET  14          2HB       MET  14  12.675 -13.235 -13.235
  102   2HB   MET  14          1HB       MET  14  12.777 -11.510 -11.510
  103   1HG   MET  14          2HG       MET  14  15.260 -13.031 -13.031
  104   2HG   MET  14          1HG       MET  14  13.940 -13.401 -13.401
  105   1HE   MET  14          1HE       MET  14  16.711 -12.458 -12.458
  106   2HE   MET  14          3HE       MET  14  15.830 -12.196 -12.196
  107   3HE   MET  14          2HE       MET  14  16.796 -10.894 -10.894
  108    H    SER  15           H        SER  15  12.811 -13.773 -13.773
  109    HA   SER  15           HA       SER  15  10.549 -12.294 -12.294
  110   1HB   SER  15          2HB       SER  15  11.916 -14.711 -14.711
  111   2HB   SER  15          1HB       SER  15  10.833 -13.892 -13.892
  112    HG   SER  15           HG       SER  15   9.257 -13.983 -13.983
  113    H    ALA  16           H        ALA  16  13.792 -12.288 -12.288
  114    HA   ALA  16           HA       ALA  16  13.024 -10.072 -10.072
  115   1HB   ALA  16          1HB       ALA  16  14.542 -12.545 -12.545
  116   2HB   ALA  16          3HB       ALA  16  14.873 -11.032 -11.032
  117   3HB   ALA  16          2HB       ALA  16  13.252 -11.726 -11.726
  118    H    ILE  17           H        ILE  17  13.837  -8.930  -8.930
  119    HA   ILE  17           HA       ILE  17  16.666  -9.029  -9.029
  120    HB   ILE  17           HB       ILE  17  14.681  -6.964  -6.964
  121   1HG1  ILE  17          2HG1      ILE  17  15.524  -9.121  -9.121
  122   2HG1  ILE  17          1HG1      ILE  17  14.470  -9.627  -9.627
  123   1HG2  ILE  17          3HG2      ILE  17  17.371  -6.866  -6.866
  124   2HG2  ILE  17          2HG2      ILE  17  16.991  -7.733  -7.733
  125   3HG2  ILE  17          1HG2      ILE  17  16.285  -6.145  -6.145
  126   1HD1  ILE  17          3HD1      ILE  17  13.718  -7.242  -7.242
  127   2HD1  ILE  17          2HD1      ILE  17  13.485  -8.853  -8.853
  128   3HD1  ILE  17          1HD1      ILE  17  12.695  -8.411  -8.411
  129    H    GLN  18           H        GLN  18  17.888  -8.354  -8.354
  130    HA   GLN  18           HA       GLN  18  18.878  -6.952  -6.952
  131   1HB   GLN  18          2HB       GLN  18  17.686  -5.088  -5.088
  132   2HB   GLN  18          1HB       GLN  18  18.305  -4.406  -4.406
  133   1HG   GLN  18          2HG       GLN  18  20.422  -4.644  -4.644
  134   2HG   GLN  18          1HG       GLN  18  20.152  -6.285  -6.285
  135   1HE2  GLN  18          2HE2      GLN  18  20.414  -3.208  -3.208
  136   2HE2  GLN  18          1HE2      GLN  18  20.665  -3.060  -3.060
  137    H    ASN  19           H        ASN  19  18.150  -7.133  -7.133
  138    HA   ASN  19           HA       ASN  19  15.497  -6.854  -6.854
  139   1HB   ASN  19          2HB       ASN  19  18.129  -7.036  -7.036
  140   2HB   ASN  19          1HB       ASN  19  16.771  -6.441  -6.441
  141   1HD2  ASN  19          2HD2      ASN  19  17.120 -10.345 -10.345
  142   2HD2  ASN  19          1HD2      ASN  19  18.257  -9.155  -9.155
  143    H    LEU  20           H        LEU  20  18.073  -4.505  -4.505
  144    HA   LEU  20           HA       LEU  20  16.406  -2.449  -2.449
  145   1HB   LEU  20          2HB       LEU  20  19.057  -2.928  -2.928
  146   2HB   LEU  20          1HB       LEU  20  19.076  -1.742  -1.742
  147    HG   LEU  20           HG       LEU  20  17.811  -0.180  -0.180
  148   1HD1  LEU  20          1HD1      LEU  20  17.930  -2.506  -2.506
  149   2HD1  LEU  20          3HD1      LEU  20  17.955  -0.870  -0.870
  150   3HD1  LEU  20          2HD1      LEU  20  16.599  -1.400  -1.400
  151   1HD2  LEU  20          3HD2      LEU  20  20.453  -0.651  -0.651
  152   2HD2  LEU  20          2HD2      LEU  20  19.701   0.623   0.623
  153   3HD2  LEU  20          1HD2      LEU  20  20.115  -0.920  -0.920
  154    H    HIS  21           H        HIS  21  16.261  -0.324  -0.324
  155    HA   HIS  21           HA       HIS  21  15.617   0.986   0.986
  156   1HB   HIS  21          2HB       HIS  21  18.008  -0.352  -0.352
  157   2HB   HIS  21          1HB       HIS  21  16.927  -0.174  -0.174
  158    HD1  HIS  21           HD1      HIS  21  18.766   1.879   1.879
  159    HD2  HIS  21           HD2      HIS  21  16.717   2.384   2.384
  160    HE1  HIS  21           HE1      HIS  21  19.193   4.259   4.259
  161    HE2  HIS  21           HE2      HIS  21  18.009   4.518   4.518
  162    H    SER  22           H        SER  22  13.474   0.189   0.189
  163    HA   SER  22           HA       SER  22  12.582  -1.001  -1.001
  164   1HB   SER  22          2HB       SER  22  11.601  -2.531  -2.531
  165   2HB   SER  22          1HB       SER  22  11.888  -3.068  -3.068
  166    HG   SER  22           HG       SER  22  13.635  -2.927  -2.927
  167    H    PHE  23           H        PHE  23  11.395   0.890   0.890
  168    HA   PHE  23           HA       PHE  23   9.522   1.684   1.684
  169   1HB   PHE  23          2HB       PHE  23  10.868   3.176   3.176
  170   2HB   PHE  23          1HB       PHE  23   9.477   2.855   2.855
  171    HD1  PHE  23           HD1      PHE  23  10.406   4.140   4.140
  172    HD2  PHE  23           HD2      PHE  23   7.550   4.130   4.130
  173    HE1  PHE  23           HE1      PHE  23   9.164   5.942   5.942
  174    HE2  PHE  23           HE2      PHE  23   6.303   5.932   5.932
  175    HZ   PHE  23           HZ       PHE  23   7.109   6.840   6.840
  176    H    ASP  24           H        ASP  24   7.222   2.186   2.186
  177    HA   ASP  24           HA       ASP  24   6.173   0.232   0.232
  178   1HB   ASP  24          2HB       ASP  24   4.421  -0.457  -0.457
  179   2HB   ASP  24          1HB       ASP  24   6.038  -0.888  -0.888
  180    HA   PRO  25           HA       PRO  25   4.208   4.229   4.229
  181   1HB   PRO  25          2HB       PRO  25   3.131   2.566   2.566
  182   2HB   PRO  25          1HB       PRO  25   3.947   4.131   4.131
  183   1HG   PRO  25          2HG       PRO  25   5.196   1.901   1.901
  184   2HG   PRO  25          1HG       PRO  25   6.058   3.184   3.184
  185   1HD   PRO  25          2HD       PRO  25   5.034   0.563   0.563
  186   2HD   PRO  25          1HD       PRO  25   6.541   1.416   1.416
  187    H    PHE  26           H        PHE  26   2.841   1.070   1.070
  188    HA   PHE  26           HA       PHE  26   0.228   2.308   2.308
  189   1HB   PHE  26          2HB       PHE  26  -0.159  -0.459  -0.459
  190   2HB   PHE  26          1HB       PHE  26  -0.721   0.895   0.895
  191    HD1  PHE  26           HD2      PHE  26   0.638   1.689   1.689
  192    HD2  PHE  26           HD1      PHE  26   1.643  -1.828  -1.828
  193    HE1  PHE  26           HE2      PHE  26   2.103   0.972   0.972
  194    HE2  PHE  26           HE1      PHE  26   3.111  -2.550  -2.550
  195    HZ   PHE  26           HZ       PHE  26   3.341  -1.149  -1.149
  196    H    ALA  27           H        ALA  27   1.535  -0.940  -0.940
  197    HA   ALA  27           HA       ALA  27   2.068  -0.609  -0.609
  198   1HB   ALA  27          2HB       ALA  27  -0.739  -1.266  -1.266
  199   2HB   ALA  27          1HB       ALA  27  -0.015  -2.119  -2.119
  200   3HB   ALA  27          3HB       ALA  27  -0.094  -0.357  -0.357
  201    H    ASP  28           H        ASP  28   3.803  -1.929  -1.929
  202    HA   ASP  28           HA       ASP  28   3.328  -4.607  -4.607
  203   1HB   ASP  28          2HB       ASP  28   5.226  -3.264  -3.264
  204   2HB   ASP  28          1HB       ASP  28   5.941  -3.270  -3.270
  205    H    ALA  29           H        ALA  29   2.055  -4.874  -4.874
  206    HA   ALA  29           HA       ALA  29   3.776  -6.350  -6.350
  207   1HB   ALA  29          2HB       ALA  29   2.326  -3.867  -3.867
  208   2HB   ALA  29          1HB       ALA  29   2.347  -5.187  -5.187
  209   3HB   ALA  29          3HB       ALA  29   3.864  -4.499  -4.499
  210    H    SER  30           H        SER  30   2.375  -7.483  -7.483
  211    HA   SER  30           HA       SER  30   0.726  -8.969  -8.969
  212   1HB   SER  30          2HB       SER  30  -0.646  -6.789  -6.789
  213   2HB   SER  30          1HB       SER  30  -1.141  -7.493  -7.493
  214    HG   SER  30           HG       SER  30  -2.100  -7.999  -7.999
  215    H    LYS  31           H        LYS  31   0.402 -10.976 -10.976
  216    HA   LYS  31           HA       LYS  31   0.305 -12.774 -12.774
  217   1HB   LYS  31          2HB       LYS  31  -0.739 -10.889 -10.889
  218   2HB   LYS  31          1HB       LYS  31  -1.027 -12.619 -12.619
  219   1HG   LYS  31          2HG       LYS  31  -1.918 -10.791 -10.791
  220   2HG   LYS  31          1HG       LYS  31  -2.870 -10.934 -10.934
  221   1HD   LYS  31          2HD       LYS  31  -3.562 -13.025 -13.025
  222   2HD   LYS  31          1HD       LYS  31  -2.014 -13.480 -13.480
  223   1HE   LYS  31          2HE       LYS  31  -2.777 -11.786 -11.786
  224   2HE   LYS  31          1HE       LYS  31  -4.380 -12.176 -12.176
  225   1HZ   LYS  31          2HZ       LYS  31  -3.563 -14.599 -14.599
  226   2HZ   LYS  31          1HZ       LYS  31  -2.426 -13.938 -13.938
  227   3HZ   LYS  31          3HZ       LYS  31  -4.079 -13.753 -13.753
  228    H    GLY  32           H        GLY  32   2.776 -12.032 -12.032
  229   1HA   GLY  32          2HA       GLY  32   3.828 -12.296 -12.296
  230   2HA   GLY  32          1HA       GLY  32   4.443 -10.996 -10.996
  231    H    ASP  33           H        ASP  33   5.018 -11.913 -11.913
  232    HA   ASP  33           HA       ASP  33   6.922 -14.083 -14.083
  233   1HB   ASP  33          2HB       ASP  33   8.025 -13.305 -13.305
  234   2HB   ASP  33          1HB       ASP  33   7.895 -12.033 -12.033
  235    H    ASP  34           H        ASP  34   4.374 -14.996 -14.996
  236    HA   ASP  34           HA       ASP  34   3.085 -16.536 -16.536
  237   1HB   ASP  34          2HB       ASP  34   5.426 -17.561 -17.561
  238   2HB   ASP  34          1HB       ASP  34   5.355 -16.967 -16.967
  239    H    LEU  35           H        LEU  35   2.394 -14.077 -14.077
  240    HA   LEU  35           HA       LEU  35   2.548 -13.416 -13.416
  241   1HB   LEU  35          2HB       LEU  35   1.641 -12.161 -12.161
  242   2HB   LEU  35          1HB       LEU  35   0.128 -12.564 -12.564
  243    HG   LEU  35           HG       LEU  35   0.829 -10.321 -10.321
  244   1HD1  LEU  35          3HD1      LEU  35  -0.258 -11.959 -11.959
  245   2HD1  LEU  35          2HD1      LEU  35   1.329 -11.992 -11.992
  246   3HD1  LEU  35          1HD1      LEU  35   0.450 -10.470 -10.470
  247   1HD2  LEU  35          2HD2      LEU  35   3.294 -10.845 -10.845
  248   2HD2  LEU  35          1HD2      LEU  35   2.871  -9.807  -9.807
  249   3HD2  LEU  35          3HD2      LEU  35   3.252 -11.507 -11.507
  250    H    LEU  36           H        LEU  36   2.070 -15.261 -15.261
  251    HA   LEU  36           HA       LEU  36  -0.236 -16.837 -16.837
  252   1HB   LEU  36          2HB       LEU  36   1.600 -16.334 -16.334
  253   2HB   LEU  36          1HB       LEU  36   0.225 -17.413 -17.413
  254    HG   LEU  36           HG       LEU  36   2.115 -17.890 -17.890
  255   1HD1  LEU  36          1HD1      LEU  36   3.353 -17.407 -17.407
  256   2HD1  LEU  36          3HD1      LEU  36   2.817 -19.044 -19.044
  257   3HD1  LEU  36          2HD1      LEU  36   3.831 -18.754 -18.754
  258   1HD2  LEU  36          1HD2      LEU  36  -0.060 -19.175 -19.175
  259   2HD2  LEU  36          3HD2      LEU  36   1.348 -20.042 -20.042
  260   3HD2  LEU  36          2HD2      LEU  36   1.054 -19.954 -19.954
  261    HA   PRO  37           HA       PRO  37  -3.559 -14.302 -14.302
  262   1HB   PRO  37          2HB       PRO  37  -4.495 -16.771 -16.771
  263   2HB   PRO  37          1HB       PRO  37  -5.356 -15.714 -15.714
  264   1HG   PRO  37          2HG       PRO  37  -4.454 -18.088 -18.088
  265   2HG   PRO  37          1HG       PRO  37  -4.380 -16.679 -16.679
  266   1HD   PRO  37          2HD       PRO  37  -2.198 -17.994 -17.994
  267   2HD   PRO  37          1HD       PRO  37  -2.146 -17.252 -17.252
  268    H    ALA  38           H        ALA  38  -2.000 -16.515 -16.515
  269    HA   ALA  38           HA       ALA  38  -2.888 -15.056 -15.056
  270   1HB   ALA  38          2HB       ALA  38  -0.821 -17.235 -17.235
  271   2HB   ALA  38          1HB       ALA  38  -1.433 -16.596 -16.596
  272   3HB   ALA  38          3HB       ALA  38  -2.519 -17.448 -17.448
  273    H    GLY  39           H        GLY  39  -1.136 -14.410 -14.410
  274   1HA   GLY  39          2HA       GLY  39   1.366 -13.680 -13.680
  275   2HA   GLY  39          1HA       GLY  39   0.679 -12.572 -12.572
  276    H    THR  40           H        THR  40  -0.536 -13.648 -13.648
  277    HA   THR  40           HA       THR  40  -0.975 -10.858 -10.858
  278    HB   THR  40           HB       THR  40  -1.982 -12.140 -12.140
  279    HG1  THR  40           HG1      THR  40  -2.266 -14.195 -14.195
  280   1HG2  THR  40          2HG2      THR  40  -3.092 -11.386 -11.386
  281   2HG2  THR  40          1HG2      THR  40  -3.986 -12.689 -12.689
  282   3HG2  THR  40          3HG2      THR  40  -3.735 -11.161 -11.161
  283    H    GLU  41           H        GLU  41   0.893 -13.659 -13.659
  284    HA   GLU  41           HA       GLU  41   2.575 -13.931 -13.931
  285   1HB   GLU  41          2HB       GLU  41   3.061 -11.511 -11.511
  286   2HB   GLU  41          1HB       GLU  41   3.669 -11.335 -11.335
  287   1HG   GLU  41          2HG       GLU  41   4.887 -13.496 -13.496
  288   2HG   GLU  41          1HG       GLU  41   4.410 -13.443 -13.443
  289    H    ASP  42           H        ASP  42  -0.086 -12.854 -12.854
  290    HA   ASP  42           HA       ASP  42  -1.052 -12.042 -12.042
  291   1HB   ASP  42          2HB       ASP  42   0.586 -14.109 -14.109
  292   2HB   ASP  42          1HB       ASP  42   1.236 -12.851 -12.851
  293    H    TYR  43           H        TYR  43  -0.250  -9.903  -9.903
  294    HA   TYR  43           HA       TYR  43   1.831  -8.435  -8.435
  295   1HB   TYR  43          2HB       TYR  43  -0.636  -7.393  -7.393
  296   2HB   TYR  43          1HB       TYR  43   0.823  -6.470  -6.470
  297    HD1  TYR  43           HD2      TYR  43   2.657  -8.963  -8.963
  298    HD2  TYR  43           HD1      TYR  43  -0.491  -6.921  -6.921
  299    HE1  TYR  43           HE2      TYR  43   3.593  -9.654  -9.654
  300    HE2  TYR  43           HE1      TYR  43   0.438  -7.608  -7.608
  301    HH   TYR  43           HH       TYR  43   1.888  -9.379  -9.379
  302    H    ILE  44           H        ILE  44   1.418  -6.327  -6.327
  303    HA   ILE  44           HA       ILE  44  -0.576  -6.780  -6.780
  304    HB   ILE  44           HB       ILE  44   2.167  -5.561  -5.561
  305   1HG1  ILE  44          2HG1      ILE  44   2.642  -7.180  -7.180
  306   2HG1  ILE  44          1HG1      ILE  44   0.969  -7.299  -7.299
  307   1HG2  ILE  44          3HG2      ILE  44  -0.030  -5.111  -5.111
  308   2HG2  ILE  44          2HG2      ILE  44   1.673  -4.746  -4.746
  309   3HG2  ILE  44          1HG2      ILE  44   0.777  -3.883  -3.883
  310   1HD1  ILE  44          3HD1      ILE  44   1.922  -8.319  -8.319
  311   2HD1  ILE  44          2HD1      ILE  44   1.882  -9.300  -9.300
  312   3HD1  ILE  44          1HD1      ILE  44   0.386  -8.642  -8.642
  313    H    HIS  45           H        HIS  45  -2.313  -5.676  -5.676
  314    HA   HIS  45           HA       HIS  45  -2.173  -3.157  -3.157
  315   1HB   HIS  45          2HB       HIS  45  -4.101  -5.177  -5.177
  316   2HB   HIS  45          1HB       HIS  45  -4.781  -3.699  -3.699
  317    HD1  HIS  45           HD1      HIS  45  -3.615  -5.212  -5.212
  318    HD2  HIS  45           HD2      HIS  45  -5.509  -1.775  -1.775
  319    HE1  HIS  45           HE1      HIS  45  -4.486  -4.062  -4.062
  320    HE2  HIS  45           HE2      HIS  45  -5.705  -2.030  -2.030
  321    H    ILE  46           H        ILE  46  -1.902  -1.250  -1.250
  322    HA   ILE  46           HA       ILE  46  -2.122  -0.878  -0.878
  323    HB   ILE  46           HB       ILE  46  -1.610   1.207   1.207
  324   1HG1  ILE  46          2HG1      ILE  46   0.053  -0.627  -0.627
  325   2HG1  ILE  46          1HG1      ILE  46   0.754   0.906   0.906
  326   1HG2  ILE  46          2HG2      ILE  46  -1.468   1.218   1.218
  327   2HG2  ILE  46          1HG2      ILE  46  -0.437   2.289   2.289
  328   3HG2  ILE  46          3HG2      ILE  46  -2.190   2.401   2.401
  329   1HD1  ILE  46          1HD1      ILE  46   0.173  -0.063  -0.063
  330   2HD1  ILE  46          3HD1      ILE  46   0.335  -1.588  -1.588
  331   3HD1  ILE  46          2HD1      ILE  46   1.676  -0.444  -0.444
  332    H    ARG  47           H        ARG  47  -3.298   1.727   1.727
  333    HA   ARG  47           HA       ARG  47  -5.378   2.564   2.564
  334   1HB   ARG  47          2HB       ARG  47  -6.105   0.088   0.088
  335   2HB   ARG  47          1HB       ARG  47  -6.648   0.459   0.459
  336   1HG   ARG  47          2HG       ARG  47  -8.567   1.101   1.101
  337   2HG   ARG  47          1HG       ARG  47  -7.706   2.506   2.506
  338   1HD   ARG  47          2HD       ARG  47  -8.050   1.799   1.799
  339   2HD   ARG  47          1HD       ARG  47  -7.200   0.296   0.296
  340    HE   ARG  47           HE       ARG  47  -9.659  -0.147  -0.147
  341   1HH1  ARG  47          2HH1      ARG  47  -8.554   0.974   0.974
  342   2HH1  ARG  47          1HH1      ARG  47  -9.900   0.303   0.303
  343   1HH2  ARG  47          1HH2      ARG  47 -11.429  -1.031  -1.031
  344   2HH2  ARG  47          2HH2      ARG  47 -11.532  -0.836  -0.836
  345    H    ILE  48           H        ILE  48  -6.056   4.337   4.337
  346    HA   ILE  48           HA       ILE  48  -5.902   4.610   4.610
  347    HB   ILE  48           HB       ILE  48  -5.767   6.632   6.632
  348   1HG1  ILE  48          2HG1      ILE  48  -3.946   6.058   6.058
  349   2HG1  ILE  48          1HG1      ILE  48  -3.669   5.545   5.545
  350   1HG2  ILE  48          1HG2      ILE  48  -6.197   7.197   7.197
  351   2HG2  ILE  48          3HG2      ILE  48  -5.704   8.399   8.399
  352   3HG2  ILE  48          2HG2      ILE  48  -7.275   7.610   7.610
  353   1HD1  ILE  48          3HD1      ILE  48  -4.004   8.438   8.438
  354   2HD1  ILE  48          2HD1      ILE  48  -2.450   7.625   7.625
  355   3HD1  ILE  48          1HD1      ILE  48  -3.216   7.704   7.704
  356    H    GLN  49           H        GLN  49  -7.616   5.868   5.868
  357    HA   GLN  49           HA       GLN  49 -10.156   5.924   5.924
  358   1HB   GLN  49          2HB       GLN  49 -11.346   4.928   4.928
  359   2HB   GLN  49          1HB       GLN  49 -10.122   3.827   3.827
  360   1HG   GLN  49          2HG       GLN  49  -8.765   5.174   5.174
  361   2HG   GLN  49          1HG       GLN  49 -10.392   5.062   5.062
  362   1HE2  GLN  49          2HE2      GLN  49 -10.138   1.722   1.722
  363   2HE2  GLN  49          1HE2      GLN  49 -11.019   3.207   3.207
  364    H    GLN  50           H        GLN  50  -9.948   8.174   8.174
  365    HA   GLN  50           HA       GLN  50  -9.812   9.653   9.653
  366   1HB   GLN  50          2HB       GLN  50  -8.740  10.167  10.167
  367   2HB   GLN  50          1HB       GLN  50 -10.203  11.141  11.141
  368   1HG   GLN  50          2HG       GLN  50  -9.555  12.272  12.272
  369   2HG   GLN  50          1HG       GLN  50  -8.098  11.289  11.289
  370   1HE2  GLN  50          2HE2      GLN  50  -6.393  13.819  13.819
  371   2HE2  GLN  50          1HE2      GLN  50  -6.561  12.791  12.791
  372    H    ARG  51           H        ARG  51 -11.677   9.779   9.779
  373    HA   ARG  51           HA       ARG  51 -14.216   9.856   9.856
  374   1HB   ARG  51          2HB       ARG  51 -13.921  10.460  10.460
  375   2HB   ARG  51          1HB       ARG  51 -15.213   9.610   9.610
  376   1HG   ARG  51          2HG       ARG  51 -12.458   8.559   8.559
  377   2HG   ARG  51          1HG       ARG  51 -13.977   8.056   8.056
  378   1HD   ARG  51          2HD       ARG  51 -14.372   7.769   7.769
  379   2HD   ARG  51          1HD       ARG  51 -12.741   7.168   7.168
  380    HE   ARG  51           HE       ARG  51 -13.639   5.377   5.377
  381   1HH1  ARG  51          2HH1      ARG  51 -16.095   7.830   7.830
  382   2HH1  ARG  51          1HH1      ARG  51 -17.371   6.815   6.815
  383   1HH2  ARG  51          1HH2      ARG  51 -15.316   4.042   4.042
  384   2HH2  ARG  51          2HH2      ARG  51 -16.929   4.665   4.665
  385    H    ASN  52           H        ASN  52 -15.199  11.633  11.633
  386    HA   ASN  52           HA       ASN  52 -15.778  13.812  13.812
  387   1HB   ASN  52          2HB       ASN  52 -15.948  13.502  13.502
  388   2HB   ASN  52          1HB       ASN  52 -14.638  14.680  14.680
  389   1HD2  ASN  52          2HD2      ASN  52 -17.231  17.022  17.022
  390   2HD2  ASN  52          1HD2      ASN  52 -16.005  16.181  16.181
  391    H    GLY  53           H        GLY  53 -12.994  12.743  12.743
  392   1HA   GLY  53          2HA       GLY  53 -11.077  13.566  13.566
  393   2HA   GLY  53          1HA       GLY  53 -11.869  15.132  15.132
  394    H    ARG  54           H        ARG  54 -11.355  13.374  13.374
  395    HA   ARG  54           HA       ARG  54  -9.055  15.046  15.046
  396   1HB   ARG  54          2HB       ARG  54 -11.464  14.941  14.941
  397   2HB   ARG  54          1HB       ARG  54 -10.006  15.899  15.899
  398   1HG   ARG  54          2HG       ARG  54 -11.889  16.271  16.271
  399   2HG   ARG  54          1HG       ARG  54 -12.021  17.157  17.157
  400   1HD   ARG  54          2HD       ARG  54  -9.488  17.112  17.112
  401   2HD   ARG  54          1HD       ARG  54 -10.765  18.292  18.292
  402    HE   ARG  54           HE       ARG  54  -8.854  18.338  18.338
  403   1HH1  ARG  54          2HH1      ARG  54 -12.181  19.110  19.110
  404   2HH1  ARG  54          1HH1      ARG  54 -12.284  20.347  20.347
  405   1HH2  ARG  54          1HH2      ARG  54  -8.988  19.964  19.964
  406   2HH2  ARG  54          2HH2      ARG  54 -10.472  20.833  20.833
  407    H    LYS  55           H        LYS  55 -11.344  12.766  12.766
  408    HA   LYS  55           HA       LYS  55  -9.421  11.660  11.660
  409   1HB   LYS  55          2HB       LYS  55 -12.053  10.557  10.557
  410   2HB   LYS  55          1HB       LYS  55 -11.099   9.830   9.830
  411   1HG   LYS  55          2HG       LYS  55 -12.184  12.637  12.637
  412   2HG   LYS  55          1HG       LYS  55 -12.975  11.236  11.236
  413   1HD   LYS  55          2HD       LYS  55 -10.205  12.223  12.223
  414   2HD   LYS  55          1HD       LYS  55 -11.658  12.536  12.536
  415   1HE   LYS  55          2HE       LYS  55 -11.929  10.003  10.003
  416   2HE   LYS  55          1HE       LYS  55 -10.274   9.914   9.914
  417   1HZ   LYS  55          2HZ       LYS  55 -10.990  11.480  11.480
  418   2HZ   LYS  55          1HZ       LYS  55 -10.590   9.839   9.839
  419   3HZ   LYS  55          3HZ       LYS  55  -9.458  10.957  10.957
  420    H    THR  56           H        THR  56  -7.722  11.441  11.441
  421    HA   THR  56           HA       THR  56  -7.947   9.318   9.318
  422    HB   THR  56           HB       THR  56  -5.238  10.149  10.149
  423    HG1  THR  56           HG1      THR  56  -5.441  12.247  12.247
  424   1HG2  THR  56          1HG2      THR  56  -6.773   9.595   9.595
  425   2HG2  THR  56          3HG2      THR  56  -5.841  11.083  11.083
  426   3HG2  THR  56          2HG2      THR  56  -5.026   9.571   9.571
  427    H    LEU  57           H        LEU  57  -7.476   7.221   7.221
  428    HA   LEU  57           HA       LEU  57  -5.826   6.387   6.387
  429   1HB   LEU  57          2HB       LEU  57  -8.664   5.976   5.976
  430   2HB   LEU  57          1HB       LEU  57  -7.832   4.432   4.432
  431    HG   LEU  57           HG       LEU  57  -6.620   5.299   5.299
  432   1HD1  LEU  57          3HD1      LEU  57  -7.928   7.636   7.636
  433   2HD1  LEU  57          2HD1      LEU  57  -8.892   6.975   6.975
  434   3HD1  LEU  57          1HD1      LEU  57  -7.166   7.255   7.255
  435   1HD2  LEU  57          1HD2      LEU  57  -9.332   4.245   4.245
  436   2HD2  LEU  57          3HD2      LEU  57  -8.000   3.669   3.669
  437   3HD2  LEU  57          2HD2      LEU  57  -9.025   4.988   4.988
  438    H    THR  58           H        THR  58  -4.153   5.726   5.726
  439    HA   THR  58           HA       THR  58  -4.505   4.206   4.206
  440    HB   THR  58           HB       THR  58  -1.931   4.136   4.136
  441    HG1  THR  58           HG1      THR  58  -3.199   6.453   6.453
  442   1HG2  THR  58          2HG2      THR  58  -2.555   3.428   3.428
  443   2HG2  THR  58          1HG2      THR  58  -2.058   5.102   5.102
  444   3HG2  THR  58          3HG2      THR  58  -0.953   3.958   3.958
  445    H    THR  59           H        THR  59  -5.083   2.134   2.134
  446    HA   THR  59           HA       THR  59  -4.506   0.405   0.405
  447    HB   THR  59           HB       THR  59  -6.137  -1.092  -1.092
  448    HG1  THR  59           HG1      THR  59  -6.999   1.601   1.601
  449   1HG2  THR  59          1HG2      THR  59  -6.571   0.611   0.611
  450   2HG2  THR  59          3HG2      THR  59  -8.015   0.159   0.159
  451   3HG2  THR  59          2HG2      THR  59  -6.948  -1.091  -1.091
  452    H    VAL  60           H        VAL  60  -3.545  -1.610  -1.610
  453    HA   VAL  60           HA       VAL  60  -2.095  -1.947  -1.947
  454    HB   VAL  60           HB       VAL  60  -1.147  -3.281  -3.281
  455   1HG1  VAL  60          1HG1      VAL  60  -0.106  -2.539  -2.539
  456   2HG1  VAL  60          3HG1      VAL  60   1.028  -2.362  -2.362
  457   3HG1  VAL  60          2HG1      VAL  60   0.274  -3.924  -3.924
  458   1HG2  VAL  60          2HG2      VAL  60  -0.800  -0.359  -0.359
  459   2HG2  VAL  60          1HG2      VAL  60  -1.417  -1.086  -1.086
  460   3HG2  VAL  60          3HG2      VAL  60   0.289  -1.249  -1.249
  461    H    GLN  61           H        GLN  61  -2.914  -3.519  -3.519
  462    HA   GLN  61           HA       GLN  61  -3.991  -5.902  -5.902
  463   1HB   GLN  61          2HB       GLN  61  -5.414  -4.299  -4.299
  464   2HB   GLN  61          1HB       GLN  61  -4.709  -5.347  -5.347
  465   1HG   GLN  61          2HG       GLN  61  -5.602  -7.104  -7.104
  466   2HG   GLN  61          1HG       GLN  61  -6.850  -5.862  -5.862
  467   1HE2  GLN  61          2HE2      GLN  61  -7.084  -6.548  -6.548
  468   2HE2  GLN  61          1HE2      GLN  61  -6.410  -5.243  -5.243
  469    H    GLY  62           H        GLY  62  -3.341  -7.899  -7.899
  470   1HA   GLY  62          2HA       GLY  62  -2.325  -9.334  -9.334
  471   2HA   GLY  62          1HA       GLY  62  -1.242  -7.996  -7.996
  472    H    ILE  63           H        ILE  63  -1.112  -7.468  -7.468
  473    HA   ILE  63           HA       ILE  63   1.285  -8.875  -8.875
  474    HB   ILE  63           HB       ILE  63  -0.480  -7.122  -7.122
  475   1HG1  ILE  63          2HG1      ILE  63   0.722  -5.750  -5.750
  476   2HG1  ILE  63          1HG1      ILE  63   1.797  -5.812  -5.812
  477   1HG2  ILE  63          1HG2      ILE  63   1.610  -8.930  -8.930
  478   2HG2  ILE  63          3HG2      ILE  63   1.818  -7.259  -7.259
  479   3HG2  ILE  63          2HG2      ILE  63   0.325  -8.120  -8.120
  480   1HD1  ILE  63          3HD1      ILE  63   2.846  -7.819  -7.819
  481   2HD1  ILE  63          2HD1      ILE  63   2.099  -7.000  -7.000
  482   3HD1  ILE  63          1HD1      ILE  63   3.274  -6.148  -6.148
  483    H    ALA  64           H        ALA  64   1.750 -10.453 -10.453
  484    HA   ALA  64           HA       ALA  64  -0.403 -12.372 -12.372
  485   1HB   ALA  64          1HB       ALA  64   2.181 -12.712 -12.712
  486   2HB   ALA  64          3HB       ALA  64   2.267 -12.984 -12.984
  487   3HB   ALA  64          2HB       ALA  64   1.190 -13.965 -13.965
  488    H    ASP  65           H        ASP  65  -1.422 -12.824 -12.824
  489    HA   ASP  65           HA       ASP  65  -1.250 -11.137 -11.137
  490   1HB   ASP  65          2HB       ASP  65  -2.633 -12.951 -12.951
  491   2HB   ASP  65          1HB       ASP  65  -3.302 -12.281 -12.281
  492    H    ASP  66           H        ASP  66   0.603 -13.877 -13.877
  493    HA   ASP  66           HA       ASP  66   1.423 -14.799 -14.799
  494   1HB   ASP  66          2HB       ASP  66   1.967 -15.428 -15.428
  495   2HB   ASP  66          1HB       ASP  66   3.524 -15.085 -15.085
  496    H    TYR  67           H        TYR  67   2.275 -12.011 -12.011
  497    HA   TYR  67           HA       TYR  67   4.832 -11.414 -11.414
  498   1HB   TYR  67          2HB       TYR  67   2.476  -9.583  -9.583
  499   2HB   TYR  67          1HB       TYR  67   4.111  -8.999  -8.999
  500    HD1  TYR  67           HD1      TYR  67   4.140 -12.046 -12.046
  501    HD2  TYR  67           HD2      TYR  67   3.545  -7.854  -7.854
  502    HE1  TYR  67           HE1      TYR  67   4.597 -12.202 -12.202
  503    HE2  TYR  67           HE2      TYR  67   3.991  -7.992  -7.992
  504    HH   TYR  67           HH       TYR  67   3.972  -9.616  -9.616
  505    H    ASP  68           H        ASP  68   5.162  -9.321  -9.321
  506    HA   ASP  68           HA       ASP  68   4.219 -10.134 -10.134
  507   1HB   ASP  68          2HB       ASP  68   6.353  -8.105  -8.105
  508   2HB   ASP  68          1HB       ASP  68   6.031  -8.791  -8.791
  509    H    LYS  69           H        LYS  69   2.083  -9.219  -9.219
  510    HA   LYS  69           HA       LYS  69   1.318  -6.752  -6.752
  511   1HB   LYS  69          2HB       LYS  69   0.113  -8.444  -8.444
  512   2HB   LYS  69          1HB       LYS  69  -0.676  -7.043  -7.043
  513   1HG   LYS  69          2HG       LYS  69  -0.311  -8.292  -8.292
  514   2HG   LYS  69          1HG       LYS  69  -0.104  -9.710  -9.710
  515   1HD   LYS  69          2HD       LYS  69  -2.463  -7.938  -7.938
  516   2HD   LYS  69          1HD       LYS  69  -2.471  -9.055  -9.055
  517   1HE   LYS  69          2HE       LYS  69  -1.790  -9.984  -9.984
  518   2HE   LYS  69          1HE       LYS  69  -3.467  -9.844  -9.844
  519   1HZ   LYS  69          1HZ       LYS  69  -2.678 -11.255 -11.255
  520   2HZ   LYS  69          3HZ       LYS  69  -1.359 -11.649 -11.649
  521   3HZ   LYS  69          2HZ       LYS  69  -2.931 -12.022 -12.022
  522    H    LYS  70           H        LYS  70   2.359  -7.688  -7.688
  523    HA   LYS  70           HA       LYS  70   1.823  -5.310  -5.310
  524   1HB   LYS  70          2HB       LYS  70   4.144  -7.196  -7.196
  525   2HB   LYS  70          1HB       LYS  70   3.560  -6.001  -6.001
  526   1HG   LYS  70          2HG       LYS  70   2.202  -7.534  -7.534
  527   2HG   LYS  70          1HG       LYS  70   1.330  -7.549  -7.549
  528   1HD   LYS  70          2HD       LYS  70   2.200  -9.528  -9.528
  529   2HD   LYS  70          1HD       LYS  70   3.812  -9.102  -9.102
  530   1HE   LYS  70          2HE       LYS  70   1.588  -9.768  -9.768
  531   2HE   LYS  70          1HE       LYS  70   2.576 -11.029 -11.029
  532   1HZ   LYS  70          1HZ       LYS  70   4.479  -9.430  -9.430
  533   2HZ   LYS  70          3HZ       LYS  70   3.285  -9.059  -9.059
  534   3HZ   LYS  70          2HZ       LYS  70   3.810 -10.656 -10.656
  535    H    LYS  71           H        LYS  71   4.893  -6.311  -6.311
  536    HA   LYS  71           HA       LYS  71   5.990  -3.655  -3.655
  537   1HB   LYS  71          2HB       LYS  71   7.238  -5.935  -5.935
  538   2HB   LYS  71          1HB       LYS  71   7.210  -5.838  -5.838
  539   1HG   LYS  71          2HG       LYS  71   8.327  -3.612  -3.612
  540   2HG   LYS  71          1HG       LYS  71   8.498  -3.909  -3.909
  541   1HD   LYS  71          2HD       LYS  71  10.160  -5.408  -5.408
  542   2HD   LYS  71          1HD       LYS  71   9.427  -6.088  -6.088
  543   1HE   LYS  71          2HE       LYS  71  10.507  -3.337  -3.337
  544   2HE   LYS  71          1HE       LYS  71  11.677  -4.648  -4.648
  545   1HZ   LYS  71          3HZ       LYS  71  10.355  -5.720  -5.720
  546   2HZ   LYS  71          2HZ       LYS  71   9.696  -4.184  -4.184
  547   3HZ   LYS  71          1HZ       LYS  71  11.365  -4.419  -4.419
  548    H    LEU  72           H        LEU  72   4.249  -5.444  -5.444
  549    HA   LEU  72           HA       LEU  72   5.061  -4.325  -4.325
  550   1HB   LEU  72          2HB       LEU  72   3.018  -5.976  -5.976
  551   2HB   LEU  72          1HB       LEU  72   2.152  -4.568  -4.568
  552    HG   LEU  72           HG       LEU  72   2.403  -6.277  -6.277
  553   1HD1  LEU  72          3HD1      LEU  72   2.567  -3.664  -3.664
  554   2HD1  LEU  72          2HD1      LEU  72   4.182  -4.080  -4.080
  555   3HD1  LEU  72          1HD1      LEU  72   2.763  -4.785  -4.785
  556   1HD2  LEU  72          2HD2      LEU  72   4.810  -6.809  -6.809
  557   2HD2  LEU  72          1HD2      LEU  72   4.363  -7.208  -7.208
  558   3HD2  LEU  72          3HD2      LEU  72   5.295  -5.750  -5.750
  559    H    VAL  73           H        VAL  73   2.193  -3.198  -3.198
  560    HA   VAL  73           HA       VAL  73   2.238  -0.676  -0.676
  561    HB   VAL  73           HB       VAL  73   0.133  -1.835  -1.835
  562   1HG1  VAL  73          3HG1      VAL  73   1.137  -2.356  -2.356
  563   2HG1  VAL  73          2HG1      VAL  73   0.584  -0.737  -0.737
  564   3HG1  VAL  73          1HG1      VAL  73  -0.575  -1.950  -1.950
  565   1HG2  VAL  73          3HG2      VAL  73   0.723   0.869   0.869
  566   2HG2  VAL  73          2HG2      VAL  73  -0.881   0.137   0.137
  567   3HG2  VAL  73          1HG2      VAL  73  -0.224   0.698   0.698
  568    H    LYS  74           H        LYS  74   3.046  -1.816  -1.816
  569    HA   LYS  74           HA       LYS  74   3.366   0.605   0.605
  570   1HB   LYS  74          2HB       LYS  74   3.516  -1.551  -1.551
  571   2HB   LYS  74          1HB       LYS  74   5.022  -1.906  -1.906
  572   1HG   LYS  74          2HG       LYS  74   5.642   0.453   0.453
  573   2HG   LYS  74          1HG       LYS  74   4.510  -0.214  -0.214
  574   1HD   LYS  74          2HD       LYS  74   6.142  -2.358  -2.358
  575   2HD   LYS  74          1HD       LYS  74   7.245  -0.984  -0.984
  576   1HE   LYS  74          2HE       LYS  74   5.253  -1.641  -1.641
  577   2HE   LYS  74          1HE       LYS  74   6.912  -2.239  -2.239
  578   1HZ   LYS  74          1HZ       LYS  74   6.562   0.630   0.630
  579   2HZ   LYS  74          3HZ       LYS  74   6.200   0.010   0.010
  580   3HZ   LYS  74          2HZ       LYS  74   7.738  -0.219  -0.219
  581    H    ALA  75           H        ALA  75   5.704  -1.155  -1.155
  582    HA   ALA  75           HA       ALA  75   7.854   0.628   0.628
  583   1HB   ALA  75          3HB       ALA  75   7.183  -1.340  -1.340
  584   2HB   ALA  75          2HB       ALA  75   8.652  -0.366  -0.366
  585   3HB   ALA  75          1HB       ALA  75   8.370  -1.495  -1.495
  586    H    PHE  76           H        PHE  76   5.048   0.688   0.688
  587    HA   PHE  76           HA       PHE  76   5.936   2.595   2.595
  588   1HB   PHE  76          2HB       PHE  76   3.813   1.077   1.077
  589   2HB   PHE  76          1HB       PHE  76   3.067   2.426   2.426
  590    HD1  PHE  76           HD1      PHE  76   4.541   1.308   1.308
  591    HD2  PHE  76           HD2      PHE  76   2.616   4.502   4.502
  592    HE1  PHE  76           HE1      PHE  76   4.145   2.444   2.444
  593    HE2  PHE  76           HE2      PHE  76   2.216   5.641   5.641
  594    HZ   PHE  76           HZ       PHE  76   2.982   4.611   4.611
  595    H    LYS  77           H        LYS  77   4.118   2.949   2.949
  596    HA   LYS  77           HA       LYS  77   3.903   5.772   5.772
  597   1HB   LYS  77          2HB       LYS  77   3.644   3.816   3.816
  598   2HB   LYS  77          1HB       LYS  77   3.447   5.548   5.548
  599   1HG   LYS  77          2HG       LYS  77   1.491   5.624   5.624
  600   2HG   LYS  77          1HG       LYS  77   1.859   4.137   4.137
  601   1HD   LYS  77          2HD       LYS  77   1.533   3.950   3.950
  602   2HD   LYS  77          1HD       LYS  77   0.081   4.221   4.221
  603   1HE   LYS  77          2HE       LYS  77   0.696   2.257   2.257
  604   2HE   LYS  77          1HE       LYS  77   2.054   1.960   1.960
  605   1HZ   LYS  77          1HZ       LYS  77   0.021   2.111   2.111
  606   2HZ   LYS  77          3HZ       LYS  77  -0.770   1.447   1.447
  607   3HZ   LYS  77          2HZ       LYS  77   0.575   0.664   0.664
  608    H    LYS  78           H        LYS  78   6.547   3.769   3.769
  609    HA   LYS  78           HA       LYS  78   7.921   5.768   5.768
  610   1HB   LYS  78          2HB       LYS  78   8.728   2.982   2.982
  611   2HB   LYS  78          1HB       LYS  78   9.703   4.038   4.038
  612   1HG   LYS  78          2HG       LYS  78   6.928   3.131   3.131
  613   2HG   LYS  78          1HG       LYS  78   8.401   2.305   2.305
  614   1HD   LYS  78          2HD       LYS  78   9.155   4.431   4.431
  615   2HD   LYS  78          1HD       LYS  78   7.589   5.138   5.138
  616   1HE   LYS  78          2HE       LYS  78   6.502   3.992   3.992
  617   2HE   LYS  78          1HE       LYS  78   7.518   2.562   2.562
  618   1HZ   LYS  78          3HZ       LYS  78   8.749   4.961   4.961
  619   2HZ   LYS  78          2HZ       LYS  78   7.665   4.110   4.110
  620   3HZ   LYS  78          1HZ       LYS  78   9.031   3.332   3.332
  621    H    LYS  79           H        LYS  79   7.657   4.708   4.708
  622    HA   LYS  79           HA       LYS  79  10.225   5.902   5.902
  623   1HB   LYS  79          2HB       LYS  79   9.244   3.601   3.601
  624   2HB   LYS  79          1HB       LYS  79   8.391   4.627   4.627
  625   1HG   LYS  79          2HG       LYS  79  11.035   5.511   5.511
  626   2HG   LYS  79          1HG       LYS  79  11.132   3.750   3.750
  627   1HD   LYS  79          2HD       LYS  79   9.507   3.664   3.664
  628   2HD   LYS  79          1HD       LYS  79   9.603   5.423   5.423
  629   1HE   LYS  79          2HE       LYS  79  11.759   3.398   3.398
  630   2HE   LYS  79          1HE       LYS  79  11.097   4.603   4.603
  631   1HZ   LYS  79          2HZ       LYS  79  12.015   6.195   6.195
  632   2HZ   LYS  79          1HZ       LYS  79  13.089   4.907   4.907
  633   3HZ   LYS  79          3HZ       LYS  79  12.980   5.672   5.672
  634    H    PHE  80           H        PHE  80   6.775   6.101   6.101
  635    HA   PHE  80           HA       PHE  80   7.323   8.734   8.734
  636   1HB   PHE  80          2HB       PHE  80   4.767   7.254   7.254
  637   2HB   PHE  80          1HB       PHE  80   5.599   8.409   8.409
  638    HD1  PHE  80           HD1      PHE  80   5.655   4.936   4.936
  639    HD2  PHE  80           HD2      PHE  80   7.152   7.696   7.696
  640    HE1  PHE  80           HE1      PHE  80   6.637   3.076   3.076
  641    HE2  PHE  80           HE2      PHE  80   8.138   5.838   5.838
  642    HZ   PHE  80           HZ       PHE  80   7.880   3.523   3.523
  643    H    ALA  81           H        ALA  81   5.876   7.239   7.239
  644    HA   ALA  81           HA       ALA  81   4.618   8.034   8.034
  645   1HB   ALA  81          2HB       ALA  81   5.708  10.508  10.508
  646   2HB   ALA  81          1HB       ALA  81   4.379  10.681  10.681
  647   3HB   ALA  81          3HB       ALA  81   5.873   9.885   9.885
  648    H    CYS  82           H        CYS  82   3.223   7.011   7.011
  649    HA   CYS  82           HA       CYS  82   0.938   8.846   8.846
  650   1HB   CYS  82          2HB       CYS  82   1.785   6.509   6.509
  651   2HB   CYS  82          1HB       CYS  82   0.320   7.453   7.453
  652    HG   CYS  82           HG       CYS  82   2.682   8.147   8.147
  653    H    ASN  83           H        ASN  83  -1.043   8.246   8.246
  654    HA   ASN  83           HA       ASN  83  -1.304   6.238   6.238
  655   1HB   ASN  83          2HB       ASN  83  -3.075   8.156   8.156
  656   2HB   ASN  83          1HB       ASN  83  -3.886   6.682   6.682
  657   1HD2  ASN  83          2HD2      ASN  83  -2.834   7.289   7.289
  658   2HD2  ASN  83          1HD2      ASN  83  -2.614   6.049   6.049
  659    H    GLY  84           H        GLY  84  -0.709   4.224   4.224
  660   1HA   GLY  84          2HA       GLY  84  -2.172   3.105   3.105
  661   2HA   GLY  84          1HA       GLY  84  -0.682   2.459   2.459
  662    H    THR  85           H        THR  85  -3.671   1.579   1.579
  663    HA   THR  85           HA       THR  85  -3.764   0.048   0.048
  664    HB   THR  85           HB       THR  85  -6.214   0.382   0.382
  665    HG1  THR  85           HG1      THR  85  -6.695   0.962   0.962
  666   1HG2  THR  85          1HG2      THR  85  -4.615   2.928   2.928
  667   2HG2  THR  85          3HG2      THR  85  -6.222   2.722   2.722
  668   3HG2  THR  85          2HG2      THR  85  -4.859   1.803   1.803
  669    H    VAL  86           H        VAL  86  -3.933  -2.042  -2.042
  670    HA   VAL  86           HA       VAL  86  -4.567  -2.997  -2.997
  671    HB   VAL  86           HB       VAL  86  -2.721  -4.011  -4.011
  672   1HG1  VAL  86          2HG1      VAL  86  -4.299  -3.838  -3.838
  673   2HG1  VAL  86          1HG1      VAL  86  -4.514  -5.540  -5.540
  674   3HG1  VAL  86          3HG1      VAL  86  -2.897  -4.901  -4.901
  675   1HG2  VAL  86          2HG2      VAL  86  -4.467  -5.272  -5.272
  676   2HG2  VAL  86          1HG2      VAL  86  -3.050  -6.054  -6.054
  677   3HG2  VAL  86          3HG2      VAL  86  -4.629  -6.257  -6.257
  678    H    ILE  87           H        ILE  87  -6.592  -3.423  -3.423
  679    HA   ILE  87           HA       ILE  87  -8.461  -4.527  -4.527
  680    HB   ILE  87           HB       ILE  87 -10.251  -3.172  -3.172
  681   1HG1  ILE  87          2HG1      ILE  87  -9.898  -3.334  -3.334
  682   2HG1  ILE  87          1HG1      ILE  87 -10.295  -1.700  -1.700
  683   1HG2  ILE  87          3HG2      ILE  87  -7.970  -2.017  -2.017
  684   2HG2  ILE  87          2HG2      ILE  87  -8.418  -0.937  -0.937
  685   3HG2  ILE  87          1HG2      ILE  87  -9.572  -1.282  -1.282
  686   1HD1  ILE  87          2HD1      ILE  87  -7.513  -1.833  -1.833
  687   2HD1  ILE  87          1HD1      ILE  87  -8.001  -2.656  -2.656
  688   3HD1  ILE  87          3HD1      ILE  87  -8.527  -1.002  -1.002
  689    H    GLU  88           H        GLU  88 -10.037  -5.959  -5.959
  690    HA   GLU  88           HA       GLU  88  -9.228  -7.325  -7.325
  691   1HB   GLU  88          2HB       GLU  88 -10.076  -8.302  -8.302
  692   2HB   GLU  88          1HB       GLU  88 -11.625  -8.209  -8.209
  693   1HG   GLU  88          2HG       GLU  88 -11.023  -9.767  -9.767
  694   2HG   GLU  88          1HG       GLU  88  -9.297  -9.501  -9.501
  695    H    HIS  89           H        HIS  89  -9.831  -5.617  -5.617
  696    HA   HIS  89           HA       HIS  89 -12.374  -4.527  -4.527
  697   1HB   HIS  89          2HB       HIS  89 -10.041  -4.092  -4.092
  698   2HB   HIS  89          1HB       HIS  89 -10.792  -5.075  -5.075
  699    HD1  HIS  89           HD1      HIS  89 -12.340  -3.901  -3.901
  700    HD2  HIS  89           HD2      HIS  89 -11.591  -1.700  -1.700
  701    HE1  HIS  89           HE1      HIS  89 -13.455  -1.679  -1.679
  702    HE2  HIS  89           HE2      HIS  89 -12.916  -0.330  -0.330
  703    HA   PRO  90           HA       PRO  90 -14.681  -7.951  -7.951
  704   1HB   PRO  90          2HB       PRO  90 -16.938  -6.680  -6.680
  705   2HB   PRO  90          1HB       PRO  90 -16.449  -6.861  -6.861
  706   1HG   PRO  90          2HG       PRO  90 -16.193  -4.487  -4.487
  707   2HG   PRO  90          1HG       PRO  90 -16.669  -4.553  -4.553
  708   1HD   PRO  90          2HD       PRO  90 -14.140  -3.908  -3.908
  709   2HD   PRO  90          1HD       PRO  90 -14.503  -4.546  -4.546
  710    H    GLU  91           H        GLU  91 -13.782  -5.192  -5.192
  711    HA   GLU  91           HA       GLU  91 -14.861  -6.199  -6.199
  712   1HB   GLU  91          2HB       GLU  91 -13.900  -3.709  -3.709
  713   2HB   GLU  91          1HB       GLU  91 -12.893  -4.165  -4.165
  714   1HG   GLU  91          2HG       GLU  91 -15.886  -4.231  -4.231
  715   2HG   GLU  91          1HG       GLU  91 -14.964  -2.761  -2.761
  716    H    TYR  92           H        TYR  92 -11.923  -6.440  -6.440
  717    HA   TYR  92           HA       TYR  92 -10.715  -7.925  -7.925
  718   1HB   TYR  92          2HB       TYR  92  -8.991  -6.426  -6.426
  719   2HB   TYR  92          1HB       TYR  92  -8.652  -6.903  -6.903
  720    HD1  TYR  92           HD1      TYR  92 -10.588  -5.818  -5.818
  721    HD2  TYR  92           HD2      TYR  92  -9.091  -4.138  -4.138
  722    HE1  TYR  92           HE1      TYR  92 -11.232  -3.584  -3.584
  723    HE2  TYR  92           HE2      TYR  92  -9.733  -1.895  -1.895
  724    HH   TYR  92           HH       TYR  92 -10.113  -0.898  -0.898
  725    H    GLY  93           H        GLY  93 -10.426  -7.324  -7.324
  726   1HA   GLY  93          2HA       GLY  93 -10.678  -9.064  -9.064
  727   2HA   GLY  93          1HA       GLY  93 -10.217 -10.229 -10.229
  728    H    GLU  94           H        GLU  94  -9.175  -8.378  -8.378
  729    HA   GLU  94           HA       GLU  94  -7.202  -8.257  -8.257
  730   1HB   GLU  94          2HB       GLU  94  -7.177 -10.745 -10.745
  731   2HB   GLU  94          1HB       GLU  94  -5.763 -10.086 -10.086
  732   1HG   GLU  94          2HG       GLU  94  -4.824 -10.968 -10.968
  733   2HG   GLU  94          1HG       GLU  94  -5.102  -9.302  -9.302
  734    H    VAL  95           H        VAL  95  -7.127  -6.076  -6.076
  735    HA   VAL  95           HA       VAL  95  -4.704  -5.721  -5.721
  736    HB   VAL  95           HB       VAL  95  -5.745  -3.901  -3.901
  737   1HG1  VAL  95          1HG1      VAL  95  -6.900  -6.660  -6.660
  738   2HG1  VAL  95          3HG1      VAL  95  -7.403  -5.404  -5.404
  739   3HG1  VAL  95          2HG1      VAL  95  -5.709  -5.885  -5.885
  740   1HG2  VAL  95          3HG2      VAL  95  -7.866  -4.275  -4.275
  741   2HG2  VAL  95          2HG2      VAL  95  -7.615  -2.966  -2.966
  742   3HG2  VAL  95          1HG2      VAL  95  -8.487  -4.417  -4.417
  743    H    ILE  96           H        ILE  96  -3.459  -3.974  -3.974
  744    HA   ILE  96           HA       ILE  96  -4.018  -2.847  -2.847
  745    HB   ILE  96           HB       ILE  96  -1.782  -2.554  -2.554
  746   1HG1  ILE  96          2HG1      ILE  96  -2.260  -4.265  -4.265
  747   2HG1  ILE  96          1HG1      ILE  96  -0.656  -3.877  -3.877
  748   1HG2  ILE  96          3HG2      ILE  96  -2.241  -0.768  -0.768
  749   2HG2  ILE  96          2HG2      ILE  96  -0.683  -0.956  -0.956
  750   3HG2  ILE  96          1HG2      ILE  96  -2.055  -0.285  -0.285
  751   1HD1  ILE  96          2HD1      ILE  96  -1.921  -2.303  -2.303
  752   2HD1  ILE  96          1HD1      ILE  96  -1.030  -3.796  -3.796
  753   3HD1  ILE  96          3HD1      ILE  96  -0.217  -2.420  -2.420
  754    H    GLN  97           H        GLN  97  -4.217  -0.587  -0.587
  755    HA   GLN  97           HA       GLN  97  -5.315   1.008   1.008
  756   1HB   GLN  97          2HB       GLN  97  -6.759  -0.027  -0.027
  757   2HB   GLN  97          1HB       GLN  97  -6.521   1.671   1.671
  758   1HG   GLN  97          2HG       GLN  97  -7.475   2.278   2.278
  759   2HG   GLN  97          1HG       GLN  97  -7.764   0.568   0.568
  760   1HE2  GLN  97          2HE2      GLN  97 -10.941   0.916   0.916
  761   2HE2  GLN  97          1HE2      GLN  97  -9.921   0.459   0.459
  762    H    LEU  98           H        LEU  98  -3.542   2.310   2.310
  763    HA   LEU  98           HA       LEU  98  -2.349   3.637   3.637
  764   1HB   LEU  98          2HB       LEU  98  -1.806   3.817   3.817
  765   2HB   LEU  98          1HB       LEU  98  -0.924   4.724   4.724
  766    HG   LEU  98           HG       LEU  98  -1.040   1.715   1.715
  767   1HD1  LEU  98          1HD1      LEU  98   0.734   3.600   3.600
  768   2HD1  LEU  98          3HD1      LEU  98   1.392   2.083   2.083
  769   3HD1  LEU  98          2HD1      LEU  98   0.039   2.065   2.065
  770   1HD2  LEU  98          1HD2      LEU  98   0.385   3.802   3.802
  771   2HD2  LEU  98          3HD2      LEU  98  -0.305   2.266   2.266
  772   3HD2  LEU  98          2HD2      LEU  98   1.229   2.291   2.291
  773    H    GLN  99           H        GLN  99  -2.158   5.982   5.982
  774    HA   GLN  99           HA       GLN  99  -4.648   7.257   7.257
  775   1HB   GLN  99          2HB       GLN  99  -3.086   7.377   7.377
  776   2HB   GLN  99          1HB       GLN  99  -3.076   8.978   8.978
  777   1HG   GLN  99          2HG       GLN  99  -5.623   7.453   7.453
  778   2HG   GLN  99          1HG       GLN  99  -4.914   8.427   8.427
  779   1HE2  GLN  99          2HE2      GLN  99  -5.526  11.529  11.529
  780   2HE2  GLN  99          1HE2      GLN  99  -4.383  10.704  10.704
  781    H    GLY 100           H        GLY 100  -4.728   9.079   9.079
  782   1HA   GLY 100          2HA       GLY 100  -3.950  10.837  10.837
  783   2HA   GLY 100          1HA       GLY 100  -2.321  10.493  10.493
  784    H    ASP 101           H        ASP 101  -2.162  11.074  11.074
  785    HA   ASP 101           HA       ASP 101  -2.731   8.837   8.837
  786   1HB   ASP 101          2HB       ASP 101  -1.647  10.285  10.285
  787   2HB   ASP 101          1HB       ASP 101  -3.037  11.022  11.022
  788    H    GLN 102           H        GLN 102  -1.411   7.295   7.295
  789    HA   GLN 102           HA       GLN 102   1.481   7.667   7.667
  790   1HB   GLN 102          2HB       GLN 102  -0.325   5.973   5.973
  791   2HB   GLN 102          1HB       GLN 102   1.228   5.275   5.275
  792   1HG   GLN 102          2HG       GLN 102   1.038   6.512   6.512
  793   2HG   GLN 102          1HG       GLN 102   2.417   6.881   6.881
  794   1HE2  GLN 102          2HE2      GLN 102  -0.571   9.665   9.665
  795   2HE2  GLN 102          1HE2      GLN 102  -0.924   7.983   7.983
  796    H    ARG 103           H        ARG 103  -0.651   6.851   6.851
  797    HA   ARG 103           HA       ARG 103  -0.303   4.284   4.284
  798   1HB   ARG 103          2HB       ARG 103  -1.031   4.972   4.972
  799   2HB   ARG 103          1HB       ARG 103  -1.710   6.171   6.171
  800   1HG   ARG 103          2HG       ARG 103   0.896   6.673   6.673
  801   2HG   ARG 103          1HG       ARG 103  -0.640   6.941   6.941
  802   1HD   ARG 103          2HD       ARG 103  -0.481   8.099   8.099
  803   2HD   ARG 103          1HD       ARG 103   0.659   8.781   8.781
  804    HE   ARG 103           HE       ARG 103  -2.064   8.581   8.581
  805   1HH1  ARG 103          2HH1      ARG 103   0.310  10.580  10.580
  806   2HH1  ARG 103          1HH1      ARG 103  -0.501  12.062  12.062
  807   1HH2  ARG 103          1HH2      ARG 103  -3.130  10.529  10.529
  808   2HH2  ARG 103          2HH2      ARG 103  -2.454  12.034  12.034
  809    H    LYS 104           H        LYS 104   1.933   6.969   6.969
  810    HA   LYS 104           HA       LYS 104   3.823   5.332   5.332
  811   1HB   LYS 104          2HB       LYS 104   3.302   7.886   7.886
  812   2HB   LYS 104          1HB       LYS 104   4.436   8.092   8.092
  813   1HG   LYS 104          2HG       LYS 104   5.684   8.333   8.333
  814   2HG   LYS 104          1HG       LYS 104   6.079   6.735   6.735
  815   1HD   LYS 104          2HD       LYS 104   5.642   6.035   6.035
  816   2HD   LYS 104          1HD       LYS 104   3.951   6.169   6.169
  817   1HE   LYS 104          2HE       LYS 104   4.160   7.303   7.303
  818   2HE   LYS 104          1HE       LYS 104   4.011   8.542   8.542
  819   1HZ   LYS 104          1HZ       LYS 104   6.566   8.512   8.512
  820   2HZ   LYS 104          3HZ       LYS 104   6.392   7.757   7.757
  821   3HZ   LYS 104          2HZ       LYS 104   5.746   9.301   9.301
  822    H    ASN 105           H        ASN 105   3.207   6.486   6.486
  823    HA   ASN 105           HA       ASN 105   5.818   6.121   6.121
  824   1HB   ASN 105          2HB       ASN 105   3.151   6.081   6.081
  825   2HB   ASN 105          1HB       ASN 105   4.729   6.337   6.337
  826   1HD2  ASN 105          2HD2      ASN 105   3.938   9.719   9.719
  827   2HD2  ASN 105          1HD2      ASN 105   4.099   8.320   8.320
  828    H    ILE 106           H        ILE 106   2.869   4.123   4.123
  829    HA   ILE 106           HA       ILE 106   3.936   1.990   1.990
  830    HB   ILE 106           HB       ILE 106   1.524   2.268   2.268
  831   1HG1  ILE 106          2HG1      ILE 106   1.029  -0.136  -0.136
  832   2HG1  ILE 106          1HG1      ILE 106   2.699  -0.360  -0.360
  833   1HG2  ILE 106          1HG2      ILE 106   1.736   2.920   2.920
  834   2HG2  ILE 106          3HG2      ILE 106   2.037   1.225   1.225
  835   3HG2  ILE 106          2HG2      ILE 106   0.492   1.711   1.711
  836   1HD1  ILE 106          2HD1      ILE 106   3.456   0.308   0.308
  837   2HD1  ILE 106          1HD1      ILE 106   1.775   0.478   0.478
  838   3HD1  ILE 106          3HD1      ILE 106   2.400  -1.104  -1.104
  839    H    CYS 107           H        CYS 107   3.683   2.454   2.454
  840    HA   CYS 107           HA       CYS 107   4.908   0.059   0.059
  841   1HB   CYS 107          2HB       CYS 107   3.823   1.440   1.440
  842   2HB   CYS 107          1HB       CYS 107   4.890   2.794   2.794
  843    HG   CYS 107           HG       CYS 107   5.441   0.624   0.624
  844    H    GLN 108           H        GLN 108   6.145   3.081   3.081
  845    HA   GLN 108           HA       GLN 108   8.907   2.560   2.560
  846   1HB   GLN 108          2HB       GLN 108   8.515   4.824   4.824
  847   2HB   GLN 108          1HB       GLN 108   7.303   4.646   4.646
  848   1HG   GLN 108          2HG       GLN 108   8.871   5.558   5.558
  849   2HG   GLN 108          1HG       GLN 108   9.521   3.923   3.923
  850   1HE2  GLN 108          2HE2      GLN 108  12.254   4.608   4.608
  851   2HE2  GLN 108          1HE2      GLN 108  11.138   3.379   3.379
  852    H    PHE 109           H        PHE 109   6.707   2.168   2.168
  853    HA   PHE 109           HA       PHE 109   8.653   1.416   1.416
  854   1HB   PHE 109          2HB       PHE 109   6.405   2.212   2.212
  855   2HB   PHE 109          1HB       PHE 109   5.693   0.786   0.786
  856    HD1  PHE 109           HD1      PHE 109   8.175   1.733   1.733
  857    HD2  PHE 109           HD2      PHE 109   5.218  -1.043  -1.043
  858    HE1  PHE 109           HE1      PHE 109   8.374   0.535   0.535
  859    HE2  PHE 109           HE2      PHE 109   5.412  -2.249  -2.249
  860    HZ   PHE 109           HZ       PHE 109   6.991  -1.457  -1.457
  861    H    LEU 110           H        LEU 110   6.387  -0.442  -0.442
  862    HA   LEU 110           HA       LEU 110   7.101  -3.001  -3.001
  863   1HB   LEU 110          2HB       LEU 110   5.923  -1.856  -1.856
  864   2HB   LEU 110          1HB       LEU 110   6.402  -3.541  -3.541
  865    HG   LEU 110           HG       LEU 110   4.781  -4.124  -4.124
  866   1HD1  LEU 110          2HD1      LEU 110   5.272  -2.326  -2.326
  867   2HD1  LEU 110          1HD1      LEU 110   4.368  -1.196  -1.196
  868   3HD1  LEU 110          3HD1      LEU 110   3.539  -2.550  -2.550
  869   1HD2  LEU 110          2HD2      LEU 110   3.977  -3.231  -3.231
  870   2HD2  LEU 110          1HD2      LEU 110   2.803  -3.622  -3.622
  871   3HD2  LEU 110          3HD2      LEU 110   3.258  -1.943  -1.943
  872    H    VAL 111           H        VAL 111   8.697  -0.783  -0.783
  873    HA   VAL 111           HA       VAL 111  10.555  -2.822  -2.822
  874    HB   VAL 111           HB       VAL 111  10.437   0.132   0.132
  875   1HG1  VAL 111          2HG1      VAL 111  12.238  -2.072  -2.072
  876   2HG1  VAL 111          1HG1      VAL 111  11.792  -0.837  -0.837
  877   3HG1  VAL 111          3HG1      VAL 111  12.601  -0.377  -0.377
  878   1HG2  VAL 111          1HG2      VAL 111   8.601  -1.694  -1.694
  879   2HG2  VAL 111          3HG2      VAL 111   9.048  -0.298  -0.298
  880   3HG2  VAL 111          2HG2      VAL 111   9.770  -1.873  -1.873
  881    H    GLU 112           H        GLU 112  10.405  -0.122  -0.122
  882    HA   GLU 112           HA       GLU 112  13.209   0.130   0.130
  883   1HB   GLU 112          2HB       GLU 112  10.784   1.051   1.051
  884   2HB   GLU 112          1HB       GLU 112  12.403   1.289   1.289
  885   1HG   GLU 112          2HG       GLU 112  12.091   2.165   2.165
  886   2HG   GLU 112          1HG       GLU 112  11.063   3.022   3.022
  887    H    ILE 113           H        ILE 113  10.626  -1.638  -1.638
  888    HA   ILE 113           HA       ILE 113  12.525  -2.756  -2.756
  889    HB   ILE 113           HB       ILE 113  10.681  -3.582  -3.582
  890   1HG1  ILE 113          2HG1      ILE 113   8.981  -3.007  -3.007
  891   2HG1  ILE 113          1HG1      ILE 113   9.412  -4.597  -4.597
  892   1HG2  ILE 113          2HG2      ILE 113  11.038  -1.064  -1.064
  893   2HG2  ILE 113          1HG2      ILE 113   9.600  -1.016  -1.016
  894   3HG2  ILE 113          3HG2      ILE 113   9.489  -1.628  -1.628
  895   1HD1  ILE 113          3HD1      ILE 113   8.112  -2.963  -2.963
  896   2HD1  ILE 113          2HD1      ILE 113   7.121  -3.184  -3.184
  897   3HD1  ILE 113          1HD1      ILE 113   7.727  -4.589  -4.589
  898    H    GLY 114           H        GLY 114  11.195  -3.552  -3.552
  899   1HA   GLY 114          2HA       GLY 114  11.698  -5.403  -5.403
  900   2HA   GLY 114          1HA       GLY 114  12.445  -6.160  -6.160
  901    H    LEU 115           H        LEU 115   9.205  -4.840  -4.840
  902    HA   LEU 115           HA       LEU 115   8.115  -7.346  -7.346
  903   1HB   LEU 115          2HB       LEU 115   7.458  -4.945  -4.945
  904   2HB   LEU 115          1HB       LEU 115   6.497  -4.941  -4.941
  905    HG   LEU 115           HG       LEU 115   5.158  -6.762  -6.762
  906   1HD1  LEU 115          1HD1      LEU 115   7.332  -7.023  -7.023
  907   2HD1  LEU 115          3HD1      LEU 115   5.695  -7.347  -7.347
  908   3HD1  LEU 115          2HD1      LEU 115   6.354  -8.264  -8.264
  909   1HD2  LEU 115          2HD2      LEU 115   4.905  -4.318  -4.318
  910   2HD2  LEU 115          1HD2      LEU 115   3.940  -5.618  -5.618
  911   3HD2  LEU 115          3HD2      LEU 115   5.375  -5.033  -5.033
  912    H    ALA 116           H        ALA 116   6.765  -5.220  -5.220
  913    HA   ALA 116           HA       ALA 116   5.675  -7.456  -7.456
  914   1HB   ALA 116          1HB       ALA 116   4.715  -5.092  -5.092
  915   2HB   ALA 116          3HB       ALA 116   5.886  -4.668  -4.668
  916   3HB   ALA 116          2HB       ALA 116   4.658  -5.893  -5.893
  917    H    LYS 117           H        LYS 117   6.075  -6.721  -6.721
  918    HA   LYS 117           HA       LYS 117   8.982  -6.953  -6.953
  919   1HB   LYS 117          2HB       LYS 117   6.898  -8.897  -8.897
  920   2HB   LYS 117          1HB       LYS 117   8.026  -8.510  -8.510
  921   1HG   LYS 117          2HG       LYS 117   9.061  -9.214  -9.214
  922   2HG   LYS 117          1HG       LYS 117   8.519 -10.484 -10.484
  923   1HD   LYS 117          2HD       LYS 117  10.724 -10.368 -10.368
  924   2HD   LYS 117          1HD       LYS 117  10.049  -9.175  -9.175
  925   1HE   LYS 117          2HE       LYS 117  10.773  -7.372  -7.372
  926   2HE   LYS 117          1HE       LYS 117  11.122  -8.431  -8.431
  927   1HZ   LYS 117          3HZ       LYS 117  12.909  -9.434  -9.434
  928   2HZ   LYS 117          2HZ       LYS 117  12.593  -8.360  -8.360
  929   3HZ   LYS 117          1HZ       LYS 117  13.152  -7.773  -7.773
  930    H    ASP 118           H        ASP 118   9.791  -5.999  -5.999
  931    HA   ASP 118           HA       ASP 118   8.433  -3.799  -3.799
  932   1HB   ASP 118          2HB       ASP 118  10.160  -3.965  -3.965
  933   2HB   ASP 118          1HB       ASP 118  10.744  -3.709  -3.709
  934    H    ASP 119           H        ASP 119   8.404  -7.113  -7.113
  935    HA   ASP 119           HA       ASP 119   7.099  -6.559  -6.559
  936   1HB   ASP 119          2HB       ASP 119   6.794  -9.039  -9.039
  937   2HB   ASP 119          1HB       ASP 119   8.470  -8.549  -8.549
  938    H    GLN 120           H        GLN 120   6.194  -6.975  -6.975
  939    HA   GLN 120           HA       GLN 120   3.391  -7.434  -7.434
  940   1HB   GLN 120          2HB       GLN 120   4.753  -7.469  -7.469
  941   2HB   GLN 120          1HB       GLN 120   3.076  -7.890  -7.890
  942   1HG   GLN 120          2HG       GLN 120   4.115  -9.642  -9.642
  943   2HG   GLN 120          1HG       GLN 120   5.557  -9.402  -9.402
  944   1HE2  GLN 120          2HE2      GLN 120   3.460 -10.411 -10.411
  945   2HE2  GLN 120          1HE2      GLN 120   4.107  -8.898  -8.898
  946    H    LEU 121           H        LEU 121   5.486  -4.905  -4.905
  947    HA   LEU 121           HA       LEU 121   4.042  -3.206  -3.206
  948   1HB   LEU 121          2HB       LEU 121   5.968  -2.706  -2.706
  949   2HB   LEU 121          1HB       LEU 121   5.191  -1.366  -1.366
  950    HG   LEU 121           HG       LEU 121   6.909  -3.458  -3.458
  951   1HD1  LEU 121          1HD1      LEU 121   7.748  -1.367  -1.367
  952   2HD1  LEU 121          3HD1      LEU 121   7.821  -0.692  -0.692
  953   3HD1  LEU 121          2HD1      LEU 121   8.707  -2.169  -2.169
  954   1HD2  LEU 121          1HD2      LEU 121   5.124  -1.371  -1.371
  955   2HD2  LEU 121          3HD2      LEU 121   5.772  -2.801  -2.801
  956   3HD2  LEU 121          2HD2      LEU 121   6.747  -1.336  -1.336
  957    H    LYS 122           H        LYS 122   1.859  -3.280  -3.280
  958    HA   LYS 122           HA       LYS 122   0.960  -2.151  -2.151
  959   1HB   LYS 122          2HB       LYS 122  -0.072  -4.321  -4.321
  960   2HB   LYS 122          1HB       LYS 122  -1.289  -3.248  -3.248
  961   1HG   LYS 122          2HG       LYS 122   0.808  -4.638  -4.638
  962   2HG   LYS 122          1HG       LYS 122  -0.811  -5.281  -5.281
  963   1HD   LYS 122          2HD       LYS 122  -1.796  -3.776  -3.776
  964   2HD   LYS 122          1HD       LYS 122  -0.648  -2.498  -2.498
  965   1HE   LYS 122          2HE       LYS 122   1.059  -3.668  -3.668
  966   2HE   LYS 122          1HE       LYS 122  -0.164  -4.851  -4.851
  967   1HZ   LYS 122          2HZ       LYS 122  -1.466  -2.793  -2.793
  968   2HZ   LYS 122          1HZ       LYS 122   0.031  -2.006  -2.006
  969   3HZ   LYS 122          3HZ       LYS 122  -0.192  -3.355  -3.355
  970    H    VAL 123           H        VAL 123   1.169   0.014   0.014
  971    HA   VAL 123           HA       VAL 123  -0.531   0.848   0.848
  972    HB   VAL 123           HB       VAL 123   1.797   1.660   1.660
  973   1HG1  VAL 123          1HG1      VAL 123   1.675   1.857   1.857
  974   2HG1  VAL 123          3HG1      VAL 123   1.251   3.522   3.522
  975   3HG1  VAL 123          2HG1      VAL 123   2.777   2.843   2.843
  976   1HG2  VAL 123          3HG2      VAL 123  -0.026   2.966   2.966
  977   2HG2  VAL 123          2HG2      VAL 123   1.304   3.977   3.977
  978   3HG2  VAL 123          1HG2      VAL 123  -0.190   3.883   3.883
  979    H    HIS 124           H        HIS 124  -2.419   1.874   1.874
  980    HA   HIS 124           HA       HIS 124  -2.904   3.108   3.108
  981   1HB   HIS 124          2HB       HIS 124  -4.975   1.437   1.437
  982   2HB   HIS 124          1HB       HIS 124  -5.051   2.092   2.092
  983    HD1  HIS 124           HD1      HIS 124  -4.428   0.514   0.514
  984    HD2  HIS 124           HD2      HIS 124  -2.805  -0.587  -0.587
  985    HE1  HIS 124           HE1      HIS 124  -3.281  -1.685  -1.685
  986    HE2  HIS 124           HE2      HIS 124  -2.456  -2.406  -2.406
  987    H    GLY 125           H        GLY 125  -2.615   5.151   5.151
  988   1HA   GLY 125          2HA       GLY 125  -3.915   6.044   6.044
  989   2HA   GLY 125          1HA       GLY 125  -3.350   7.078   7.078
  990    H    PHE 126           HN       PHE 126  -6.014   6.196   6.196
  991    HA   PHE 126           HA       PHE 126  -8.089   5.803   5.803
  992   1HB   PHE 126          2HB       PHE 126  -9.459   6.292   6.292
  993   2HB   PHE 126          1HB       PHE 126  -7.943   6.215   6.215
  994    HD1  PHE 126           HD1      PHE 126  -6.653   8.485   8.485
  995    HD2  PHE 126           HD2      PHE 126 -10.805   8.137   8.137
  996    HE1  PHE 126           HE1      PHE 126  -7.006  10.790  10.790
  997    HE2  PHE 126           HE2      PHE 126 -11.166  10.441  10.441
  998    HZ   PHE 126           HZ       PHE 126  -9.266  11.769  11.769

  Start of MODEL   11
    1   1H    MET   1          2H        MET   1   4.592 -43.846 -43.846
    2   2H    MET   1          1H        MET   1   5.168 -45.459 -45.459
    3   3H    MET   1          3H        MET   1   5.877 -44.217 -44.217
    4    HA   MET   1           HA       MET   1   4.544 -45.244 -45.244
    5   1HB   MET   1          2HB       MET   1   2.254 -46.003 -46.003
    6   2HB   MET   1          1HB       MET   1   3.492 -46.770 -46.770
    7   1HG   MET   1          2HG       MET   1   2.869 -44.657 -44.657
    8   2HG   MET   1          1HG       MET   1   1.321 -44.947 -44.947
    9   1HE   MET   1          1HE       MET   1   4.309 -46.989 -46.989
   10   2HE   MET   1          3HE       MET   1   3.734 -46.094 -46.094
   11   3HE   MET   1          2HE       MET   1   3.561 -47.849 -47.849
   12    H    ARG   2           H        ARG   2   4.958 -42.954 -42.954
   13    HA   ARG   2           HA       ARG   2   2.606 -41.230 -41.230
   14   1HB   ARG   2          2HB       ARG   2   5.427 -40.742 -40.742
   15   2HB   ARG   2          1HB       ARG   2   4.701 -39.845 -39.845
   16   1HG   ARG   2          2HG       ARG   2   3.168 -39.612 -39.612
   17   2HG   ARG   2          1HG       ARG   2   4.833 -39.057 -39.057
   18   1HD   ARG   2          2HD       ARG   2   4.577 -37.563 -37.563
   19   2HD   ARG   2          1HD       ARG   2   2.945 -38.166 -38.166
   20    HE   ARG   2           HE       ARG   2   3.767 -36.249 -36.249
   21   1HH1  ARG   2          2HH1      ARG   2   1.340 -38.599 -38.599
   22   2HH1  ARG   2          1HH1      ARG   2   0.103 -37.866 -37.866
   23   1HH2  ARG   2          1HH2      ARG   2   2.140 -35.285 -35.285
   24   2HH2  ARG   2          2HH2      ARG   2   0.556 -35.985 -35.985
   25    H    GLY   3           H        GLY   3   1.306 -40.757 -40.757
   26   1HA   GLY   3          2HA       GLY   3   2.032 -41.855 -41.855
   27   2HA   GLY   3          1HA       GLY   3   0.397 -41.515 -41.515
   28    H    SER   4           H        SER   4   0.878 -38.903 -38.903
   29    HA   SER   4           HA       SER   4   1.261 -37.471 -37.471
   30   1HB   SER   4          2HB       SER   4  -0.223 -35.771 -35.771
   31   2HB   SER   4          1HB       SER   4  -0.995 -37.334 -37.334
   32    HG   SER   4           HG       SER   4  -0.992 -36.918 -36.918
   33    H    HIS   5           H        HIS   5   3.239 -36.632 -36.632
   34    HA   HIS   5           HA       HIS   5   4.183 -34.927 -34.927
   35   1HB   HIS   5          2HB       HIS   5   6.504 -35.973 -35.973
   36   2HB   HIS   5          1HB       HIS   5   5.304 -36.904 -36.904
   37    HD1  HIS   5           HD1      HIS   5   7.864 -37.489 -37.489
   38    HD2  HIS   5           HD2      HIS   5   3.890 -38.693 -38.693
   39    HE1  HIS   5           HE1      HIS   5   7.728 -39.530 -39.530
   40    HE2  HIS   5           HE2      HIS   5   5.332 -40.289 -40.289
   41    H    HIS   6           H        HIS   6   3.142 -34.328 -34.328
   42    HA   HIS   6           HA       HIS   6   5.415 -33.655 -33.655
   43   1HB   HIS   6          2HB       HIS   6   3.107 -34.427 -34.427
   44   2HB   HIS   6          1HB       HIS   6   2.569 -32.789 -32.789
   45    HD1  HIS   6           HD1      HIS   6   5.971 -33.424 -33.424
   46    HD2  HIS   6           HD2      HIS   6   2.226 -32.129 -32.129
   47    HE1  HIS   6           HE1      HIS   6   6.314 -32.514 -32.514
   48    HE2  HIS   6           HE2      HIS   6   4.019 -31.814 -31.814
   49    H    HIS   7           H        HIS   7   3.034 -32.021 -32.021
   50    HA   HIS   7           HA       HIS   7   4.660 -29.572 -29.572
   51   1HB   HIS   7          2HB       HIS   7   1.661 -29.869 -29.869
   52   2HB   HIS   7          1HB       HIS   7   2.459 -28.357 -28.357
   53    HD1  HIS   7           HD1      HIS   7   2.485 -30.800 -30.800
   54    HD2  HIS   7           HD2      HIS   7   2.733 -26.728 -26.728
   55    HE1  HIS   7           HE1      HIS   7   2.598 -29.685 -29.685
   56    HE2  HIS   7           HE2      HIS   7   2.660 -27.216 -27.216
   57    H    HIS   8           H        HIS   8   5.696 -29.299 -29.299
   58    HA   HIS   8           HA       HIS   8   4.711 -30.414 -30.414
   59   1HB   HIS   8          2HB       HIS   8   7.214 -29.863 -29.863
   60   2HB   HIS   8          1HB       HIS   8   6.961 -28.524 -28.524
   61    HD1  HIS   8           HD1      HIS   8   5.135 -30.666 -30.666
   62    HD2  HIS   8           HD2      HIS   8   9.157 -30.800 -30.800
   63    HE1  HIS   8           HE1      HIS   8   6.226 -32.128 -32.128
   64    HE2  HIS   8           HE2      HIS   8   8.674 -32.123 -32.123
   65    H    HIS   9           H        HIS   9   4.975 -27.223 -27.223
   66    HA   HIS   9           HA       HIS   9   4.030 -25.904 -25.904
   67   1HB   HIS   9          2HB       HIS   9   5.552 -25.099 -25.099
   68   2HB   HIS   9          1HB       HIS   9   4.010 -24.285 -24.285
   69    HD1  HIS   9           HD1      HIS   9   6.637 -22.765 -22.765
   70    HD2  HIS   9           HD2      HIS   9   3.729 -23.931 -23.931
   71    HE1  HIS   9           HE1      HIS   9   6.907 -21.223 -21.223
   72    HE2  HIS   9           HE2      HIS   9   5.195 -22.006 -22.006
   73    H    HIS  10           H        HIS  10   1.959 -26.575 -26.575
   74    HA   HIS  10           HA       HIS  10  -0.310 -26.599 -26.599
   75   1HB   HIS  10          2HB       HIS  10   0.404 -24.158 -24.158
   76   2HB   HIS  10          1HB       HIS  10  -0.448 -24.799 -24.799
   77    HD1  HIS  10           HD1      HIS  10  -2.298 -22.980 -22.980
   78    HD2  HIS  10           HD2      HIS  10  -1.893 -25.822 -25.822
   79    HE1  HIS  10           HE1      HIS  10  -4.367 -22.765 -22.765
   80    HE2  HIS  10           HE2      HIS  10  -4.140 -24.553 -24.553
   81    H    THR  11           H        THR  11  -1.516 -28.184 -28.184
   82    HA   THR  11           HA       THR  11  -1.010 -29.057 -29.057
   83    HB   THR  11           HB       THR  11  -2.321 -31.149 -31.149
   84    HG1  THR  11           HG1      THR  11  -1.990 -30.719 -30.719
   85   1HG2  THR  11          2HG2      THR  11  -0.387 -31.305 -31.305
   86   2HG2  THR  11          1HG2      THR  11   0.663 -30.859 -30.859
   87   3HG2  THR  11          3HG2      THR  11  -0.272 -32.352 -32.352
   88    H    ASP  12           H        ASP  12  -2.546 -27.763 -27.763
   89    HA   ASP  12           HA       ASP  12  -5.278 -28.708 -28.708
   90   1HB   ASP  12          2HB       ASP  12  -6.138 -26.327 -26.327
   91   2HB   ASP  12          1HB       ASP  12  -5.387 -26.906 -26.906
   92    HA   PRO  13           HA       PRO  13  -3.602 -27.838 -27.838
   93   1HB   PRO  13          2HB       PRO  13  -5.002 -30.433 -30.433
   94   2HB   PRO  13          1HB       PRO  13  -3.437 -29.897 -29.897
   95   1HG   PRO  13          2HG       PRO  13  -3.583 -31.650 -31.650
   96   2HG   PRO  13          1HG       PRO  13  -2.334 -30.390 -30.390
   97   1HD   PRO  13          2HD       PRO  13  -4.853 -30.534 -30.534
   98   2HD   PRO  13          1HD       PRO  13  -3.254 -29.920 -29.920
   99    H    MET  14           H        MET  14  -6.652 -28.626 -28.626
  100    HA   MET  14           HA       MET  14  -8.129 -27.756 -27.756
  101   1HB   MET  14          2HB       MET  14  -9.010 -29.016 -29.016
  102   2HB   MET  14          1HB       MET  14 -10.138 -28.428 -28.428
  103   1HG   MET  14          2HG       MET  14  -8.637 -29.988 -29.988
  104   2HG   MET  14          1HG       MET  14  -8.402 -30.818 -30.818
  105   1HE   MET  14          1HE       MET  14  -9.157 -32.466 -32.466
  106   2HE   MET  14          3HE       MET  14 -10.217 -33.302 -33.302
  107   3HE   MET  14          2HE       MET  14 -10.834 -32.793 -32.793
  108    H    SER  15           H        SER  15  -6.543 -25.877 -25.877
  109    HA   SER  15           HA       SER  15  -8.654 -24.162 -24.162
  110   1HB   SER  15          2HB       SER  15  -6.903 -24.645 -24.645
  111   2HB   SER  15          1HB       SER  15  -5.663 -24.135 -24.135
  112    HG   SER  15           HG       SER  15  -7.709 -22.465 -22.465
  113    H    ALA  16           H        ALA  16  -8.139 -24.475 -24.475
  114    HA   ALA  16           HA       ALA  16  -7.931 -21.699 -21.699
  115   1HB   ALA  16          2HB       ALA  16  -5.557 -22.299 -22.299
  116   2HB   ALA  16          1HB       ALA  16  -5.820 -23.592 -23.592
  117   3HB   ALA  16          3HB       ALA  16  -6.037 -21.908 -21.908
  118    H    ILE  17           H        ILE  17  -9.842 -23.889 -23.889
  119    HA   ILE  17           HA       ILE  17  -9.970 -24.345 -24.345
  120    HB   ILE  17           HB       ILE  17 -11.789 -25.523 -25.523
  121   1HG1  ILE  17          2HG1      ILE  17  -9.254 -26.715 -26.715
  122   2HG1  ILE  17          1HG1      ILE  17  -9.434 -26.101 -26.101
  123   1HG2  ILE  17          3HG2      ILE  17 -11.185 -26.188 -26.188
  124   2HG2  ILE  17          2HG2      ILE  17 -12.028 -27.293 -27.293
  125   3HG2  ILE  17          1HG2      ILE  17 -12.730 -25.720 -25.720
  126   1HD1  ILE  17          3HD1      ILE  17 -11.495 -28.003 -28.003
  127   2HD1  ILE  17          2HD1      ILE  17  -9.928 -28.695 -28.695
  128   3HD1  ILE  17          1HD1      ILE  17 -10.206 -28.055 -28.055
  129    H    GLN  18           H        GLN  18 -12.046 -24.088 -24.088
  130    HA   GLN  18           HA       GLN  18 -13.194 -21.538 -21.538
  131   1HB   GLN  18          2HB       GLN  18 -12.911 -22.727 -22.727
  132   2HB   GLN  18          1HB       GLN  18 -14.369 -23.613 -23.613
  133   1HG   GLN  18          2HG       GLN  18 -15.391 -21.268 -21.268
  134   2HG   GLN  18          1HG       GLN  18 -14.031 -20.708 -20.708
  135   1HE2  GLN  18          2HE2      GLN  18 -16.953 -21.350 -21.350
  136   2HE2  GLN  18          1HE2      GLN  18 -16.656 -20.374 -20.374
  137    H    ASN  19           H        ASN  19 -14.304 -21.395 -21.395
  138    HA   ASN  19           HA       ASN  19 -16.471 -23.332 -23.332
  139   1HB   ASN  19          2HB       ASN  19 -14.830 -21.646 -21.646
  140   2HB   ASN  19          1HB       ASN  19 -16.392 -22.288 -22.288
  141   1HD2  ASN  19          1HD2      ASN  19 -13.108 -22.886 -22.886
  142   2HD2  ASN  19          2HD2      ASN  19 -13.128 -24.582 -24.582
  143    H    LEU  20           H        LEU  20 -18.109 -22.429 -22.429
  144    HA   LEU  20           HA       LEU  20 -19.925 -21.111 -21.111
  145   1HB   LEU  20          2HB       LEU  20 -19.575 -20.919 -20.919
  146   2HB   LEU  20          1HB       LEU  20 -19.370 -19.238 -19.238
  147    HG   LEU  20           HG       LEU  20 -21.617 -19.599 -19.599
  148   1HD1  LEU  20          2HD1      LEU  20 -21.379 -22.133 -22.133
  149   2HD1  LEU  20          1HD1      LEU  20 -22.261 -21.492 -21.492
  150   3HD1  LEU  20          3HD1      LEU  20 -22.941 -21.351 -21.351
  151   1HD2  LEU  20          2HD2      LEU  20 -21.237 -19.215 -19.215
  152   2HD2  LEU  20          1HD2      LEU  20 -21.581 -18.012 -18.012
  153   3HD2  LEU  20          3HD2      LEU  20 -22.837 -19.141 -19.141
  154    H    HIS  21           H        HIS  21 -17.624 -18.788 -18.788
  155    HA   HIS  21           HA       HIS  21 -18.020 -17.027 -17.027
  156   1HB   HIS  21          2HB       HIS  21 -17.590 -16.575 -16.575
  157   2HB   HIS  21          1HB       HIS  21 -16.033 -16.183 -16.183
  158    HD1  HIS  21           HD1      HIS  21 -15.898 -14.074 -14.074
  159    HD2  HIS  21           HD2      HIS  21 -19.728 -14.889 -14.889
  160    HE1  HIS  21           HE1      HIS  21 -17.244 -12.008 -12.008
  161    HE2  HIS  21           HE2      HIS  21 -19.577 -12.553 -12.553
  162    H    SER  22           H        SER  22 -16.553 -16.609 -16.609
  163    HA   SER  22           HA       SER  22 -14.236 -18.357 -18.357
  164   1HB   SER  22          2HB       SER  22 -15.996 -17.602 -17.602
  165   2HB   SER  22          1HB       SER  22 -14.738 -16.393 -16.393
  166    HG   SER  22           HG       SER  22 -14.471 -19.215 -19.215
  167    H    PHE  23           H        PHE  23 -14.981 -15.017 -15.017
  168    HA   PHE  23           HA       PHE  23 -13.698 -13.244 -13.244
  169   1HB   PHE  23          2HB       PHE  23 -12.421 -15.466 -15.466
  170   2HB   PHE  23          1HB       PHE  23 -11.133 -14.587 -14.587
  171    HD1  PHE  23           HD1      PHE  23 -11.918 -11.808 -11.808
  172    HD2  PHE  23           HD2      PHE  23 -12.134 -15.086 -15.086
  173    HE1  PHE  23           HE1      PHE  23 -11.781 -10.247 -10.247
  174    HE2  PHE  23           HE2      PHE  23 -11.999 -13.530 -13.530
  175    HZ   PHE  23           HZ       PHE  23 -11.823 -11.108 -11.108
  176    H    ASP  24           H        ASP  24 -13.008 -11.724 -11.724
  177    HA   ASP  24           HA       ASP  24 -12.030 -10.676 -10.676
  178   1HB   ASP  24          2HB       ASP  24 -10.050 -12.866 -12.866
  179   2HB   ASP  24          1HB       ASP  24  -9.818 -11.776 -11.776
  180    HA   PRO  25           HA       PRO  25 -14.355 -13.255 -13.255
  181   1HB   PRO  25          2HB       PRO  25 -14.258 -10.614 -10.614
  182   2HB   PRO  25          1HB       PRO  25 -15.626 -11.705 -11.705
  183   1HG   PRO  25          2HG       PRO  25 -15.374  -9.474  -9.474
  184   2HG   PRO  25          1HG       PRO  25 -15.995 -10.969 -10.969
  185   1HD   PRO  25          2HD       PRO  25 -13.313  -9.695  -9.695
  186   2HD   PRO  25          1HD       PRO  25 -14.263 -10.605 -10.605
  187    H    PHE  26           H        PHE  26 -11.634 -11.078 -11.078
  188    HA   PHE  26           HA       PHE  26 -10.707 -12.817 -12.817
  189   1HB   PHE  26          2HB       PHE  26  -9.570 -10.729 -10.729
  190   2HB   PHE  26          1HB       PHE  26 -11.321 -10.802 -10.802
  191    HD1  PHE  26           HD1      PHE  26 -12.731  -9.569  -9.569
  192    HD2  PHE  26           HD2      PHE  26  -8.554  -8.925  -8.925
  193    HE1  PHE  26           HE1      PHE  26 -12.934  -7.397  -7.397
  194    HE2  PHE  26           HE2      PHE  26  -8.749  -6.753  -6.753
  195    HZ   PHE  26           HZ       PHE  26 -10.942  -5.986  -5.986
  196    H    ALA  27           H        ALA  27  -9.713 -10.484 -10.484
  197    HA   ALA  27           HA       ALA  27  -7.875 -10.364 -10.364
  198   1HB   ALA  27          2HB       ALA  27  -8.594 -13.020 -13.020
  199   2HB   ALA  27          1HB       ALA  27  -6.875 -13.065 -13.065
  200   3HB   ALA  27          3HB       ALA  27  -7.422 -12.279 -12.279
  201    H    ASP  28           H        ASP  28  -6.212  -9.187  -9.187
  202    HA   ASP  28           HA       ASP  28  -4.719 -10.018 -10.018
  203   1HB   ASP  28          2HB       ASP  28  -3.814  -7.696  -7.696
  204   2HB   ASP  28          1HB       ASP  28  -5.568  -7.755  -7.755
  205    H    ALA  29           H        ALA  29  -2.307  -9.036  -9.036
  206    HA   ALA  29           HA       ALA  29  -1.066  -9.346  -9.346
  207   1HB   ALA  29          3HB       ALA  29  -1.188 -11.691 -11.691
  208   2HB   ALA  29          2HB       ALA  29   0.316 -11.392 -11.392
  209   3HB   ALA  29          1HB       ALA  29  -1.189 -11.623 -11.623
  210    H    SER  30           H        SER  30   0.091  -7.521  -7.521
  211    HA   SER  30           HA       SER  30   2.191  -7.742  -7.742
  212   1HB   SER  30          2HB       SER  30   1.807  -5.249  -5.249
  213   2HB   SER  30          1HB       SER  30   0.658  -6.392  -6.392
  214    HG   SER  30           HG       SER  30  -0.102  -4.397  -4.397
  215    H    LYS  31           H        LYS  31   0.927  -5.630  -5.630
  216    HA   LYS  31           HA       LYS  31   3.405  -4.489  -4.489
  217   1HB   LYS  31          2HB       LYS  31   0.740  -4.229  -4.229
  218   2HB   LYS  31          1HB       LYS  31   1.629  -4.687  -4.687
  219   1HG   LYS  31          2HG       LYS  31   1.883  -2.445  -2.445
  220   2HG   LYS  31          1HG       LYS  31   3.275  -2.801  -2.801
  221   1HD   LYS  31          2HD       LYS  31   2.361  -1.801  -1.801
  222   2HD   LYS  31          1HD       LYS  31   0.736  -2.373  -2.373
  223   1HE   LYS  31          2HE       LYS  31   0.298  -0.592  -0.592
  224   2HE   LYS  31          1HE       LYS  31   2.006  -0.265  -0.265
  225   1HZ   LYS  31          2HZ       LYS  31   1.937   0.252   0.252
  226   2HZ   LYS  31          1HZ       LYS  31   0.304   0.552   0.552
  227   3HZ   LYS  31          3HZ       LYS  31   1.502   1.422   1.422
  228    H    GLY  32           H        GLY  32   1.568  -7.052  -7.052
  229   1HA   GLY  32          2HA       GLY  32   2.322  -8.892  -8.892
  230   2HA   GLY  32          1HA       GLY  32   3.929  -8.570  -8.570
  231    H    ASP  33           H        ASP  33   2.310  -6.018  -6.018
  232    HA   ASP  33           HA       ASP  33   3.940  -6.552  -6.552
  233   1HB   ASP  33          2HB       ASP  33   4.505  -4.548  -4.548
  234   2HB   ASP  33          1HB       ASP  33   3.287  -3.737  -3.737
  235    H    ASP  34           H        ASP  34   1.239  -7.357  -7.357
  236    HA   ASP  34           HA       ASP  34  -0.429  -5.466  -5.466
  237   1HB   ASP  34          2HB       ASP  34  -1.237  -6.989  -6.989
  238   2HB   ASP  34          1HB       ASP  34  -1.119  -8.316  -8.316
  239    H    LEU  35           H        LEU  35   1.494  -5.805  -5.805
  240    HA   LEU  35           HA       LEU  35   0.523  -7.789  -7.789
  241   1HB   LEU  35          2HB       LEU  35   3.290  -6.888  -6.888
  242   2HB   LEU  35          1HB       LEU  35   2.947  -7.447  -7.447
  243    HG   LEU  35           HG       LEU  35   3.889  -9.211  -9.211
  244   1HD1  LEU  35          2HD1      LEU  35   2.435  -9.763  -9.763
  245   2HD1  LEU  35          1HD1      LEU  35   1.039  -9.736  -9.736
  246   3HD1  LEU  35          3HD1      LEU  35   2.308 -10.939 -10.939
  247   1HD2  LEU  35          2HD2      LEU  35   2.590  -8.253  -8.253
  248   2HD2  LEU  35          1HD2      LEU  35   2.860  -9.991  -9.991
  249   3HD2  LEU  35          3HD2      LEU  35   1.293  -9.309  -9.309
  250    H    LEU  36           H        LEU  36  -0.310  -6.978  -6.978
  251    HA   LEU  36           HA       LEU  36   0.295  -4.178  -4.178
  252   1HB   LEU  36          2HB       LEU  36  -2.150  -5.868  -5.868
  253   2HB   LEU  36          1HB       LEU  36  -1.883  -4.378  -4.378
  254    HG   LEU  36           HG       LEU  36  -1.856  -4.410  -4.410
  255   1HD1  LEU  36          2HD1      LEU  36  -4.238  -4.295  -4.295
  256   2HD1  LEU  36          1HD1      LEU  36  -4.261  -3.666  -3.666
  257   3HD1  LEU  36          3HD1      LEU  36  -3.958  -5.380  -5.380
  258   1HD2  LEU  36          1HD2      LEU  36  -0.992  -2.447  -2.447
  259   2HD2  LEU  36          3HD2      LEU  36  -2.382  -2.082  -2.082
  260   3HD2  LEU  36          2HD2      LEU  36  -2.590  -2.258  -2.258
  261    HA   PRO  37           HA       PRO  37   2.303  -5.871  -5.871
  262   1HB   PRO  37          2HB       PRO  37   2.823  -3.531  -3.531
  263   2HB   PRO  37          1HB       PRO  37   3.737  -4.075  -4.075
  264   1HG   PRO  37          2HG       PRO  37   1.486  -2.107  -2.107
  265   2HG   PRO  37          1HG       PRO  37   3.001  -2.006  -2.006
  266   1HD   PRO  37          2HD       PRO  37   0.642  -2.731  -2.731
  267   2HD   PRO  37          1HD       PRO  37   2.208  -3.341  -3.341
  268    H    ALA  38           H        ALA  38   2.182  -4.888  -4.888
  269    HA   ALA  38           HA       ALA  38   0.935  -4.785  -4.785
  270   1HB   ALA  38          2HB       ALA  38  -0.224  -2.956  -2.956
  271   2HB   ALA  38          1HB       ALA  38  -1.564  -4.101  -4.101
  272   3HB   ALA  38          3HB       ALA  38  -0.900  -3.430  -3.430
  273    H    GLY  39           H        GLY  39   0.728  -6.788  -6.788
  274   1HA   GLY  39          2HA       GLY  39  -1.538  -8.400  -8.400
  275   2HA   GLY  39          1HA       GLY  39   0.036  -9.130  -9.130
  276    H    THR  40           H        THR  40  -0.440 -10.510 -10.510
  277    HA   THR  40           HA       THR  40  -0.889  -9.358  -9.358
  278    HB   THR  40           HB       THR  40  -2.774 -11.003 -11.003
  279    HG1  THR  40           HG1      THR  40  -2.942 -12.336 -12.336
  280   1HG2  THR  40          2HG2      THR  40  -3.003  -8.473  -8.473
  281   2HG2  THR  40          1HG2      THR  40  -3.715  -9.093  -9.093
  282   3HG2  THR  40          3HG2      THR  40  -4.427  -9.513  -9.513
  283    H    GLU  41           H        GLU  41   0.887 -10.196 -10.196
  284    HA   GLU  41           HA       GLU  41   1.153 -13.116 -13.116
  285   1HB   GLU  41          2HB       GLU  41   3.504 -11.232 -11.232
  286   2HB   GLU  41          1HB       GLU  41   3.541 -12.985 -12.985
  287   1HG   GLU  41          2HG       GLU  41   1.889 -12.323 -12.323
  288   2HG   GLU  41          1HG       GLU  41   3.059 -11.003 -11.003
  289    H    ASP  42           H        ASP  42  -0.191 -12.229 -12.229
  290    HA   ASP  42           HA       ASP  42  -0.340 -12.085 -12.085
  291   1HB   ASP  42          2HB       ASP  42   2.295 -13.435 -13.435
  292   2HB   ASP  42          1HB       ASP  42   1.885 -12.872 -12.872
  293    H    TYR  43           H        TYR  43  -0.130  -9.728  -9.728
  294    HA   TYR  43           HA       TYR  43   2.169  -8.304  -8.304
  295   1HB   TYR  43          2HB       TYR  43  -0.285  -7.252  -7.252
  296   2HB   TYR  43          1HB       TYR  43   1.167  -6.330  -6.330
  297    HD1  TYR  43           HD1      TYR  43   3.015  -8.807  -8.807
  298    HD2  TYR  43           HD2      TYR  43  -0.115  -6.725  -6.725
  299    HE1  TYR  43           HE1      TYR  43   3.982  -9.440  -9.440
  300    HE2  TYR  43           HE2      TYR  43   0.841  -7.360  -7.360
  301    HH   TYR  43           HH       TYR  43   3.478  -8.044  -8.044
  302    H    ILE  44           H        ILE  44   1.632  -6.169  -6.169
  303    HA   ILE  44           HA       ILE  44  -0.304  -6.767  -6.767
  304    HB   ILE  44           HB       ILE  44   2.130  -4.980  -4.980
  305   1HG1  ILE  44          2HG1      ILE  44   2.849  -7.244  -7.244
  306   2HG1  ILE  44          1HG1      ILE  44   2.857  -6.661  -6.661
  307   1HG2  ILE  44          3HG2      ILE  44   0.103  -5.609  -5.609
  308   2HG2  ILE  44          2HG2      ILE  44   1.630  -4.773  -4.773
  309   3HG2  ILE  44          1HG2      ILE  44   0.397  -4.042  -4.042
  310   1HD1  ILE  44          2HD1      ILE  44   0.635  -7.739  -7.739
  311   2HD1  ILE  44          1HD1      ILE  44   0.820  -8.449  -8.449
  312   3HD1  ILE  44          3HD1      ILE  44   1.958  -8.861  -8.861
  313    H    HIS  45           H        HIS  45  -2.152  -5.868  -5.868
  314    HA   HIS  45           HA       HIS  45  -2.275  -3.365  -3.365
  315   1HB   HIS  45          2HB       HIS  45  -4.032  -5.514  -5.514
  316   2HB   HIS  45          1HB       HIS  45  -4.795  -4.047  -4.047
  317    HD1  HIS  45           HD1      HIS  45  -3.695  -5.722  -5.722
  318    HD2  HIS  45           HD2      HIS  45  -5.591  -2.224  -2.224
  319    HE1  HIS  45           HE1      HIS  45  -4.652  -4.729  -4.729
  320    HE2  HIS  45           HE2      HIS  45  -5.728  -2.571  -2.571
  321    H    ILE  46           H        ILE  46  -1.991  -1.453  -1.453
  322    HA   ILE  46           HA       ILE  46  -2.162  -1.013  -1.013
  323    HB   ILE  46           HB       ILE  46  -1.827   0.996   0.996
  324   1HG1  ILE  46          2HG1      ILE  46  -0.036  -0.734  -0.734
  325   2HG1  ILE  46          1HG1      ILE  46   0.537   0.901   0.901
  326   1HG2  ILE  46          1HG2      ILE  46  -1.768   1.242   1.242
  327   2HG2  ILE  46          3HG2      ILE  46  -0.757   2.295   2.295
  328   3HG2  ILE  46          2HG2      ILE  46  -2.509   2.301   2.301
  329   1HD1  ILE  46          2HD1      ILE  46   0.131   0.266   0.266
  330   2HD1  ILE  46          1HD1      ILE  46   0.218  -1.386  -1.386
  331   3HD1  ILE  46          3HD1      ILE  46   1.582  -0.288  -0.288
  332    H    ARG  47           H        ARG  47  -3.596   1.425   1.425
  333    HA   ARG  47           HA       ARG  47  -5.760   2.088   2.088
  334   1HB   ARG  47          2HB       ARG  47  -6.260  -0.464  -0.464
  335   2HB   ARG  47          1HB       ARG  47  -6.891   0.203   0.203
  336   1HG   ARG  47          2HG       ARG  47  -8.720   0.040   0.040
  337   2HG   ARG  47          1HG       ARG  47  -8.290   1.751   1.751
  338   1HD   ARG  47          2HD       ARG  47  -7.038   1.493   1.493
  339   2HD   ARG  47          1HD       ARG  47  -7.495  -0.209  -0.209
  340    HE   ARG  47           HE       ARG  47  -9.815   1.369   1.369
  341   1HH1  ARG  47          2HH1      ARG  47  -7.268   0.591   0.591
  342   2HH1  ARG  47          1HH1      ARG  47  -8.253   0.865   0.865
  343   1HH2  ARG  47          1HH2      ARG  47 -11.111   1.730   1.730
  344   2HH2  ARG  47          2HH2      ARG  47 -10.433   1.512   1.512
  345    H    ILE  48           H        ILE  48  -6.284   3.956   3.956
  346    HA   ILE  48           HA       ILE  48  -6.105   4.407   4.407
  347    HB   ILE  48           HB       ILE  48  -5.683   6.226   6.226
  348   1HG1  ILE  48          2HG1      ILE  48  -4.164   5.725   5.725
  349   2HG1  ILE  48          1HG1      ILE  48  -3.727   5.149   5.149
  350   1HG2  ILE  48          2HG2      ILE  48  -6.360   7.133   7.133
  351   2HG2  ILE  48          1HG2      ILE  48  -5.708   8.168   8.168
  352   3HG2  ILE  48          3HG2      ILE  48  -7.297   7.428   7.428
  353   1HD1  ILE  48          1HD1      ILE  48  -4.008   8.076   8.076
  354   2HD1  ILE  48          3HD1      ILE  48  -2.546   7.225   7.225
  355   3HD1  ILE  48          2HD1      ILE  48  -3.032   7.228   7.228
  356    H    GLN  49           H        GLN  49  -7.732   5.788   5.788
  357    HA   GLN  49           HA       GLN  49 -10.239   5.992   5.992
  358   1HB   GLN  49          2HB       GLN  49 -11.521   5.183   5.183
  359   2HB   GLN  49          1HB       GLN  49 -10.381   3.962   3.962
  360   1HG   GLN  49          2HG       GLN  49  -8.885   5.152   5.152
  361   2HG   GLN  49          1HG       GLN  49 -10.487   5.465   5.465
  362   1HE2  GLN  49          2HE2      GLN  49 -11.232   2.013   2.013
  363   2HE2  GLN  49          1HE2      GLN  49 -11.946   3.500   3.500
  364    H    GLN  50           H        GLN  50 -10.293   8.167   8.167
  365    HA   GLN  50           HA       GLN  50  -9.851   9.786   9.786
  366   1HB   GLN  50          2HB       GLN  50  -8.976  10.121  10.121
  367   2HB   GLN  50          1HB       GLN  50 -10.354  11.212  11.212
  368   1HG   GLN  50          2HG       GLN  50  -9.397  12.423  12.423
  369   2HG   GLN  50          1HG       GLN  50  -8.132  11.216  11.216
  370   1HE2  GLN  50          2HE2      GLN  50  -6.184  13.561  13.561
  371   2HE2  GLN  50          1HE2      GLN  50  -6.626  12.947  12.947
  372    H    ARG  51           H        ARG  51 -11.571  10.306  10.306
  373    HA   ARG  51           HA       ARG  51 -14.185  10.482  10.482
  374   1HB   ARG  51          2HB       ARG  51 -13.334  10.061  10.061
  375   2HB   ARG  51          1HB       ARG  51 -14.971  10.574  10.574
  376   1HG   ARG  51          2HG       ARG  51 -15.573   8.514   8.514
  377   2HG   ARG  51          1HG       ARG  51 -14.172   8.317   8.317
  378   1HD   ARG  51          2HD       ARG  51 -14.161   6.649   6.649
  379   2HD   ARG  51          1HD       ARG  51 -12.794   7.750   7.750
  380    HE   ARG  51           HE       ARG  51 -13.639   8.417   8.417
  381   1HH1  ARG  51          2HH1      ARG  51 -16.178   6.837   6.837
  382   2HH1  ARG  51          1HH1      ARG  51 -17.301   6.867   6.867
  383   1HH2  ARG  51          1HH2      ARG  51 -15.115   8.456   8.456
  384   2HH2  ARG  51          2HH2      ARG  51 -16.699   7.787   7.787
  385    H    ASN  52           H        ASN  52 -15.354  12.340  12.340
  386    HA   ASN  52           HA       ASN  52 -15.793  14.571  14.571
  387   1HB   ASN  52          2HB       ASN  52 -14.181  14.722  14.722
  388   2HB   ASN  52          1HB       ASN  52 -15.542  15.728  15.728
  389   1HD2  ASN  52          2HD2      ASN  52 -16.335  12.872  12.872
  390   2HD2  ASN  52          1HD2      ASN  52 -14.913  13.844  13.844
  391    H    GLY  53           H        GLY  53 -13.187  13.474  13.474
  392   1HA   GLY  53          2HA       GLY  53 -11.367  14.327  14.327
  393   2HA   GLY  53          1HA       GLY  53 -12.117  15.906  15.906
  394    H    ARG  54           H        ARG  54 -10.874  13.616  13.616
  395    HA   ARG  54           HA       ARG  54  -8.507  15.026  15.026
  396   1HB   ARG  54          2HB       ARG  54  -9.019  16.237  16.237
  397   2HB   ARG  54          1HB       ARG  54 -10.187  16.726  16.726
  398   1HG   ARG  54          2HG       ARG  54 -11.878  15.320  15.320
  399   2HG   ARG  54          1HG       ARG  54 -10.710  14.703  14.703
  400   1HD   ARG  54          2HD       ARG  54 -11.250  17.640  17.640
  401   2HD   ARG  54          1HD       ARG  54 -12.330  16.596  16.596
  402    HE   ARG  54           HE       ARG  54  -9.745  16.057  16.057
  403   1HH1  ARG  54          2HH1      ARG  54 -11.951  18.761  18.761
  404   2HH1  ARG  54          1HH1      ARG  54 -11.296  19.462  19.462
  405   1HH2  ARG  54          1HH2      ARG  54  -8.883  16.977  16.977
  406   2HH2  ARG  54          2HH2      ARG  54  -9.555  18.450  18.450
  407    H    LYS  55           H        LYS  55 -11.103  13.095  13.095
  408    HA   LYS  55           HA       LYS  55  -9.429  11.826  11.826
  409   1HB   LYS  55          2HB       LYS  55 -12.212  11.695  11.695
  410   2HB   LYS  55          1HB       LYS  55 -11.568  10.100  10.100
  411   1HG   LYS  55          2HG       LYS  55 -11.443  12.468  12.468
  412   2HG   LYS  55          1HG       LYS  55 -12.634  11.169  11.169
  413   1HD   LYS  55          2HD       LYS  55 -11.211  10.099  10.099
  414   2HD   LYS  55          1HD       LYS  55 -10.194   9.850   9.850
  415   1HE   LYS  55          2HE       LYS  55  -8.634  10.928  10.928
  416   2HE   LYS  55          1HE       LYS  55  -9.503  12.380  12.380
  417   1HZ   LYS  55          2HZ       LYS  55 -10.521  11.058  11.058
  418   2HZ   LYS  55          1HZ       LYS  55  -8.989  11.755  11.755
  419   3HZ   LYS  55          3HZ       LYS  55 -10.305  12.706  12.706
  420    H    THR  56           H        THR  56  -7.703  11.455  11.455
  421    HA   THR  56           HA       THR  56  -8.106   9.252   9.252
  422    HB   THR  56           HB       THR  56  -5.339  10.023  10.023
  423    HG1  THR  56           HG1      THR  56  -5.840  12.061  12.061
  424   1HG2  THR  56          3HG2      THR  56  -6.990   9.412   9.412
  425   2HG2  THR  56          2HG2      THR  56  -5.819  10.706  10.706
  426   3HG2  THR  56          1HG2      THR  56  -5.275   9.119   9.119
  427    H    LEU  57           H        LEU  57  -7.456   7.167   7.167
  428    HA   LEU  57           HA       LEU  57  -5.902   6.387   6.387
  429   1HB   LEU  57          2HB       LEU  57  -8.755   5.992   5.992
  430   2HB   LEU  57          1HB       LEU  57  -7.922   4.453   4.453
  431    HG   LEU  57           HG       LEU  57  -6.757   5.437   5.437
  432   1HD1  LEU  57          2HD1      LEU  57  -8.669   7.576   7.576
  433   2HD1  LEU  57          1HD1      LEU  57  -8.566   7.130   7.130
  434   3HD1  LEU  57          3HD1      LEU  57  -7.120   7.657   7.657
  435   1HD2  LEU  57          3HD2      LEU  57  -9.443   4.349   4.349
  436   2HD2  LEU  57          2HD2      LEU  57  -8.161   3.891   3.891
  437   3HD2  LEU  57          1HD2      LEU  57  -9.229   5.242   5.242
  438    H    THR  58           H        THR  58  -4.237   5.620   5.620
  439    HA   THR  58           HA       THR  58  -4.591   4.072   4.072
  440    HB   THR  58           HB       THR  58  -2.067   3.964   3.964
  441    HG1  THR  58           HG1      THR  58  -3.263   6.260   6.260
  442   1HG2  THR  58          1HG2      THR  58  -2.763   4.081   4.081
  443   2HG2  THR  58          3HG2      THR  58  -1.152   4.508   4.508
  444   3HG2  THR  58          2HG2      THR  58  -1.792   2.893   2.893
  445    H    THR  59           H        THR  59  -4.974   1.962   1.962
  446    HA   THR  59           HA       THR  59  -4.668   0.258   0.258
  447    HB   THR  59           HB       THR  59  -6.199  -1.225  -1.225
  448    HG1  THR  59           HG1      THR  59  -7.379   0.006   0.006
  449   1HG2  THR  59          3HG2      THR  59  -6.956   0.692   0.692
  450   2HG2  THR  59          2HG2      THR  59  -8.195  -0.170  -0.170
  451   3HG2  THR  59          1HG2      THR  59  -6.987  -1.072  -1.072
  452    H    VAL  60           H        VAL  60  -3.917  -1.918  -1.918
  453    HA   VAL  60           HA       VAL  60  -2.261  -2.261  -2.261
  454    HB   VAL  60           HB       VAL  60  -1.519  -3.140  -3.140
  455   1HG1  VAL  60          3HG1      VAL  60  -0.251  -3.520  -3.520
  456   2HG1  VAL  60          2HG1      VAL  60   0.741  -3.468  -3.468
  457   3HG1  VAL  60          1HG1      VAL  60  -0.512  -4.698  -4.698
  458   1HG2  VAL  60          2HG2      VAL  60  -0.839  -0.754  -0.754
  459   2HG2  VAL  60          1HG2      VAL  60  -1.107  -0.890  -0.890
  460   3HG2  VAL  60          3HG2      VAL  60   0.411  -1.449  -1.449
  461    H    GLN  61           H        GLN  61  -2.900  -3.913  -3.913
  462    HA   GLN  61           HA       GLN  61  -4.120  -6.232  -6.232
  463   1HB   GLN  61          2HB       GLN  61  -5.308  -4.656  -4.656
  464   2HB   GLN  61          1HB       GLN  61  -4.588  -5.893  -5.893
  465   1HG   GLN  61          2HG       GLN  61  -5.812  -7.237  -7.237
  466   2HG   GLN  61          1HG       GLN  61  -6.954  -6.012  -6.012
  467   1HE2  GLN  61          2HE2      GLN  61  -6.693  -7.481  -7.481
  468   2HE2  GLN  61          1HE2      GLN  61  -6.179  -5.993  -5.993
  469    H    GLY  62           H        GLY  62  -3.379  -8.257  -8.257
  470   1HA   GLY  62          2HA       GLY  62  -2.225  -9.727  -9.727
  471   2HA   GLY  62          1HA       GLY  62  -1.108  -8.401  -8.401
  472    H    ILE  63           H        ILE  63  -0.685  -7.608  -7.608
  473    HA   ILE  63           HA       ILE  63   1.451  -9.158  -9.158
  474    HB   ILE  63           HB       ILE  63  -0.313  -7.283  -7.283
  475   1HG1  ILE  63          2HG1      ILE  63   1.518  -5.811  -5.811
  476   2HG1  ILE  63          1HG1      ILE  63   2.659  -7.115  -7.115
  477   1HG2  ILE  63          2HG2      ILE  63   1.574  -9.212  -9.212
  478   2HG2  ILE  63          1HG2      ILE  63   1.732  -7.544  -7.544
  479   3HG2  ILE  63          3HG2      ILE  63   0.193  -8.388  -8.388
  480   1HD1  ILE  63          3HD1      ILE  63   1.710  -7.400  -7.400
  481   2HD1  ILE  63          2HD1      ILE  63   0.591  -6.073  -6.073
  482   3HD1  ILE  63          1HD1      ILE  63   2.327  -5.769  -5.769
  483    H    ALA  64           H        ALA  64   1.788 -10.770 -10.770
  484    HA   ALA  64           HA       ALA  64  -0.463 -12.592 -12.592
  485   1HB   ALA  64          2HB       ALA  64   2.490 -12.844 -12.844
  486   2HB   ALA  64          1HB       ALA  64   1.499 -14.027 -14.027
  487   3HB   ALA  64          3HB       ALA  64   1.318 -13.819 -13.819
  488    H    ASP  65           H        ASP  65  -0.693 -13.838 -13.838
  489    HA   ASP  65           HA       ASP  65  -1.108 -12.056 -12.056
  490   1HB   ASP  65          2HB       ASP  65  -2.261 -14.386 -14.386
  491   2HB   ASP  65          1HB       ASP  65  -1.161 -14.976 -14.976
  492    H    ASP  66           H        ASP  66   1.397 -14.272 -14.272
  493    HA   ASP  66           HA       ASP  66   2.655 -14.591 -14.591
  494   1HB   ASP  66          2HB       ASP  66   3.390 -15.044 -15.044
  495   2HB   ASP  66          1HB       ASP  66   4.726 -14.864 -14.864
  496    H    TYR  67           H        TYR  67   2.710 -12.085 -12.085
  497    HA   TYR  67           HA       TYR  67   5.040 -10.722 -10.722
  498   1HB   TYR  67          2HB       TYR  67   2.330  -9.797  -9.797
  499   2HB   TYR  67          1HB       TYR  67   3.623  -8.646  -8.646
  500    HD1  TYR  67           HD1      TYR  67   4.359 -11.984 -11.984
  501    HD2  TYR  67           HD2      TYR  67   3.626  -7.903  -7.903
  502    HE1  TYR  67           HE1      TYR  67   5.214 -12.358 -12.358
  503    HE2  TYR  67           HE2      TYR  67   4.474  -8.259  -8.259
  504    HH   TYR  67           HH       TYR  67   6.207 -10.072 -10.072
  505    H    ASP  68           H        ASP  68   5.764  -9.947  -9.947
  506    HA   ASP  68           HA       ASP  68   4.407  -9.848  -9.848
  507   1HB   ASP  68          2HB       ASP  68   6.865  -8.548  -8.548
  508   2HB   ASP  68          1HB       ASP  68   6.183  -7.880  -7.880
  509    H    LYS  69           H        LYS  69   2.404  -8.948  -8.948
  510    HA   LYS  69           HA       LYS  69   1.380  -6.772  -6.772
  511   1HB   LYS  69          2HB       LYS  69   0.196  -8.335  -8.335
  512   2HB   LYS  69          1HB       LYS  69   0.835  -7.369  -7.369
  513   1HG   LYS  69          2HG       LYS  69  -0.460  -5.520  -5.520
  514   2HG   LYS  69          1HG       LYS  69  -0.763  -6.109  -6.109
  515   1HD   LYS  69          2HD       LYS  69  -2.780  -6.473  -6.473
  516   2HD   LYS  69          1HD       LYS  69  -1.992  -8.052  -8.052
  517   1HE   LYS  69          2HE       LYS  69  -2.451  -8.033  -8.033
  518   2HE   LYS  69          1HE       LYS  69  -1.019  -7.010  -7.010
  519   1HZ   LYS  69          1HZ       LYS  69  -2.589  -5.082  -5.082
  520   2HZ   LYS  69          3HZ       LYS  69  -3.858  -6.169  -6.169
  521   3HZ   LYS  69          2HZ       LYS  69  -2.706  -5.901  -5.901
  522    H    LYS  70           H        LYS  70   2.905  -6.611  -6.611
  523    HA   LYS  70           HA       LYS  70   2.801  -3.829  -3.829
  524   1HB   LYS  70          2HB       LYS  70   4.808  -5.760  -5.760
  525   2HB   LYS  70          1HB       LYS  70   4.568  -4.101  -4.101
  526   1HG   LYS  70          2HG       LYS  70   2.229  -4.682  -4.682
  527   2HG   LYS  70          1HG       LYS  70   2.587  -6.361  -6.361
  528   1HD   LYS  70          2HD       LYS  70   4.615  -5.891  -5.891
  529   2HD   LYS  70          1HD       LYS  70   3.437  -4.751  -4.751
  530   1HE   LYS  70          2HE       LYS  70   2.929  -6.643  -6.643
  531   2HE   LYS  70          1HE       LYS  70   1.815  -6.796  -6.796
  532   1HZ   LYS  70          1HZ       LYS  70   4.453  -8.002  -8.002
  533   2HZ   LYS  70          3HZ       LYS  70   3.386  -8.760  -8.760
  534   3HZ   LYS  70          2HZ       LYS  70   2.946  -8.544  -8.544
  535    H    LYS  71           H        LYS  71   5.439  -5.907  -5.907
  536    HA   LYS  71           HA       LYS  71   7.318  -3.926  -3.926
  537   1HB   LYS  71          2HB       LYS  71   7.796  -6.344  -6.344
  538   2HB   LYS  71          1HB       LYS  71   6.876  -6.483  -6.483
  539   1HG   LYS  71          2HG       LYS  71   9.214  -6.439  -6.439
  540   2HG   LYS  71          1HG       LYS  71   8.474  -4.940  -4.940
  541   1HD   LYS  71          2HD       LYS  71   9.244  -3.871  -3.871
  542   2HD   LYS  71          1HD       LYS  71  10.157  -5.346  -5.346
  543   1HE   LYS  71          2HE       LYS  71  10.955  -4.804  -4.804
  544   2HE   LYS  71          1HE       LYS  71  10.682  -3.174  -3.174
  545   1HZ   LYS  71          1HZ       LYS  71  12.063  -4.018  -4.018
  546   2HZ   LYS  71          3HZ       LYS  71  12.608  -5.202  -5.202
  547   3HZ   LYS  71          2HZ       LYS  71  12.860  -3.565  -3.565
  548    H    LEU  72           H        LEU  72   4.350  -4.508  -4.508
  549    HA   LEU  72           HA       LEU  72   5.234  -3.101  -3.101
  550   1HB   LEU  72          2HB       LEU  72   2.638  -4.509  -4.509
  551   2HB   LEU  72          1HB       LEU  72   3.007  -3.713  -3.713
  552    HG   LEU  72           HG       LEU  72   3.939  -5.573  -5.573
  553   1HD1  LEU  72          2HD1      LEU  72   6.021  -4.761  -4.761
  554   2HD1  LEU  72          1HD1      LEU  72   5.634  -5.863  -5.863
  555   3HD1  LEU  72          3HD1      LEU  72   5.950  -6.499  -6.499
  556   1HD2  LEU  72          3HD2      LEU  72   2.742  -6.473  -6.473
  557   2HD2  LEU  72          2HD2      LEU  72   2.562  -7.102  -7.102
  558   3HD2  LEU  72          1HD2      LEU  72   3.963  -7.557  -7.557
  559    H    VAL  73           H        VAL  73   2.340  -2.985  -2.985
  560    HA   VAL  73           HA       VAL  73   1.827  -0.271  -0.271
  561    HB   VAL  73           HB       VAL  73   0.040  -1.970  -1.970
  562   1HG1  VAL  73          2HG1      VAL  73   1.098  -2.797  -2.797
  563   2HG1  VAL  73          1HG1      VAL  73   0.738  -1.249  -1.249
  564   3HG1  VAL  73          3HG1      VAL  73  -0.578  -2.293  -2.293
  565   1HG2  VAL  73          3HG2      VAL  73  -0.184   0.583   0.583
  566   2HG2  VAL  73          2HG2      VAL  73  -1.470  -0.323  -0.323
  567   3HG2  VAL  73          1HG2      VAL  73  -0.262   0.528   0.528
  568    H    LYS  74           H        LYS  74   2.892  -1.874  -1.874
  569    HA   LYS  74           HA       LYS  74   3.086   0.464   0.464
  570   1HB   LYS  74          2HB       LYS  74   3.337  -2.137  -2.137
  571   2HB   LYS  74          1HB       LYS  74   5.043  -1.731  -1.731
  572   1HG   LYS  74          2HG       LYS  74   3.083  -0.284  -0.284
  573   2HG   LYS  74          1HG       LYS  74   4.125  -1.603  -1.603
  574   1HD   LYS  74          2HD       LYS  74   5.886   0.101   0.101
  575   2HD   LYS  74          1HD       LYS  74   4.750   1.210   1.210
  576   1HE   LYS  74          2HE       LYS  74   5.217  -0.683  -0.683
  577   2HE   LYS  74          1HE       LYS  74   6.792  -0.496  -0.496
  578   1HZ   LYS  74          3HZ       LYS  74   5.298   1.927   1.927
  579   2HZ   LYS  74          2HZ       LYS  74   6.024   1.066   1.066
  580   3HZ   LYS  74          1HZ       LYS  74   6.968   1.655   1.655
  581    H    ALA  75           H        ALA  75   5.416  -1.213  -1.213
  582    HA   ALA  75           HA       ALA  75   7.600   0.512   0.512
  583   1HB   ALA  75          2HB       ALA  75   7.528  -1.846  -1.846
  584   2HB   ALA  75          1HB       ALA  75   7.329  -0.911  -0.911
  585   3HB   ALA  75          3HB       ALA  75   8.757  -0.673  -0.673
  586    H    PHE  76           H        PHE  76   5.020   0.484   0.484
  587    HA   PHE  76           HA       PHE  76   5.885   2.451   2.451
  588   1HB   PHE  76          2HB       PHE  76   3.701   1.052   1.052
  589   2HB   PHE  76          1HB       PHE  76   3.024   2.369   2.369
  590    HD1  PHE  76           HD2      PHE  76   4.514   1.469   1.469
  591    HD2  PHE  76           HD1      PHE  76   2.439   4.432   4.432
  592    HE1  PHE  76           HE2      PHE  76   4.086   2.728   2.728
  593    HE2  PHE  76           HE1      PHE  76   2.009   5.697   5.697
  594    HZ   PHE  76           HZ       PHE  76   2.834   4.844   4.844
  595    H    LYS  77           H        LYS  77   4.363   2.809   2.809
  596    HA   LYS  77           HA       LYS  77   4.177   5.660   5.660
  597   1HB   LYS  77          2HB       LYS  77   4.098   3.866   3.866
  598   2HB   LYS  77          1HB       LYS  77   3.550   5.534   5.534
  599   1HG   LYS  77          2HG       LYS  77   1.569   4.954   4.954
  600   2HG   LYS  77          1HG       LYS  77   2.287   3.845   3.845
  601   1HD   LYS  77          2HD       LYS  77   1.525   2.150   2.150
  602   2HD   LYS  77          1HD       LYS  77   2.621   2.641   2.641
  603   1HE   LYS  77          2HE       LYS  77   0.517   4.398   4.398
  604   2HE   LYS  77          1HE       LYS  77  -0.276   2.892   2.892
  605   1HZ   LYS  77          1HZ       LYS  77   1.627   3.221   3.221
  606   2HZ   LYS  77          3HZ       LYS  77  -0.054   3.096   3.096
  607   3HZ   LYS  77          2HZ       LYS  77   0.847   1.784   1.784
  608    H    LYS  78           H        LYS  78   6.796   3.628   3.628
  609    HA   LYS  78           HA       LYS  78   8.292   5.536   5.536
  610   1HB   LYS  78          2HB       LYS  78   8.229   2.721   2.721
  611   2HB   LYS  78          1HB       LYS  78   9.793   3.183   3.183
  612   1HG   LYS  78          2HG       LYS  78  10.509   4.081   4.081
  613   2HG   LYS  78          1HG       LYS  78   8.878   4.490   4.490
  614   1HD   LYS  78          2HD       LYS  78   8.446   2.043   2.043
  615   2HD   LYS  78          1HD       LYS  78  10.154   1.758   1.758
  616   1HE   LYS  78          2HE       LYS  78  10.457   3.565   3.565
  617   2HE   LYS  78          1HE       LYS  78   8.861   2.982   2.982
  618   1HZ   LYS  78          1HZ       LYS  78  10.089   0.674   0.674
  619   2HZ   LYS  78          3HZ       LYS  78  11.434   1.615   1.615
  620   3HZ   LYS  78          2HZ       LYS  78  10.121   1.506   1.506
  621    H    LYS  79           H        LYS  79   7.939   4.334   4.334
  622    HA   LYS  79           HA       LYS  79  10.524   5.344   5.344
  623   1HB   LYS  79          2HB       LYS  79   9.032   3.243   3.243
  624   2HB   LYS  79          1HB       LYS  79   8.564   4.464   4.464
  625   1HG   LYS  79          2HG       LYS  79  11.169   4.823   4.823
  626   2HG   LYS  79          1HG       LYS  79  11.195   3.164   3.164
  627   1HD   LYS  79          2HD       LYS  79  10.812   2.441   2.441
  628   2HD   LYS  79          1HD       LYS  79   9.248   3.257   3.257
  629   1HE   LYS  79          2HE       LYS  79  10.781   3.865   3.865
  630   2HE   LYS  79          1HE       LYS  79  10.140   5.214   5.214
  631   1HZ   LYS  79          1HZ       LYS  79  12.696   4.130   4.130
  632   2HZ   LYS  79          3HZ       LYS  79  12.704   4.959   4.959
  633   3HZ   LYS  79          2HZ       LYS  79  12.167   5.735   5.735
  634    H    PHE  80           H        PHE  80   7.084   6.061   6.061
  635    HA   PHE  80           HA       PHE  80   7.887   8.632   8.632
  636   1HB   PHE  80          2HB       PHE  80   5.157   7.483   7.483
  637   2HB   PHE  80          1HB       PHE  80   6.079   8.576   8.576
  638    HD1  PHE  80           HD1      PHE  80   5.618   5.084   5.084
  639    HD2  PHE  80           HD2      PHE  80   7.623   7.745   7.745
  640    HE1  PHE  80           HE1      PHE  80   6.324   3.174   3.174
  641    HE2  PHE  80           HE2      PHE  80   8.333   5.839   5.839
  642    HZ   PHE  80           HZ       PHE  80   7.682   3.551   3.551
  643    H    ALA  81           H        ALA  81   6.344   7.165   7.165
  644    HA   ALA  81           HA       ALA  81   5.357   8.052   8.052
  645   1HB   ALA  81          1HB       ALA  81   7.021  10.027  10.027
  646   2HB   ALA  81          3HB       ALA  81   5.471  10.857  10.857
  647   3HB   ALA  81          2HB       ALA  81   5.944  10.139  10.139
  648    H    CYS  82           H        CYS  82   3.836   7.219   7.219
  649    HA   CYS  82           HA       CYS  82   1.584   9.110   9.110
  650   1HB   CYS  82          2HB       CYS  82   2.558   8.414   8.414
  651   2HB   CYS  82          1HB       CYS  82   2.029   6.771   6.771
  652    HG   CYS  82           HG       CYS  82  -0.350   7.414   7.414
  653    H    ASN  83           H        ASN  83  -0.583   8.226   8.226
  654    HA   ASN  83           HA       ASN  83  -0.747   6.231   6.231
  655   1HB   ASN  83          2HB       ASN  83  -2.634   8.142   8.142
  656   2HB   ASN  83          1HB       ASN  83  -3.320   6.721   6.721
  657   1HD2  ASN  83          2HD2      ASN  83  -1.929   7.707   7.707
  658   2HD2  ASN  83          1HD2      ASN  83  -1.885   6.335   6.335
  659    H    GLY  84           H        GLY  84  -1.087   4.126   4.126
  660   1HA   GLY  84          2HA       GLY  84  -2.352   3.240   3.240
  661   2HA   GLY  84          1HA       GLY  84  -0.864   2.492   2.492
  662    H    THR  85           H        THR  85  -3.585   1.398   1.398
  663    HA   THR  85           HA       THR  85  -3.805  -0.014  -0.014
  664    HB   THR  85           HB       THR  85  -6.193   0.239   0.239
  665    HG1  THR  85           HG1      THR  85  -7.363   1.325   1.325
  666   1HG2  THR  85          3HG2      THR  85  -4.804   2.119   2.119
  667   2HG2  THR  85          2HG2      THR  85  -5.161   2.995   2.995
  668   3HG2  THR  85          1HG2      THR  85  -6.471   2.532   2.532
  669    H    VAL  86           H        VAL  86  -5.095  -2.016  -2.016
  670    HA   VAL  86           HA       VAL  86  -4.869  -3.136  -3.136
  671    HB   VAL  86           HB       VAL  86  -3.412  -4.215  -4.215
  672   1HG1  VAL  86          1HG1      VAL  86  -5.530  -3.860  -3.860
  673   2HG1  VAL  86          3HG1      VAL  86  -5.475  -5.604  -5.604
  674   3HG1  VAL  86          2HG1      VAL  86  -4.043  -4.753  -4.753
  675   1HG2  VAL  86          2HG2      VAL  86  -5.591  -5.659  -5.659
  676   2HG2  VAL  86          1HG2      VAL  86  -3.843  -5.803  -5.803
  677   3HG2  VAL  86          3HG2      VAL  86  -4.659  -6.579  -6.579
  678    H    ILE  87           H        ILE  87  -6.822  -3.095  -3.095
  679    HA   ILE  87           HA       ILE  87  -9.177  -3.865  -3.865
  680    HB   ILE  87           HB       ILE  87 -10.546  -2.731  -2.731
  681   1HG1  ILE  87          2HG1      ILE  87  -8.651  -1.083  -1.083
  682   2HG1  ILE  87          1HG1      ILE  87  -8.061  -2.733  -2.733
  683   1HG2  ILE  87          3HG2      ILE  87  -8.388  -1.013  -1.013
  684   2HG2  ILE  87          2HG2      ILE  87  -9.921  -0.421  -0.421
  685   3HG2  ILE  87          1HG2      ILE  87  -9.905  -1.493  -1.493
  686   1HD1  ILE  87          1HD1      ILE  87 -10.654  -3.081  -3.081
  687   2HD1  ILE  87          3HD1      ILE  87 -10.394  -1.431  -1.431
  688   3HD1  ILE  87          2HD1      ILE  87  -9.379  -2.741  -2.741
  689    H    GLU  88           H        GLU  88 -10.851  -5.098  -5.098
  690    HA   GLU  88           HA       GLU  88  -9.680  -6.990  -6.990
  691   1HB   GLU  88          2HB       GLU  88 -10.736  -7.648  -7.648
  692   2HB   GLU  88          1HB       GLU  88 -12.233  -7.581  -7.581
  693   1HG   GLU  88          2HG       GLU  88 -11.530  -9.284  -9.284
  694   2HG   GLU  88          1HG       GLU  88  -9.862  -9.181  -9.181
  695    H    HIS  89           H        HIS  89 -10.123  -5.292  -5.292
  696    HA   HIS  89           HA       HIS  89 -12.548  -4.246  -4.246
  697   1HB   HIS  89          2HB       HIS  89 -10.107  -4.104  -4.104
  698   2HB   HIS  89          1HB       HIS  89 -10.819  -5.225  -5.225
  699    HD1  HIS  89           HD1      HIS  89 -12.095  -4.201  -4.201
  700    HD2  HIS  89           HD2      HIS  89 -11.647  -1.598  -1.598
  701    HE1  HIS  89           HE1      HIS  89 -13.076  -2.019  -2.019
  702    HE2  HIS  89           HE2      HIS  89 -12.879  -0.483  -0.483
  703    HA   PRO  90           HA       PRO  90 -14.954  -7.755  -7.755
  704   1HB   PRO  90          2HB       PRO  90 -17.037  -6.466  -6.466
  705   2HB   PRO  90          1HB       PRO  90 -16.747  -6.441  -6.441
  706   1HG   PRO  90          2HG       PRO  90 -16.121  -4.359  -4.359
  707   2HG   PRO  90          1HG       PRO  90 -16.792  -4.158  -4.158
  708   1HD   PRO  90          2HD       PRO  90 -14.150  -3.765  -3.765
  709   2HD   PRO  90          1HD       PRO  90 -14.727  -4.215  -4.215
  710    H    GLU  91           H        GLU  91 -13.771  -5.330  -5.330
  711    HA   GLU  91           HA       GLU  91 -14.626  -6.663  -6.663
  712   1HB   GLU  91          2HB       GLU  91 -13.667  -4.103  -4.103
  713   2HB   GLU  91          1HB       GLU  91 -12.491  -4.786  -4.786
  714   1HG   GLU  91          2HG       GLU  91 -15.369  -4.991  -4.991
  715   2HG   GLU  91          1HG       GLU  91 -14.578  -3.422  -3.422
  716    H    TYR  92           H        TYR  92 -11.905  -6.771  -6.771
  717    HA   TYR  92           HA       TYR  92 -10.493  -8.510  -8.510
  718   1HB   TYR  92          2HB       TYR  92  -9.068  -7.085  -7.085
  719   2HB   TYR  92          1HB       TYR  92  -8.431  -7.674  -7.674
  720    HD1  TYR  92           HD2      TYR  92 -10.258  -6.520  -6.520
  721    HD2  TYR  92           HD1      TYR  92  -8.641  -4.795  -4.795
  722    HE1  TYR  92           HE2      TYR  92 -10.539  -4.281  -4.281
  723    HE2  TYR  92           HE1      TYR  92  -8.915  -2.549  -2.549
  724    HH   TYR  92           HH       TYR  92  -9.038  -1.603  -1.603
  725    H    GLY  93           H        GLY  93 -10.956  -7.894  -7.894
  726   1HA   GLY  93          2HA       GLY  93 -11.820  -9.807  -9.807
  727   2HA   GLY  93          1HA       GLY  93 -10.691 -10.812 -10.812
  728    H    GLU  94           H        GLU  94  -8.737  -8.401  -8.401
  729    HA   GLU  94           HA       GLU  94  -8.172  -8.064  -8.064
  730   1HB   GLU  94          2HB       GLU  94  -7.622 -10.679 -10.679
  731   2HB   GLU  94          1HB       GLU  94  -6.054  -9.885  -9.885
  732   1HG   GLU  94          2HG       GLU  94  -6.988  -9.039  -9.039
  733   2HG   GLU  94          1HG       GLU  94  -7.927 -10.524 -10.524
  734    H    VAL  95           H        VAL  95  -7.350  -6.089  -6.089
  735    HA   VAL  95           HA       VAL  95  -4.798  -5.871  -5.871
  736    HB   VAL  95           HB       VAL  95  -5.565  -3.857  -3.857
  737   1HG1  VAL  95          3HG1      VAL  95  -5.476  -6.419  -6.419
  738   2HG1  VAL  95          2HG1      VAL  95  -7.182  -6.091  -6.091
  739   3HG1  VAL  95          1HG1      VAL  95  -5.941  -5.109  -5.109
  740   1HG2  VAL  95          2HG2      VAL  95  -7.707  -3.733  -3.733
  741   2HG2  VAL  95          1HG2      VAL  95  -7.805  -3.322  -3.322
  742   3HG2  VAL  95          3HG2      VAL  95  -8.353  -4.902  -4.902
  743    H    ILE  96           H        ILE  96  -3.634  -3.978  -3.978
  744    HA   ILE  96           HA       ILE  96  -4.333  -2.916  -2.916
  745    HB   ILE  96           HB       ILE  96  -1.958  -2.827  -2.827
  746   1HG1  ILE  96          2HG1      ILE  96  -2.484  -4.262  -4.262
  747   2HG1  ILE  96          1HG1      ILE  96  -0.857  -3.639  -3.639
  748   1HG2  ILE  96          1HG2      ILE  96  -2.495  -0.631  -0.631
  749   2HG2  ILE  96          3HG2      ILE  96  -0.924  -0.969  -0.969
  750   3HG2  ILE  96          2HG2      ILE  96  -2.273  -0.453  -0.453
  751   1HD1  ILE  96          3HD1      ILE  96  -1.426  -1.755  -1.755
  752   2HD1  ILE  96          2HD1      ILE  96  -2.961  -2.560  -2.560
  753   3HD1  ILE  96          1HD1      ILE  96  -1.443  -3.344  -3.344
  754    H    GLN  97           H        GLN  97  -4.465  -0.577  -0.577
  755    HA   GLN  97           HA       GLN  97  -5.419   0.950   0.950
  756   1HB   GLN  97          2HB       GLN  97  -7.039  -0.035  -0.035
  757   2HB   GLN  97          1HB       GLN  97  -6.851   1.680   1.680
  758   1HG   GLN  97          2HG       GLN  97  -7.532   2.090   2.090
  759   2HG   GLN  97          1HG       GLN  97  -7.974   0.385   0.385
  760   1HE2  GLN  97          2HE2      GLN  97 -11.158   1.535   1.535
  761   2HE2  GLN  97          1HE2      GLN  97 -10.135   0.971   0.971
  762    H    LEU  98           H        LEU  98  -3.524   2.161   2.161
  763    HA   LEU  98           HA       LEU  98  -2.534   3.550   3.550
  764   1HB   LEU  98          2HB       LEU  98  -1.859   3.902   3.902
  765   2HB   LEU  98          1HB       LEU  98  -0.984   4.613   4.613
  766    HG   LEU  98           HG       LEU  98  -1.280   1.638   1.638
  767   1HD1  LEU  98          1HD1      LEU  98  -0.192   3.081   3.081
  768   2HD1  LEU  98          3HD1      LEU  98   1.210   2.658   2.658
  769   3HD1  LEU  98          2HD1      LEU  98   0.141   1.393   1.393
  770   1HD2  LEU  98          3HD2      LEU  98   0.270   3.594   3.594
  771   2HD2  LEU  98          2HD2      LEU  98  -0.199   1.942   1.942
  772   3HD2  LEU  98          1HD2      LEU  98   1.214   2.234   2.234
  773    H    GLN  99           H        GLN  99  -2.408   5.898   5.898
  774    HA   GLN  99           HA       GLN  99  -4.901   7.112   7.112
  775   1HB   GLN  99          2HB       GLN  99  -3.081   7.507   7.507
  776   2HB   GLN  99          1HB       GLN  99  -3.655   9.009   9.009
  777   1HG   GLN  99          2HG       GLN  99  -5.848   7.202   7.202
  778   2HG   GLN  99          1HG       GLN  99  -4.980   7.326   7.326
  779   1HE2  GLN  99          2HE2      GLN  99  -6.486  10.794  10.794
  780   2HE2  GLN  99          1HE2      GLN  99  -5.773   9.600   9.600
  781    H    GLY 100           H        GLY 100  -5.001   9.051   9.051
  782   1HA   GLY 100          2HA       GLY 100  -4.309  10.676  10.676
  783   2HA   GLY 100          1HA       GLY 100  -2.695  10.509  10.509
  784    H    ASP 101           H        ASP 101  -2.619  10.992  10.992
  785    HA   ASP 101           HA       ASP 101  -2.836   8.627   8.627
  786   1HB   ASP 101          2HB       ASP 101  -1.781  10.072  10.072
  787   2HB   ASP 101          1HB       ASP 101  -3.261  10.733  10.733
  788    H    GLN 102           H        GLN 102  -1.472   7.075   7.075
  789    HA   GLN 102           HA       GLN 102   1.389   7.713   7.713
  790   1HB   GLN 102          2HB       GLN 102  -0.392   5.845   5.845
  791   2HB   GLN 102          1HB       GLN 102   1.180   5.189   5.189
  792   1HG   GLN 102          2HG       GLN 102   0.935   6.266   6.266
  793   2HG   GLN 102          1HG       GLN 102   2.322   6.741   6.741
  794   1HE2  GLN 102          2HE2      GLN 102  -0.734   9.452   9.452
  795   2HE2  GLN 102          1HE2      GLN 102  -1.034   7.781   7.781
  796    H    ARG 103           H        ARG 103  -0.635   6.780   6.780
  797    HA   ARG 103           HA       ARG 103   0.092   4.343   4.343
  798   1HB   ARG 103          2HB       ARG 103  -0.523   5.205   5.205
  799   2HB   ARG 103          1HB       ARG 103  -1.643   5.787   5.787
  800   1HG   ARG 103          2HG       ARG 103  -1.281   7.853   7.853
  801   2HG   ARG 103          1HG       ARG 103   0.400   7.708   7.708
  802   1HD   ARG 103          2HD       ARG 103   0.914   8.027   8.027
  803   2HD   ARG 103          1HD       ARG 103   0.384   6.363   6.363
  804    HE   ARG 103           HE       ARG 103  -1.471   7.146   7.146
  805   1HH1  ARG 103          2HH1      ARG 103   0.025   9.784   9.784
  806   2HH1  ARG 103          1HH1      ARG 103  -0.984  10.992  10.992
  807   1HH2  ARG 103          1HH2      ARG 103  -2.800   8.733   8.733
  808   2HH2  ARG 103          2HH2      ARG 103  -2.589  10.395  10.395
  809    H    LYS 104           H        LYS 104   1.969   7.262   7.262
  810    HA   LYS 104           HA       LYS 104   3.991   6.184   6.184
  811   1HB   LYS 104          2HB       LYS 104   3.345   8.555   8.555
  812   2HB   LYS 104          1HB       LYS 104   3.877   8.832   8.832
  813   1HG   LYS 104          2HG       LYS 104   6.115   7.756   7.756
  814   2HG   LYS 104          1HG       LYS 104   5.436   8.594   8.594
  815   1HD   LYS 104          2HD       LYS 104   6.895  10.114  10.114
  816   2HD   LYS 104          1HD       LYS 104   5.236  10.639  10.639
  817   1HE   LYS 104          2HE       LYS 104   5.260   9.731   9.731
  818   2HE   LYS 104          1HE       LYS 104   6.796   8.915   8.915
  819   1HZ   LYS 104          2HZ       LYS 104   7.688  11.267  11.267
  820   2HZ   LYS 104          1HZ       LYS 104   6.285  11.793  11.793
  821   3HZ   LYS 104          3HZ       LYS 104   7.381  10.787  10.787
  822    H    ASN 105           H        ASN 105   3.369   6.574   6.574
  823    HA   ASN 105           HA       ASN 105   6.163   6.086   6.086
  824   1HB   ASN 105          2HB       ASN 105   3.697   6.763   6.763
  825   2HB   ASN 105          1HB       ASN 105   5.167   6.197   6.197
  826   1HD2  ASN 105          2HD2      ASN 105   4.797  10.006  10.006
  827   2HD2  ASN 105          1HD2      ASN 105   3.515   8.850   8.850
  828    H    ILE 106           H        ILE 106   3.035   4.464   4.464
  829    HA   ILE 106           HA       ILE 106   3.820   2.252   2.252
  830    HB   ILE 106           HB       ILE 106   1.461   2.850   2.850
  831   1HG1  ILE 106          2HG1      ILE 106   0.657   0.557   0.557
  832   2HG1  ILE 106          1HG1      ILE 106   2.198   0.025   0.025
  833   1HG2  ILE 106          3HG2      ILE 106   1.805   3.282   3.282
  834   2HG2  ILE 106          2HG2      ILE 106   1.891   1.538   1.538
  835   3HG2  ILE 106          1HG2      ILE 106   0.409   2.270   2.270
  836   1HD1  ILE 106          3HD1      ILE 106   2.326   1.417   1.417
  837   2HD1  ILE 106          2HD1      ILE 106   1.544  -0.163  -0.163
  838   3HD1  ILE 106          1HD1      ILE 106   3.201   0.001   0.001
  839    H    CYS 107           H        CYS 107   3.643   2.629   2.629
  840    HA   CYS 107           HA       CYS 107   4.619   0.080   0.080
  841   1HB   CYS 107          2HB       CYS 107   4.119   2.574   2.574
  842   2HB   CYS 107          1HB       CYS 107   5.621   1.850   1.850
  843    HG   CYS 107           HG       CYS 107   2.907   0.334   0.334
  844    H    GLN 108           H        GLN 108   6.170   3.056   3.056
  845    HA   GLN 108           HA       GLN 108   8.853   2.215   2.215
  846   1HB   GLN 108          2HB       GLN 108   8.693   4.515   4.515
  847   2HB   GLN 108          1HB       GLN 108   7.504   4.540   4.540
  848   1HG   GLN 108          2HG       GLN 108   9.194   5.355   5.355
  849   2HG   GLN 108          1HG       GLN 108   9.672   3.667   3.667
  850   1HE2  GLN 108          2HE2      GLN 108  12.456   3.929   3.929
  851   2HE2  GLN 108          1HE2      GLN 108  11.262   2.856   2.856
  852    H    PHE 109           H        PHE 109   6.609   2.034   2.034
  853    HA   PHE 109           HA       PHE 109   8.491   1.324   1.324
  854   1HB   PHE 109          2HB       PHE 109   6.285   2.255   2.255
  855   2HB   PHE 109          1HB       PHE 109   5.503   0.849   0.849
  856    HD1  PHE 109           HD2      PHE 109   7.991   1.724   1.724
  857    HD2  PHE 109           HD1      PHE 109   4.872  -0.881  -0.881
  858    HE1  PHE 109           HE2      PHE 109   8.065   0.587   0.587
  859    HE2  PHE 109           HE1      PHE 109   4.939  -2.025  -2.025
  860    HZ   PHE 109           HZ       PHE 109   6.538  -1.291  -1.291
  861    H    LEU 110           H        LEU 110   6.122  -0.574  -0.574
  862    HA   LEU 110           HA       LEU 110   6.790  -3.093  -3.093
  863   1HB   LEU 110          2HB       LEU 110   5.600  -2.105  -2.105
  864   2HB   LEU 110          1HB       LEU 110   6.007  -3.801  -3.801
  865    HG   LEU 110           HG       LEU 110   4.406  -4.146  -4.146
  866   1HD1  LEU 110          2HD1      LEU 110   4.200  -1.145  -1.145
  867   2HD1  LEU 110          1HD1      LEU 110   3.148  -2.287  -2.287
  868   3HD1  LEU 110          3HD1      LEU 110   4.873  -2.247  -2.247
  869   1HD2  LEU 110          3HD2      LEU 110   3.463  -3.880  -3.880
  870   2HD2  LEU 110          2HD2      LEU 110   2.329  -3.397  -3.397
  871   3HD2  LEU 110          1HD2      LEU 110   3.189  -2.169  -2.169
  872    H    VAL 111           H        VAL 111   8.422  -1.048  -1.048
  873    HA   VAL 111           HA       VAL 111  10.177  -3.188  -3.188
  874    HB   VAL 111           HB       VAL 111  10.236  -0.237  -0.237
  875   1HG1  VAL 111          3HG1      VAL 111  11.898  -2.553  -2.553
  876   2HG1  VAL 111          2HG1      VAL 111  11.470  -1.385  -1.385
  877   3HG1  VAL 111          1HG1      VAL 111  12.334  -0.855  -0.855
  878   1HG2  VAL 111          1HG2      VAL 111   8.207  -1.739  -1.739
  879   2HG2  VAL 111          3HG2      VAL 111   8.927  -0.633  -0.633
  880   3HG2  VAL 111          2HG2      VAL 111   9.325  -2.351  -2.351
  881    H    GLU 112           H        GLU 112  10.154  -0.477  -0.477
  882    HA   GLU 112           HA       GLU 112  12.974  -0.385  -0.385
  883   1HB   GLU 112          2HB       GLU 112  10.585   0.766   0.766
  884   2HB   GLU 112          1HB       GLU 112  12.183   0.873   0.873
  885   1HG   GLU 112          2HG       GLU 112  12.085   1.719   1.719
  886   2HG   GLU 112          1HG       GLU 112  11.094   2.690   2.690
  887    H    ILE 113           H        ILE 113  10.254  -1.621  -1.621
  888    HA   ILE 113           HA       ILE 113  11.974  -2.854  -2.854
  889    HB   ILE 113           HB       ILE 113  10.004  -3.634  -3.634
  890   1HG1  ILE 113          2HG1      ILE 113   8.541  -3.020  -3.020
  891   2HG1  ILE 113          1HG1      ILE 113   8.869  -4.621  -4.621
  892   1HG2  ILE 113          2HG2      ILE 113  10.476  -1.089  -1.089
  893   2HG2  ILE 113          1HG2      ILE 113   9.001  -1.085  -1.085
  894   3HG2  ILE 113          3HG2      ILE 113   8.956  -1.637  -1.637
  895   1HD1  ILE 113          2HD1      ILE 113   7.461  -2.957  -2.957
  896   2HD1  ILE 113          1HD1      ILE 113   6.587  -3.121  -3.121
  897   3HD1  ILE 113          3HD1      ILE 113   7.062  -4.558  -4.558
  898    H    GLY 114           H        GLY 114  10.878  -3.760  -3.760
  899   1HA   GLY 114          2HA       GLY 114  11.472  -5.681  -5.681
  900   2HA   GLY 114          1HA       GLY 114  12.028  -6.404  -6.404
  901    H    LEU 115           H        LEU 115   8.889  -4.941  -4.941
  902    HA   LEU 115           HA       LEU 115   7.568  -7.310  -7.310
  903   1HB   LEU 115          2HB       LEU 115   6.975  -4.723  -4.723
  904   2HB   LEU 115          1HB       LEU 115   6.052  -5.066  -5.066
  905    HG   LEU 115           HG       LEU 115   4.711  -6.686  -6.686
  906   1HD1  LEU 115          3HD1      LEU 115   6.692  -6.317  -6.317
  907   2HD1  LEU 115          2HD1      LEU 115   5.075  -6.955  -6.955
  908   3HD1  LEU 115          1HD1      LEU 115   6.177  -7.807  -7.807
  909   1HD2  LEU 115          2HD2      LEU 115   4.277  -4.196  -4.196
  910   2HD2  LEU 115          1HD2      LEU 115   3.497  -5.286  -5.286
  911   3HD2  LEU 115          3HD2      LEU 115   4.933  -4.381  -4.381
  912    H    ALA 116           H        ALA 116   7.000  -5.382  -5.382
  913    HA   ALA 116           HA       ALA 116   6.232  -7.868  -7.868
  914   1HB   ALA 116          2HB       ALA 116   4.596  -5.899  -5.899
  915   2HB   ALA 116          1HB       ALA 116   5.570  -5.117  -5.117
  916   3HB   ALA 116          3HB       ALA 116   4.763  -6.648  -6.648
  917    H    LYS 117           H        LYS 117   6.628  -7.759  -7.759
  918    HA   LYS 117           HA       LYS 117   9.435  -7.099  -7.099
  919   1HB   LYS 117          2HB       LYS 117   7.577  -9.052  -9.052
  920   2HB   LYS 117          1HB       LYS 117   8.435  -8.224  -8.224
  921   1HG   LYS 117          2HG       LYS 117   9.560 -10.282 -10.282
  922   2HG   LYS 117          1HG       LYS 117  10.560  -8.849  -8.849
  923   1HD   LYS 117          2HD       LYS 117   8.879  -9.588  -9.588
  924   2HD   LYS 117          1HD       LYS 117  10.133 -10.760 -10.760
  925   1HE   LYS 117          2HE       LYS 117  11.180  -8.078  -8.078
  926   2HE   LYS 117          1HE       LYS 117  10.422  -8.395  -8.395
  927   1HZ   LYS 117          3HZ       LYS 117  12.165 -10.479 -10.479
  928   2HZ   LYS 117          2HZ       LYS 117  12.922  -9.052  -9.052
  929   3HZ   LYS 117          1HZ       LYS 117  11.965  -9.928  -9.928
  930    H    ASP 118           H        ASP 118  10.185  -5.885  -5.885
  931    HA   ASP 118           HA       ASP 118   8.854  -3.490  -3.490
  932   1HB   ASP 118          2HB       ASP 118  10.483  -3.095  -3.095
  933   2HB   ASP 118          1HB       ASP 118  11.263  -3.765  -3.765
  934    H    ASP 119           H        ASP 119   8.593  -6.552  -6.552
  935    HA   ASP 119           HA       ASP 119   7.199  -5.513  -5.513
  936   1HB   ASP 119          2HB       ASP 119   8.606  -7.747  -7.747
  937   2HB   ASP 119          1HB       ASP 119   7.034  -8.393  -8.393
  938    H    GLN 120           H        GLN 120   6.408  -6.816  -6.816
  939    HA   GLN 120           HA       GLN 120   3.633  -7.249  -7.249
  940   1HB   GLN 120          2HB       GLN 120   5.266  -7.063  -7.063
  941   2HB   GLN 120          1HB       GLN 120   3.525  -7.289  -7.289
  942   1HG   GLN 120          2HG       GLN 120   3.944  -9.316  -9.316
  943   2HG   GLN 120          1HG       GLN 120   5.635  -9.147  -9.147
  944   1HE2  GLN 120          2HE2      GLN 120   2.950  -9.938  -9.938
  945   2HE2  GLN 120          1HE2      GLN 120   2.547  -8.842  -8.842
  946    H    LEU 121           H        LEU 121   5.513  -4.487  -4.487
  947    HA   LEU 121           HA       LEU 121   3.904  -2.826  -2.826
  948   1HB   LEU 121          2HB       LEU 121   5.646  -2.157  -2.157
  949   2HB   LEU 121          1HB       LEU 121   4.924  -0.952  -0.952
  950    HG   LEU 121           HG       LEU 121   6.782  -3.096  -3.096
  951   1HD1  LEU 121          1HD1      LEU 121   7.362  -0.379  -0.379
  952   2HD1  LEU 121          3HD1      LEU 121   8.404  -1.098  -1.098
  953   3HD1  LEU 121          2HD1      LEU 121   8.174  -1.912  -1.912
  954   1HD2  LEU 121          3HD2      LEU 121   5.107  -1.738  -1.738
  955   2HD2  LEU 121          2HD2      LEU 121   6.768  -1.992  -1.992
  956   3HD2  LEU 121          1HD2      LEU 121   6.300  -0.452  -0.452
  957    H    LYS 122           H        LYS 122   1.737  -3.084  -3.084
  958    HA   LYS 122           HA       LYS 122   0.746  -2.212  -2.212
  959   1HB   LYS 122          2HB       LYS 122  -0.124  -4.301  -4.301
  960   2HB   LYS 122          1HB       LYS 122  -1.423  -3.343  -3.343
  961   1HG   LYS 122          2HG       LYS 122   0.693  -4.719  -4.719
  962   2HG   LYS 122          1HG       LYS 122  -0.873  -5.432  -5.432
  963   1HD   LYS 122          2HD       LYS 122  -1.971  -4.146  -4.146
  964   2HD   LYS 122          1HD       LYS 122  -0.999  -2.720  -2.720
  965   1HE   LYS 122          2HE       LYS 122   0.879  -4.022  -4.022
  966   2HE   LYS 122          1HE       LYS 122  -0.465  -4.936  -4.936
  967   1HZ   LYS 122          2HZ       LYS 122  -1.425  -2.719  -2.719
  968   2HZ   LYS 122          1HZ       LYS 122   0.069  -2.034  -2.034
  969   3HZ   LYS 122          3HZ       LYS 122  -0.032  -3.182  -3.182
  970    H    VAL 123           H        VAL 123   1.150  -0.009  -0.009
  971    HA   VAL 123           HA       VAL 123  -0.696   0.914   0.914
  972    HB   VAL 123           HB       VAL 123   1.607   1.755   1.755
  973   1HG1  VAL 123          3HG1      VAL 123   1.438   1.848   1.848
  974   2HG1  VAL 123          2HG1      VAL 123   1.271   3.551   3.551
  975   3HG1  VAL 123          1HG1      VAL 123   2.686   2.644   2.644
  976   1HG2  VAL 123          3HG2      VAL 123  -0.390   3.115   3.115
  977   2HG2  VAL 123          2HG2      VAL 123   1.096   4.010   4.010
  978   3HG2  VAL 123          1HG2      VAL 123  -0.219   4.026   4.026
  979    H    HIS 124           H        HIS 124  -2.657   1.644   1.644
  980    HA   HIS 124           HA       HIS 124  -3.106   2.767   2.767
  981   1HB   HIS 124          2HB       HIS 124  -5.159   1.311   1.311
  982   2HB   HIS 124          1HB       HIS 124  -5.315   1.830   1.830
  983    HD1  HIS 124           HD1      HIS 124  -4.582   0.211   0.211
  984    HD2  HIS 124           HD2      HIS 124  -3.234  -0.847  -0.847
  985    HE1  HIS 124           HE1      HIS 124  -3.515  -2.049  -2.049
  986    HE2  HIS 124           HE2      HIS 124  -2.823  -2.721  -2.721
  987    H    GLY 125           H        GLY 125  -3.394   3.243   3.243
  988   1HA   GLY 125          2HA       GLY 125  -4.226   4.973   4.973
  989   2HA   GLY 125          1HA       GLY 125  -3.880   5.963   5.963
  990    H    PHE 126           HN       PHE 126  -5.544   6.926   6.926
  991    HA   PHE 126           HA       PHE 126  -8.172   5.708   5.708
  992   1HB   PHE 126          2HB       PHE 126  -9.152   7.953   7.953
  993   2HB   PHE 126          1HB       PHE 126  -8.505   6.818   6.818
  994    HD1  PHE 126           HD2      PHE 126  -6.215   8.774   8.774
  995    HD2  PHE 126           HD1      PHE 126  -8.278   8.577   8.577
  996    HE1  PHE 126           HE2      PHE 126  -4.751  10.531  10.531
  997    HE2  PHE 126           HE1      PHE 126  -6.817  10.338  10.338
  998    HZ   PHE 126           HZ       PHE 126  -5.051  11.316  11.316

  Start of MODEL   12
    1   1H    MET   1          3H        MET   1 -14.839  16.823  16.823
    2   2H    MET   1          2H        MET   1 -14.694  15.132  15.132
    3   3H    MET   1          1H        MET   1 -13.406  16.179  16.179
    4    HA   MET   1           HA       MET   1 -14.437  15.630  15.630
    5   1HB   MET   1          2HB       MET   1 -16.936  15.973  15.973
    6   2HB   MET   1          1HB       MET   1 -16.440  14.636  14.636
    7   1HG   MET   1          2HG       MET   1 -16.779  17.145  17.145
    8   2HG   MET   1          1HG       MET   1 -18.250  16.577  16.577
    9   1HE   MET   1          2HE       MET   1 -18.685  13.717  13.717
   10   2HE   MET   1          1HE       MET   1 -19.222  13.411  13.411
   11   3HE   MET   1          3HE       MET   1 -19.779  14.849  14.849
   12    H    ARG   2           H        ARG   2 -13.462  17.297  17.297
   13    HA   ARG   2           HA       ARG   2 -14.083  20.036  20.036
   14   1HB   ARG   2          2HB       ARG   2 -12.166  18.622  18.622
   15   2HB   ARG   2          1HB       ARG   2 -12.600  20.268  20.268
   16   1HG   ARG   2          2HG       ARG   2 -11.925  19.949  19.949
   17   2HG   ARG   2          1HG       ARG   2 -10.605  19.559  19.559
   18   1HD   ARG   2          2HD       ARG   2 -11.993  21.976  21.976
   19   2HD   ARG   2          1HD       ARG   2 -11.369  22.088  22.088
   20    HE   ARG   2           HE       ARG   2  -9.846  22.045  22.045
   21   1HH1  ARG   2          2HH1      ARG   2  -9.775  21.317  21.317
   22   2HH1  ARG   2          1HH1      ARG   2  -8.054  21.462  21.462
   23   1HH2  ARG   2          1HH2      ARG   2  -7.582  22.236  22.236
   24   2HH2  ARG   2          2HH2      ARG   2  -6.808  21.983  21.983
   25    H    GLY   3           H        GLY   3 -15.004  17.705  17.705
   26   1HA   GLY   3          2HA       GLY   3 -17.369  18.711  18.711
   27   2HA   GLY   3          1HA       GLY   3 -16.251  19.707  19.707
   28    H    SER   4           H        SER   4 -16.176  19.038  19.038
   29    HA   SER   4           HA       SER   4 -15.494  16.297  16.297
   30   1HB   SER   4          2HB       SER   4 -18.199  17.424  17.424
   31   2HB   SER   4          1HB       SER   4 -17.468  16.311  16.311
   32    HG   SER   4           HG       SER   4 -18.670  15.136  15.136
   33    H    HIS   5           H        HIS   5 -13.619  17.566  17.566
   34    HA   HIS   5           HA       HIS   5 -13.735  19.465  19.465
   35   1HB   HIS   5          2HB       HIS   5 -11.319  19.150  19.150
   36   2HB   HIS   5          1HB       HIS   5 -11.805  19.246  19.246
   37    HD1  HIS   5           HD1      HIS   5  -9.164  17.866  17.866
   38    HD2  HIS   5           HD2      HIS   5 -12.687  15.917  15.917
   39    HE1  HIS   5           HE1      HIS   5  -8.488  15.511  15.511
   40    HE2  HIS   5           HE2      HIS   5 -10.623  14.381  14.381
   41    H    HIS   6           H        HIS   6 -13.393  19.291  19.291
   42    HA   HIS   6           HA       HIS   6 -13.681  16.575  16.575
   43   1HB   HIS   6          2HB       HIS   6 -14.545  17.943  17.943
   44   2HB   HIS   6          1HB       HIS   6 -15.612  17.661  17.661
   45    HD1  HIS   6           HD1      HIS   6 -14.043  20.333  20.333
   46    HD2  HIS   6           HD2      HIS   6 -15.949  19.969  19.969
   47    HE1  HIS   6           HE1      HIS   6 -14.627  22.679  22.679
   48    HE2  HIS   6           HE2      HIS   6 -15.863  22.425  22.425
   49    H    HIS   7           H        HIS   7 -11.346  16.374  16.374
   50    HA   HIS   7           HA       HIS   7  -9.583  18.087  18.087
   51   1HB   HIS   7          2HB       HIS   7  -9.437  15.325  15.325
   52   2HB   HIS   7          1HB       HIS   7  -8.203  15.805  15.805
   53    HD1  HIS   7           HD1      HIS   7  -6.837  15.333  15.333
   54    HD2  HIS   7           HD2      HIS   7  -8.971  18.872  18.872
   55    HE1  HIS   7           HE1      HIS   7  -5.885  16.903  16.903
   56    HE2  HIS   7           HE2      HIS   7  -7.245  19.012  19.012
   57    H    HIS   8           H        HIS   8  -8.496  17.787  17.787
   58    HA   HIS   8           HA       HIS   8 -10.206  17.002  17.002
   59   1HB   HIS   8          2HB       HIS   8  -7.972  18.615  18.615
   60   2HB   HIS   8          1HB       HIS   8  -7.382  17.261  17.261
   61    HD1  HIS   8           HD1      HIS   8  -7.784  17.445  17.445
   62    HD2  HIS   8           HD2      HIS   8 -10.432  19.782  19.782
   63    HE1  HIS   8           HE1      HIS   8  -9.131  18.709  18.709
   64    HE2  HIS   8           HE2      HIS   8 -10.664  20.186  20.186
   65    H    HIS   9           H        HIS   9 -10.444  15.092  15.092
   66    HA   HIS   9           HA       HIS   9  -8.691  12.899  12.899
   67   1HB   HIS   9          2HB       HIS   9 -11.253  12.783  12.783
   68   2HB   HIS   9          1HB       HIS   9 -10.404  11.423  11.423
   69    HD1  HIS   9           HD1      HIS   9 -11.263  10.721  10.721
   70    HD2  HIS   9           HD2      HIS   9 -12.206  14.679  14.679
   71    HE1  HIS   9           HE1      HIS   9 -12.693  11.491  11.491
   72    HE2  HIS   9           HE2      HIS   9 -13.329  13.861  13.861
   73    H    HIS  10           H        HIS  10  -8.637  11.155  11.155
   74    HA   HIS  10           HA       HIS  10  -7.613  10.577  10.577
   75   1HB   HIS  10          2HB       HIS  10  -9.603  12.162  12.162
   76   2HB   HIS  10          1HB       HIS  10  -8.269  13.196  13.196
   77    HD1  HIS  10           HD1      HIS  10  -8.389  12.923  12.923
   78    HD2  HIS  10           HD2      HIS  10  -8.347   9.282   9.282
   79    HE1  HIS  10           HE1      HIS  10  -8.153  11.173  11.173
   80    HE2  HIS  10           HE2      HIS  10  -8.044   8.984   8.984
   81    H    THR  11           H        THR  11  -5.602  10.819  10.819
   82    HA   THR  11           HA       THR  11  -3.851  12.758  12.758
   83    HB   THR  11           HB       THR  11  -2.796  12.869  12.869
   84    HG1  THR  11           HG1      THR  11  -4.681  11.666  11.666
   85   1HG2  THR  11          3HG2      THR  11  -3.719  14.722  14.722
   86   2HG2  THR  11          2HG2      THR  11  -5.048  14.738  14.738
   87   3HG2  THR  11          1HG2      THR  11  -3.401  15.055  15.055
   88    H    ASP  12           H        ASP  12  -4.050  10.035  10.035
   89    HA   ASP  12           HA       ASP  12  -1.819   8.773   8.773
   90   1HB   ASP  12          2HB       ASP  12  -1.861   9.584   9.584
   91   2HB   ASP  12          1HB       ASP  12  -1.132   8.030   8.030
   92    HA   PRO  13           HA       PRO  13  -5.288   5.777   5.777
   93   1HB   PRO  13          2HB       PRO  13  -3.285   4.346   4.346
   94   2HB   PRO  13          1HB       PRO  13  -5.027   4.526   4.526
   95   1HG   PRO  13          2HG       PRO  13  -3.313   5.949   5.949
   96   2HG   PRO  13          1HG       PRO  13  -4.824   6.668   6.668
   97   1HD   PRO  13          2HD       PRO  13  -2.034   7.053   7.053
   98   2HD   PRO  13          1HD       PRO  13  -3.376   8.213   8.213
   99    H    MET  14           H        MET  14  -1.856   5.397   5.397
  100    HA   MET  14           HA       MET  14  -1.963   2.811   2.811
  101   1HB   MET  14          2HB       MET  14   0.040   5.046   5.046
  102   2HB   MET  14          1HB       MET  14   0.268   3.400   3.400
  103   1HG   MET  14          2HG       MET  14  -0.420   3.473   3.473
  104   2HG   MET  14          1HG       MET  14   1.019   4.428   4.428
  105   1HE   MET  14          1HE       MET  14  -0.774   1.270   1.270
  106   2HE   MET  14          3HE       MET  14   0.444  -0.006  -0.006
  107   3HE   MET  14          2HE       MET  14   0.377   1.120   1.120
  108    H    SER  15           H        SER  15  -2.539   6.020   6.020
  109    HA   SER  15           HA       SER  15  -2.270   5.526   5.526
  110   1HB   SER  15          2HB       SER  15  -3.397   7.576   7.576
  111   2HB   SER  15          1HB       SER  15  -2.571   7.773   7.773
  112    HG   SER  15           HG       SER  15  -4.672   8.472   8.472
  113    H    ALA  16           H        ALA  16  -5.213   5.500   5.500
  114    HA   ALA  16           HA       ALA  16  -6.488   3.824   3.824
  115   1HB   ALA  16          2HB       ALA  16  -7.471   6.121   6.121
  116   2HB   ALA  16          1HB       ALA  16  -8.597   4.774   4.774
  117   3HB   ALA  16          3HB       ALA  16  -7.934   5.553   5.553
  118    H    ILE  17           H        ILE  17  -5.760   1.872   1.872
  119    HA   ILE  17           HA       ILE  17  -6.679   1.241   1.241
  120    HB   ILE  17           HB       ILE  17  -4.920  -0.445  -0.445
  121   1HG1  ILE  17          2HG1      ILE  17  -3.995   1.330   1.330
  122   2HG1  ILE  17          1HG1      ILE  17  -4.003   1.865   1.865
  123   1HG2  ILE  17          2HG2      ILE  17  -6.251  -1.341  -1.341
  124   2HG2  ILE  17          1HG2      ILE  17  -4.955  -0.561  -0.561
  125   3HG2  ILE  17          3HG2      ILE  17  -4.575  -1.821  -1.821
  126   1HD1  ILE  17          1HD1      ILE  17  -2.626  -0.317  -0.317
  127   2HD1  ILE  17          3HD1      ILE  17  -2.294  -0.171  -0.171
  128   3HD1  ILE  17          2HD1      ILE  17  -1.848   1.136   1.136
  129    H    GLN  18           H        GLN  18  -8.917   1.116   1.116
  130    HA   GLN  18           HA       GLN  18  -9.541  -1.483  -1.483
  131   1HB   GLN  18          2HB       GLN  18  -9.974   0.213   0.213
  132   2HB   GLN  18          1HB       GLN  18 -10.927   1.149   1.149
  133   1HG   GLN  18          2HG       GLN  18 -12.681  -0.391  -0.391
  134   2HG   GLN  18          1HG       GLN  18 -11.685  -1.647  -1.647
  135   1HE2  GLN  18          2HE2      GLN  18 -13.071   1.406   1.406
  136   2HE2  GLN  18          1HE2      GLN  18 -12.711   1.682   1.682
  137    H    ASN  19           H        ASN  19 -11.589  -2.391  -2.391
  138    HA   ASN  19           HA       ASN  19 -12.624  -1.284  -1.284
  139   1HB   ASN  19          2HB       ASN  19 -11.990  -4.163  -4.163
  140   2HB   ASN  19          1HB       ASN  19 -12.983  -3.686  -3.686
  141   1HD2  ASN  19          2HD2      ASN  19 -10.324  -2.744  -2.744
  142   2HD2  ASN  19          1HD2      ASN  19 -12.035  -2.834  -2.834
  143    H    LEU  20           H        LEU  20 -13.891  -0.521  -0.521
  144    HA   LEU  20           HA       LEU  20 -15.922  -0.424  -0.424
  145   1HB   LEU  20          2HB       LEU  20 -16.503  -2.065  -2.065
  146   2HB   LEU  20          1HB       LEU  20 -17.742  -1.903  -1.903
  147    HG   LEU  20           HG       LEU  20 -18.117  -0.264  -0.264
  148   1HD1  LEU  20          1HD1      LEU  20 -18.144   0.277   0.277
  149   2HD1  LEU  20          3HD1      LEU  20 -16.964   1.479   1.479
  150   3HD1  LEU  20          2HD1      LEU  20 -18.580   1.465   1.465
  151   1HD2  LEU  20          1HD2      LEU  20 -15.583  -0.253  -0.253
  152   2HD2  LEU  20          3HD2      LEU  20 -16.544   1.205   1.205
  153   3HD2  LEU  20          2HD2      LEU  20 -15.506   1.067   1.067
  154    H    HIS  21           H        HIS  21 -16.241  -3.781  -3.781
  155    HA   HIS  21           HA       HIS  21 -15.597  -4.823  -4.823
  156   1HB   HIS  21          2HB       HIS  21 -17.758  -5.808  -5.808
  157   2HB   HIS  21          1HB       HIS  21 -17.956  -4.072  -4.072
  158    HD1  HIS  21           HD1      HIS  21 -18.197  -3.856  -3.856
  159    HD2  HIS  21           HD2      HIS  21 -20.071  -6.810  -6.810
  160    HE1  HIS  21           HE1      HIS  21 -20.135  -4.633  -4.633
  161    HE2  HIS  21           HE2      HIS  21 -21.311  -6.352  -6.352
  162    H    SER  22           H        SER  22 -15.602  -7.178  -7.178
  163    HA   SER  22           HA       SER  22 -15.403  -8.361  -8.361
  164   1HB   SER  22          2HB       SER  22 -13.523  -8.408  -8.408
  165   2HB   SER  22          1HB       SER  22 -13.740  -9.937  -9.937
  166    HG   SER  22           HG       SER  22 -12.404  -7.709  -7.709
  167    H    PHE  23           H        PHE  23 -16.114  -8.962  -8.962
  168    HA   PHE  23           HA       PHE  23 -16.880 -11.626 -11.626
  169   1HB   PHE  23          2HB       PHE  23 -18.126 -11.246 -11.246
  170   2HB   PHE  23          1HB       PHE  23 -16.605 -10.363 -10.363
  171    HD1  PHE  23           HD2      PHE  23 -20.243 -10.071 -10.071
  172    HD2  PHE  23           HD1      PHE  23 -16.560  -7.961  -7.961
  173    HE1  PHE  23           HE2      PHE  23 -21.475  -8.000  -8.000
  174    HE2  PHE  23           HE1      PHE  23 -17.785  -5.885  -5.885
  175    HZ   PHE  23           HZ       PHE  23 -20.245  -5.903  -5.903
  176    H    ASP  24           H        ASP  24 -18.569 -12.684 -12.684
  177    HA   ASP  24           HA       ASP  24 -21.181 -11.683 -11.683
  178   1HB   ASP  24          2HB       ASP  24 -19.395 -10.974 -10.974
  179   2HB   ASP  24          1HB       ASP  24 -20.772 -11.912 -11.912
  180    HA   PRO  25           HA       PRO  25 -21.716 -16.097 -16.097
  181   1HB   PRO  25          2HB       PRO  25 -24.344 -15.377 -15.377
  182   2HB   PRO  25          1HB       PRO  25 -23.983 -16.410 -16.410
  183   1HG   PRO  25          2HG       PRO  25 -24.975 -13.960 -13.960
  184   2HG   PRO  25          1HG       PRO  25 -23.746 -14.613 -14.613
  185   1HD   PRO  25          2HD       PRO  25 -23.456 -12.611 -12.611
  186   2HD   PRO  25          1HD       PRO  25 -22.644 -12.685 -12.685
  187    H    PHE  26           H        PHE  26 -22.378 -13.992 -13.992
  188    HA   PHE  26           HA       PHE  26 -21.848 -16.243 -16.243
  189   1HB   PHE  26          2HB       PHE  26 -22.987 -14.626 -14.626
  190   2HB   PHE  26          1HB       PHE  26 -23.988 -15.546 -15.546
  191    HD1  PHE  26           HD2      PHE  26 -24.834 -14.406 -14.406
  192    HD2  PHE  26           HD1      PHE  26 -23.039 -12.287 -12.287
  193    HE1  PHE  26           HE2      PHE  26 -25.851 -12.317 -12.317
  194    HE2  PHE  26           HE1      PHE  26 -24.051 -10.194 -10.194
  195    HZ   PHE  26           HZ       PHE  26 -25.460 -10.208 -10.208
  196    H    ALA  27           H        ALA  27 -19.714 -14.959 -14.959
  197    HA   ALA  27           HA       ALA  27 -18.220 -14.139 -14.139
  198   1HB   ALA  27          1HB       ALA  27 -19.654 -12.077 -12.077
  199   2HB   ALA  27          3HB       ALA  27 -18.433 -11.919 -11.919
  200   3HB   ALA  27          2HB       ALA  27 -17.957 -11.869 -11.869
  201    H    ASP  28           H        ASP  28 -17.901 -16.118 -16.118
  202    HA   ASP  28           HA       ASP  28 -16.317 -17.062 -17.062
  203   1HB   ASP  28          2HB       ASP  28 -14.841 -14.852 -14.852
  204   2HB   ASP  28          1HB       ASP  28 -14.069 -15.619 -15.619
  205    H    ALA  29           H        ALA  29 -16.688 -17.097 -17.097
  206    HA   ALA  29           HA       ALA  29 -16.066 -14.724 -14.724
  207   1HB   ALA  29          1HB       ALA  29 -18.495 -14.670 -14.670
  208   2HB   ALA  29          3HB       ALA  29 -18.653 -16.240 -16.240
  209   3HB   ALA  29          2HB       ALA  29 -18.128 -14.837 -14.837
  210    H    SER  30           H        SER  30 -14.504 -16.995 -16.995
  211    HA   SER  30           HA       SER  30 -14.219 -17.783 -17.783
  212   1HB   SER  30          2HB       SER  30 -14.422 -20.318 -20.318
  213   2HB   SER  30          1HB       SER  30 -15.856 -19.408 -19.408
  214    HG   SER  30           HG       SER  30 -16.131 -20.610 -20.610
  215    H    LYS  31           H        LYS  31 -12.221 -18.698 -18.698
  216    HA   LYS  31           HA       LYS  31 -10.536 -19.851 -19.851
  217   1HB   LYS  31          2HB       LYS  31 -10.626 -17.004 -17.004
  218   2HB   LYS  31          1HB       LYS  31  -9.057 -17.478 -17.478
  219   1HG   LYS  31          2HG       LYS  31  -8.363 -18.318 -18.318
  220   2HG   LYS  31          1HG       LYS  31  -9.956 -18.956 -18.956
  221   1HD   LYS  31          2HD       LYS  31 -10.714 -16.800 -16.800
  222   2HD   LYS  31          1HD       LYS  31  -9.256 -16.025 -16.025
  223   1HE   LYS  31          2HE       LYS  31  -8.224 -16.354 -16.354
  224   2HE   LYS  31          1HE       LYS  31  -8.503 -18.090 -18.090
  225   1HZ   LYS  31          1HZ       LYS  31 -10.501 -16.162 -16.162
  226   2HZ   LYS  31          3HZ       LYS  31  -9.439 -17.043 -17.043
  227   3HZ   LYS  31          2HZ       LYS  31 -10.594 -17.850 -17.850
  228    H    GLY  32           H        GLY  32 -10.322 -21.293 -21.293
  229   1HA   GLY  32          2HA       GLY  32  -8.286 -20.434 -20.434
  230   2HA   GLY  32          1HA       GLY  32  -9.778 -21.113 -21.113
  231    H    ASP  33           H        ASP  33  -7.328 -21.886 -21.886
  232    HA   ASP  33           HA       ASP  33  -7.569 -24.712 -24.712
  233   1HB   ASP  33          2HB       ASP  33  -6.903 -23.320 -23.320
  234   2HB   ASP  33          1HB       ASP  33  -6.127 -24.871 -24.871
  235    H    ASP  34           H        ASP  34  -6.233 -24.490 -24.490
  236    HA   ASP  34           HA       ASP  34  -4.276 -24.663 -24.663
  237   1HB   ASP  34          2HB       ASP  34  -3.884 -26.202 -26.202
  238   2HB   ASP  34          1HB       ASP  34  -2.694 -24.964 -24.964
  239    H    LEU  35           H        LEU  35  -4.884 -22.212 -22.212
  240    HA   LEU  35           HA       LEU  35  -3.331 -20.352 -20.352
  241   1HB   LEU  35          2HB       LEU  35  -5.258 -20.315 -20.315
  242   2HB   LEU  35          1HB       LEU  35  -3.926 -19.249 -19.249
  243    HG   LEU  35           HG       LEU  35  -5.701 -18.020 -18.020
  244   1HD1  LEU  35          3HD1      LEU  35  -3.145 -17.673 -17.673
  245   2HD1  LEU  35          2HD1      LEU  35  -3.572 -18.199 -18.199
  246   3HD1  LEU  35          1HD1      LEU  35  -4.350 -16.779 -16.779
  247   1HD2  LEU  35          3HD2      LEU  35  -6.152 -20.270 -20.270
  248   2HD2  LEU  35          2HD2      LEU  35  -6.759 -18.674 -18.674
  249   3HD2  LEU  35          1HD2      LEU  35  -5.284 -19.294 -19.294
  250    H    LEU  36           H        LEU  36  -1.240 -19.902 -19.902
  251    HA   LEU  36           HA       LEU  36   0.497 -21.149 -21.149
  252   1HB   LEU  36          2HB       LEU  36   0.720 -19.296 -19.296
  253   2HB   LEU  36          1HB       LEU  36   1.913 -18.996 -18.996
  254    HG   LEU  36           HG       LEU  36   2.714 -21.293 -21.293
  255   1HD1  LEU  36          2HD1      LEU  36   0.321 -21.569 -21.569
  256   2HD1  LEU  36          1HD1      LEU  36   1.766 -22.464 -22.464
  257   3HD1  LEU  36          3HD1      LEU  36   1.052 -22.715 -22.715
  258   1HD2  LEU  36          2HD2      LEU  36   2.563 -19.638 -19.638
  259   2HD2  LEU  36          1HD2      LEU  36   3.919 -19.869 -19.869
  260   3HD2  LEU  36          3HD2      LEU  36   3.431 -21.172 -21.172
  261    HA   PRO  37           HA       PRO  37   0.394 -18.435 -18.435
  262   1HB   PRO  37          2HB       PRO  37   2.904 -18.737 -18.737
  263   2HB   PRO  37          1HB       PRO  37   1.675 -20.002 -20.002
  264   1HG   PRO  37          2HG       PRO  37   3.914 -19.720 -19.720
  265   2HG   PRO  37          1HG       PRO  37   3.359 -21.167 -21.167
  266   1HD   PRO  37          2HD       PRO  37   2.681 -20.649 -20.649
  267   2HD   PRO  37          1HD       PRO  37   1.605 -21.513 -21.513
  268    H    ALA  38           H        ALA  38   2.961 -18.058 -18.058
  269    HA   ALA  38           HA       ALA  38   3.867 -15.521 -15.521
  270   1HB   ALA  38          2HB       ALA  38   4.960 -17.336 -17.336
  271   2HB   ALA  38          1HB       ALA  38   4.289 -16.243 -16.243
  272   3HB   ALA  38          3HB       ALA  38   5.430 -15.636 -15.636
  273    H    GLY  39           H        GLY  39   1.915 -14.318 -14.318
  274   1HA   GLY  39          2HA       GLY  39   1.207 -12.921 -12.921
  275   2HA   GLY  39          1HA       GLY  39  -0.105 -13.841 -13.841
  276    H    THR  40           H        THR  40  -0.053 -13.444 -13.444
  277    HA   THR  40           HA       THR  40  -0.391 -10.550 -10.550
  278    HB   THR  40           HB       THR  40  -1.336 -11.733 -11.733
  279    HG1  THR  40           HG1      THR  40  -1.969 -13.665 -13.665
  280   1HG2  THR  40          3HG2      THR  40  -2.790 -10.970 -10.970
  281   2HG2  THR  40          2HG2      THR  40  -3.596 -11.429 -11.429
  282   3HG2  THR  40          1HG2      THR  40  -2.560 -10.003 -10.003
  283    H    GLU  41           H        GLU  41   1.504 -13.204 -13.204
  284    HA   GLU  41           HA       GLU  41   3.310 -13.314 -13.314
  285   1HB   GLU  41          2HB       GLU  41   3.422 -10.713 -10.713
  286   2HB   GLU  41          1HB       GLU  41   4.117 -10.659 -10.659
  287   1HG   GLU  41          2HG       GLU  41   4.901 -12.704 -12.704
  288   2HG   GLU  41          1HG       GLU  41   5.710 -11.147 -11.147
  289    H    ASP  42           H        ASP  42   0.507 -12.458 -12.458
  290    HA   ASP  42           HA       ASP  42  -0.492 -11.840 -11.840
  291   1HB   ASP  42          2HB       ASP  42   1.886 -13.477 -13.477
  292   2HB   ASP  42          1HB       ASP  42   0.958 -12.708 -12.708
  293    H    TYR  43           H        TYR  43   0.240  -9.578  -9.578
  294    HA   TYR  43           HA       TYR  43   2.318  -8.220  -8.220
  295   1HB   TYR  43          2HB       TYR  43  -0.200  -7.050  -7.050
  296   2HB   TYR  43          1HB       TYR  43   1.281  -6.175  -6.175
  297    HD1  TYR  43           HD1      TYR  43   3.138  -8.454  -8.454
  298    HD2  TYR  43           HD2      TYR  43  -0.243  -6.438  -6.438
  299    HE1  TYR  43           HE1      TYR  43   3.971  -8.891  -8.891
  300    HE2  TYR  43           HE2      TYR  43   0.581  -6.880  -6.880
  301    HH   TYR  43           HH       TYR  43   2.870  -7.330  -7.330
  302    H    ILE  44           H        ILE  44   1.701  -6.134  -6.134
  303    HA   ILE  44           HA       ILE  44  -0.113  -6.961  -6.961
  304    HB   ILE  44           HB       ILE  44   2.333  -5.193  -5.193
  305   1HG1  ILE  44          2HG1      ILE  44   3.117  -7.405  -7.405
  306   2HG1  ILE  44          1HG1      ILE  44   3.030  -7.048  -7.048
  307   1HG2  ILE  44          1HG2      ILE  44   0.329  -5.958  -5.958
  308   2HG2  ILE  44          3HG2      ILE  44   1.901  -5.237  -5.237
  309   3HG2  ILE  44          2HG2      ILE  44   0.705  -4.339  -4.339
  310   1HD1  ILE  44          1HD1      ILE  44   0.754  -8.164  -8.164
  311   2HD1  ILE  44          3HD1      ILE  44   1.194  -8.754  -8.754
  312   3HD1  ILE  44          2HD1      ILE  44   2.163  -9.205  -9.205
  313    H    HIS  45           H        HIS  45  -1.977  -6.002  -6.002
  314    HA   HIS  45           HA       HIS  45  -2.240  -3.516  -3.516
  315   1HB   HIS  45          2HB       HIS  45  -3.971  -5.546  -5.546
  316   2HB   HIS  45          1HB       HIS  45  -4.559  -3.990  -3.990
  317    HD1  HIS  45           HD1      HIS  45  -3.473  -5.557  -5.557
  318    HD2  HIS  45           HD2      HIS  45  -6.104  -2.702  -2.702
  319    HE1  HIS  45           HE1      HIS  45  -4.800  -4.773  -4.773
  320    HE2  HIS  45           HE2      HIS  45  -6.312  -2.969  -2.969
  321    H    ILE  46           H        ILE  46  -2.559  -1.492  -1.492
  322    HA   ILE  46           HA       ILE  46  -2.683  -0.901  -0.901
  323    HB   ILE  46           HB       ILE  46  -0.550   0.076   0.076
  324   1HG1  ILE  46          2HG1      ILE  46  -0.736  -1.821  -1.821
  325   2HG1  ILE  46          1HG1      ILE  46   0.670  -1.407  -1.407
  326   1HG2  ILE  46          3HG2      ILE  46  -1.445   1.338   1.338
  327   2HG2  ILE  46          2HG2      ILE  46   0.083   1.700   1.700
  328   3HG2  ILE  46          1HG2      ILE  46  -1.447   2.074   2.074
  329   1HD1  ILE  46          2HD1      ILE  46  -0.096   0.232   0.232
  330   2HD1  ILE  46          1HD1      ILE  46   0.824  -1.261  -1.261
  331   3HD1  ILE  46          3HD1      ILE  46   1.477   0.068   0.068
  332    H    ARG  47           H        ARG  47  -4.558   0.131   0.131
  333    HA   ARG  47           HA       ARG  47  -5.082   2.226   2.226
  334   1HB   ARG  47          2HB       ARG  47  -6.899   0.198   0.198
  335   2HB   ARG  47          1HB       ARG  47  -7.556   1.733   1.733
  336   1HG   ARG  47          2HG       ARG  47  -6.855   1.312   1.312
  337   2HG   ARG  47          1HG       ARG  47  -5.950  -0.118  -0.118
  338   1HD   ARG  47          2HD       ARG  47  -8.084  -0.715  -0.715
  339   2HD   ARG  47          1HD       ARG  47  -8.015  -1.225  -1.225
  340    HE   ARG  47           HE       ARG  47  -9.209   1.249   1.249
  341   1HH1  ARG  47          2HH1      ARG  47  -9.868  -1.833  -1.833
  342   2HH1  ARG  47          1HH1      ARG  47 -11.586  -1.608  -1.608
  343   1HH2  ARG  47          1HH2      ARG  47 -11.468   1.546   1.546
  344   2HH2  ARG  47          2HH2      ARG  47 -12.494   0.310   0.310
  345    H    ILE  48           H        ILE  48  -6.264   4.062   4.062
  346    HA   ILE  48           HA       ILE  48  -5.967   4.706   4.706
  347    HB   ILE  48           HB       ILE  48  -5.736   6.366   6.366
  348   1HG1  ILE  48          2HG1      ILE  48  -4.132   6.294   6.294
  349   2HG1  ILE  48          1HG1      ILE  48  -3.718   5.434   5.434
  350   1HG2  ILE  48          3HG2      ILE  48  -6.448   7.431   7.431
  351   2HG2  ILE  48          2HG2      ILE  48  -5.811   8.416   8.416
  352   3HG2  ILE  48          1HG2      ILE  48  -7.368   7.609   7.609
  353   1HD1  ILE  48          2HD1      ILE  48  -4.086   8.401   8.401
  354   2HD1  ILE  48          1HD1      ILE  48  -2.560   7.667   7.667
  355   3HD1  ILE  48          3HD1      ILE  48  -3.185   7.390   7.390
  356    H    GLN  49           H        GLN  49  -7.627   6.050   6.050
  357    HA   GLN  49           HA       GLN  49 -10.194   6.090   6.090
  358   1HB   GLN  49          2HB       GLN  49 -11.381   5.223   5.223
  359   2HB   GLN  49          1HB       GLN  49 -10.211   4.053   4.053
  360   1HG   GLN  49          2HG       GLN  49  -8.670   5.167   5.167
  361   2HG   GLN  49          1HG       GLN  49 -10.215   5.631   5.631
  362   1HE2  GLN  49          2HE2      GLN  49 -11.216   2.190   2.190
  363   2HE2  GLN  49          1HE2      GLN  49 -11.838   3.656   3.656
  364    H    GLN  50           H        GLN  50  -9.946   8.319   8.319
  365    HA   GLN  50           HA       GLN  50  -9.662   9.921   9.921
  366   1HB   GLN  50          2HB       GLN  50  -8.779  10.276  10.276
  367   2HB   GLN  50          1HB       GLN  50 -10.178  11.340  11.340
  368   1HG   GLN  50          2HG       GLN  50  -9.266  12.577  12.577
  369   2HG   GLN  50          1HG       GLN  50  -7.989  11.392  11.392
  370   1HE2  GLN  50          2HE2      GLN  50  -5.933  13.579  13.579
  371   2HE2  GLN  50          1HE2      GLN  50  -6.339  12.860  12.860
  372    H    ARG  51           H        ARG  51 -11.445  10.178  10.178
  373    HA   ARG  51           HA       ARG  51 -14.061  10.232  10.232
  374   1HB   ARG  51          2HB       ARG  51 -13.007   9.730   9.730
  375   2HB   ARG  51          1HB       ARG  51 -14.166  11.046  11.046
  376   1HG   ARG  51          2HG       ARG  51 -15.392   9.081   9.081
  377   2HG   ARG  51          1HG       ARG  51 -15.773   9.578   9.578
  378   1HD   ARG  51          2HD       ARG  51 -14.429   7.903   7.903
  379   2HD   ARG  51          1HD       ARG  51 -13.576   7.621   7.621
  380    HE   ARG  51           HE       ARG  51 -16.307   7.038   7.038
  381   1HH1  ARG  51          2HH1      ARG  51 -13.467   5.795   5.795
  382   2HH1  ARG  51          1HH1      ARG  51 -14.006   4.150   4.150
  383   1HH2  ARG  51          1HH2      ARG  51 -17.019   4.874   4.874
  384   2HH2  ARG  51          2HH2      ARG  51 -16.022   3.627   3.627
  385    H    ASN  52           H        ASN  52 -14.977  11.996  11.996
  386    HA   ASN  52           HA       ASN  52 -15.561  14.165  14.165
  387   1HB   ASN  52          2HB       ASN  52 -15.789  14.037  14.037
  388   2HB   ASN  52          1HB       ASN  52 -14.284  14.950  14.950
  389   1HD2  ASN  52          1HD2      ASN  52 -16.019  16.317  16.317
  390   2HD2  ASN  52          2HD2      ASN  52 -16.788  17.517  17.517
  391    H    GLY  53           H        GLY  53 -12.819  13.037  13.037
  392   1HA   GLY  53          2HA       GLY  53 -10.971  13.807  13.807
  393   2HA   GLY  53          1HA       GLY  53 -11.713  15.398  15.398
  394    H    ARG  54           H        ARG  54 -11.163  13.741  13.741
  395    HA   ARG  54           HA       ARG  54  -8.696  15.240  15.240
  396   1HB   ARG  54          2HB       ARG  54 -10.993  15.389  15.389
  397   2HB   ARG  54          1HB       ARG  54  -9.467  16.260  16.260
  398   1HG   ARG  54          2HG       ARG  54 -10.393  17.087  17.087
  399   2HG   ARG  54          1HG       ARG  54 -11.906  16.843  16.843
  400   1HD   ARG  54          2HD       ARG  54 -11.605  18.771  18.771
  401   2HD   ARG  54          1HD       ARG  54 -10.102  18.161  18.161
  402    HE   ARG  54           HE       ARG  54  -9.340  18.938  18.938
  403   1HH1  ARG  54          2HH1      ARG  54 -11.148  20.547  20.547
  404   2HH1  ARG  54          1HH1      ARG  54 -10.606  22.128  22.128
  405   1HH2  ARG  54          1HH2      ARG  54  -8.627  21.019  21.019
  406   2HH2  ARG  54          2HH2      ARG  54  -9.176  22.397  22.397
  407    H    LYS  55           H        LYS  55 -11.026  13.359  13.359
  408    HA   LYS  55           HA       LYS  55  -9.096  12.118  12.118
  409   1HB   LYS  55          2HB       LYS  55 -11.485  12.206  12.206
  410   2HB   LYS  55          1HB       LYS  55 -11.846  11.107  11.107
  411   1HG   LYS  55          2HG       LYS  55 -11.823   9.961   9.961
  412   2HG   LYS  55          1HG       LYS  55 -10.569   9.348   9.348
  413   1HD   LYS  55          2HD       LYS  55  -9.713   9.623   9.623
  414   2HD   LYS  55          1HD       LYS  55  -8.906  10.726  10.726
  415   1HE   LYS  55          2HE       LYS  55 -10.034  12.587  12.587
  416   2HE   LYS  55          1HE       LYS  55 -11.305  11.608  11.608
  417   1HZ   LYS  55          1HZ       LYS  55  -9.187  10.724  10.724
  418   2HZ   LYS  55          3HZ       LYS  55  -8.684  12.311  12.311
  419   3HZ   LYS  55          2HZ       LYS  55 -10.131  12.024  12.024
  420    H    THR  56           H        THR  56  -7.449  11.489  11.489
  421    HA   THR  56           HA       THR  56  -8.017   9.349   9.349
  422    HB   THR  56           HB       THR  56  -5.208  10.017  10.017
  423    HG1  THR  56           HG1      THR  56  -5.283  12.106  12.106
  424   1HG2  THR  56          2HG2      THR  56  -6.850   9.261   9.261
  425   2HG2  THR  56          1HG2      THR  56  -6.130  10.821  10.821
  426   3HG2  THR  56          3HG2      THR  56  -5.096   9.456   9.456
  427    H    LEU  57           H        LEU  57  -7.421   7.241   7.241
  428    HA   LEU  57           HA       LEU  57  -5.842   6.439   6.439
  429   1HB   LEU  57          2HB       LEU  57  -8.686   6.027   6.027
  430   2HB   LEU  57          1HB       LEU  57  -7.844   4.492   4.492
  431    HG   LEU  57           HG       LEU  57  -6.694   5.501   5.501
  432   1HD1  LEU  57          1HD1      LEU  57  -8.821   7.498   7.498
  433   2HD1  LEU  57          3HD1      LEU  57  -8.460   7.097   7.097
  434   3HD1  LEU  57          2HD1      LEU  57  -7.190   7.731   7.731
  435   1HD2  LEU  57          1HD2      LEU  57  -9.303   4.265   4.265
  436   2HD2  LEU  57          3HD2      LEU  57  -8.015   3.884   3.884
  437   3HD2  LEU  57          2HD2      LEU  57  -9.172   5.164   5.164
  438    H    THR  58           H        THR  58  -4.201   5.937   5.937
  439    HA   THR  58           HA       THR  58  -4.533   4.310   4.310
  440    HB   THR  58           HB       THR  58  -2.068   4.685   4.685
  441    HG1  THR  58           HG1      THR  58  -3.219   6.567   6.567
  442   1HG2  THR  58          1HG2      THR  58  -2.332   2.893   2.893
  443   2HG2  THR  58          3HG2      THR  58  -1.740   4.323   4.323
  444   3HG2  THR  58          2HG2      THR  58  -0.821   3.651   3.651
  445    H    THR  59           H        THR  59  -5.219   2.279   2.279
  446    HA   THR  59           HA       THR  59  -4.640   0.520   0.520
  447    HB   THR  59           HB       THR  59  -6.261  -0.923  -0.923
  448    HG1  THR  59           HG1      THR  59  -7.148   1.770   1.770
  449   1HG2  THR  59          1HG2      THR  59  -6.496   0.259   0.259
  450   2HG2  THR  59          3HG2      THR  59  -7.975   0.600   0.600
  451   3HG2  THR  59          2HG2      THR  59  -7.430  -1.066  -1.066
  452    H    VAL  60           H        VAL  60  -4.192  -1.808  -1.808
  453    HA   VAL  60           HA       VAL  60  -2.593  -2.054  -2.054
  454    HB   VAL  60           HB       VAL  60  -1.651  -2.989  -2.989
  455   1HG1  VAL  60          1HG1      VAL  60  -0.497  -3.207  -3.207
  456   2HG1  VAL  60          3HG1      VAL  60   0.500  -3.348  -3.348
  457   3HG1  VAL  60          2HG1      VAL  60  -0.807  -4.496  -4.496
  458   1HG2  VAL  60          1HG2      VAL  60  -1.078  -0.562  -0.562
  459   2HG2  VAL  60          3HG2      VAL  60  -1.268  -0.730  -0.730
  460   3HG2  VAL  60          2HG2      VAL  60   0.218  -1.273  -1.273
  461    H    GLN  61           H        GLN  61  -2.956  -3.874  -3.874
  462    HA   GLN  61           HA       GLN  61  -4.192  -6.139  -6.139
  463   1HB   GLN  61          2HB       GLN  61  -4.917  -6.071  -6.071
  464   2HB   GLN  61          1HB       GLN  61  -5.948  -6.191  -6.191
  465   1HG   GLN  61          2HG       GLN  61  -6.055  -3.822  -3.822
  466   2HG   GLN  61          1HG       GLN  61  -4.822  -3.603  -3.603
  467   1HE2  GLN  61          2HE2      GLN  61  -8.297  -5.150  -5.150
  468   2HE2  GLN  61          1HE2      GLN  61  -7.479  -5.897  -5.897
  469    H    GLY  62           H        GLY  62  -3.473  -8.159  -8.159
  470   1HA   GLY  62          2HA       GLY  62  -2.378  -9.632  -9.632
  471   2HA   GLY  62          1HA       GLY  62  -1.327  -8.281  -8.281
  472    H    ILE  63           H        ILE  63  -1.198  -7.583  -7.583
  473    HA   ILE  63           HA       ILE  63   1.173  -9.033  -9.033
  474    HB   ILE  63           HB       ILE  63  -0.474  -7.050  -7.050
  475   1HG1  ILE  63          2HG1      ILE  63   0.725  -5.820  -5.820
  476   2HG1  ILE  63          1HG1      ILE  63   1.883  -5.866  -5.866
  477   1HG2  ILE  63          1HG2      ILE  63   1.529  -8.874  -8.874
  478   2HG2  ILE  63          3HG2      ILE  63   1.911  -7.183  -7.183
  479   3HG2  ILE  63          2HG2      ILE  63   0.373  -7.854  -7.854
  480   1HD1  ILE  63          2HD1      ILE  63   2.764  -7.983  -7.983
  481   2HD1  ILE  63          1HD1      ILE  63   1.932  -7.273  -7.273
  482   3HD1  ILE  63          3HD1      ILE  63   3.205  -6.370  -6.370
  483    H    ALA  64           H        ALA  64   1.575 -10.507 -10.507
  484    HA   ALA  64           HA       ALA  64  -0.712 -12.195 -12.195
  485   1HB   ALA  64          1HB       ALA  64   1.584 -12.967 -12.967
  486   2HB   ALA  64          3HB       ALA  64   2.102 -12.862 -12.862
  487   3HB   ALA  64          2HB       ALA  64   0.776 -13.934 -13.934
  488    H    ASP  65           H        ASP  65  -1.609 -12.363 -12.363
  489    HA   ASP  65           HA       ASP  65  -1.049 -10.565 -10.565
  490   1HB   ASP  65          2HB       ASP  65  -2.469 -12.123 -12.123
  491   2HB   ASP  65          1HB       ASP  65  -3.220 -11.548 -11.548
  492    H    ASP  66           H        ASP  66   0.414 -13.562 -13.562
  493    HA   ASP  66           HA       ASP  66   1.423 -14.377 -14.377
  494   1HB   ASP  66          2HB       ASP  66   1.419 -15.616 -15.616
  495   2HB   ASP  66          1HB       ASP  66   2.925 -14.755 -14.755
  496    H    TYR  67           H        TYR  67   2.290 -11.755 -11.755
  497    HA   TYR  67           HA       TYR  67   4.967 -11.355 -11.355
  498   1HB   TYR  67          2HB       TYR  67   2.737  -9.341  -9.341
  499   2HB   TYR  67          1HB       TYR  67   4.436  -8.897  -8.897
  500    HD1  TYR  67           HD1      TYR  67   4.042 -12.036 -12.036
  501    HD2  TYR  67           HD2      TYR  67   3.690  -7.842  -7.842
  502    HE1  TYR  67           HE1      TYR  67   4.220 -12.378 -12.378
  503    HE2  TYR  67           HE2      TYR  67   3.866  -8.167  -8.167
  504    HH   TYR  67           HH       TYR  67   3.554  -9.883  -9.883
  505    H    ASP  68           H        ASP  68   5.630  -9.237  -9.237
  506    HA   ASP  68           HA       ASP  68   5.672  -9.963  -9.963
  507   1HB   ASP  68          2HB       ASP  68   6.161  -7.387  -7.387
  508   2HB   ASP  68          1HB       ASP  68   6.112  -7.381  -7.381
  509    H    LYS  69           H        LYS  69   3.209  -8.256  -8.256
  510    HA   LYS  69           HA       LYS  69   1.143  -7.511  -7.511
  511   1HB   LYS  69          2HB       LYS  69   0.798  -9.732  -9.732
  512   2HB   LYS  69          1HB       LYS  69   1.616  -9.301  -9.301
  513   1HG   LYS  69          2HG       LYS  69  -0.308  -8.660  -8.660
  514   2HG   LYS  69          1HG       LYS  69  -0.504  -7.457  -7.457
  515   1HD   LYS  69          2HD       LYS  69  -2.431  -8.841  -8.841
  516   2HD   LYS  69          1HD       LYS  69  -1.429  -9.306  -9.306
  517   1HE   LYS  69          2HE       LYS  69  -1.129 -11.381 -11.381
  518   2HE   LYS  69          1HE       LYS  69  -0.824 -10.811 -10.811
  519   1HZ   LYS  69          1HZ       LYS  69  -3.415 -10.391 -10.391
  520   2HZ   LYS  69          3HZ       LYS  69  -3.326 -11.658 -11.658
  521   3HZ   LYS  69          2HZ       LYS  69  -2.771 -11.884 -11.884
  522    H    LYS  70           H        LYS  70   2.312  -7.769  -7.769
  523    HA   LYS  70           HA       LYS  70   1.445  -5.237  -5.237
  524   1HB   LYS  70          2HB       LYS  70   3.504  -7.127  -7.127
  525   2HB   LYS  70          1HB       LYS  70   3.210  -5.564  -5.564
  526   1HG   LYS  70          2HG       LYS  70   1.767  -6.792  -6.792
  527   2HG   LYS  70          1HG       LYS  70   0.695  -6.425  -6.425
  528   1HD   LYS  70          2HD       LYS  70   0.731  -8.556  -8.556
  529   2HD   LYS  70          1HD       LYS  70   2.400  -8.826  -8.826
  530   1HE   LYS  70          2HE       LYS  70   1.356 -10.167 -10.167
  531   2HE   LYS  70          1HE       LYS  70   1.297  -8.650  -8.650
  532   1HZ   LYS  70          1HZ       LYS  70  -0.905  -9.520  -9.520
  533   2HZ   LYS  70          3HZ       LYS  70  -0.837  -9.958  -9.958
  534   3HZ   LYS  70          2HZ       LYS  70  -0.939  -8.327  -8.327
  535    H    LYS  71           H        LYS  71   4.708  -6.321  -6.321
  536    HA   LYS  71           HA       LYS  71   5.802  -3.676  -3.676
  537   1HB   LYS  71          2HB       LYS  71   6.835  -6.264  -6.264
  538   2HB   LYS  71          1HB       LYS  71   7.332  -5.572  -5.572
  539   1HG   LYS  71          2HG       LYS  71   7.770  -4.166  -4.166
  540   2HG   LYS  71          1HG       LYS  71   8.931  -5.311  -5.311
  541   1HD   LYS  71          2HD       LYS  71   8.132  -3.425  -3.425
  542   2HD   LYS  71          1HD       LYS  71   8.679  -2.568  -2.568
  543   1HE   LYS  71          2HE       LYS  71  10.576  -4.503  -4.503
  544   2HE   LYS  71          1HE       LYS  71  10.188  -4.199  -4.199
  545   1HZ   LYS  71          1HZ       LYS  71  10.912  -2.085  -2.085
  546   2HZ   LYS  71          3HZ       LYS  71  12.000  -2.792  -2.792
  547   3HZ   LYS  71          2HZ       LYS  71  10.692  -1.892  -1.892
  548    H    LEU  72           H        LEU  72   4.145  -5.560  -5.560
  549    HA   LEU  72           HA       LEU  72   5.120  -4.566  -4.566
  550   1HB   LEU  72          2HB       LEU  72   3.125  -6.258  -6.258
  551   2HB   LEU  72          1HB       LEU  72   2.185  -4.867  -4.867
  552    HG   LEU  72           HG       LEU  72   2.546  -6.548  -6.548
  553   1HD1  LEU  72          1HD1      LEU  72   2.400  -3.897  -3.897
  554   2HD1  LEU  72          3HD1      LEU  72   3.991  -4.139  -4.139
  555   3HD1  LEU  72          2HD1      LEU  72   2.583  -4.953  -4.953
  556   1HD2  LEU  72          1HD2      LEU  72   4.897  -7.081  -7.081
  557   2HD2  LEU  72          3HD2      LEU  72   4.665  -6.928  -6.928
  558   3HD2  LEU  72          2HD2      LEU  72   5.400  -5.609  -5.609
  559    H    VAL  73           H        VAL  73   2.257  -3.348  -3.348
  560    HA   VAL  73           HA       VAL  73   2.326  -0.894  -0.894
  561    HB   VAL  73           HB       VAL  73   0.178  -1.999  -1.999
  562   1HG1  VAL  73          1HG1      VAL  73   0.895  -2.692  -2.692
  563   2HG1  VAL  73          3HG1      VAL  73   0.655  -1.019  -1.019
  564   3HG1  VAL  73          2HG1      VAL  73  -0.709  -1.965  -1.965
  565   1HG2  VAL  73          1HG2      VAL  73   0.702   0.621   0.621
  566   2HG2  VAL  73          3HG2      VAL  73  -0.922  -0.027  -0.027
  567   3HG2  VAL  73          2HG2      VAL  73  -0.018   0.602   0.602
  568    H    LYS  74           H        LYS  74   2.999  -1.945  -1.945
  569    HA   LYS  74           HA       LYS  74   3.198   0.511   0.511
  570   1HB   LYS  74          2HB       LYS  74   3.342  -1.608  -1.608
  571   2HB   LYS  74          1HB       LYS  74   4.884  -1.959  -1.959
  572   1HG   LYS  74          2HG       LYS  74   5.977  -0.852  -0.852
  573   2HG   LYS  74          1HG       LYS  74   5.009   0.596   0.596
  574   1HD   LYS  74          2HD       LYS  74   4.731  -0.036  -0.036
  575   2HD   LYS  74          1HD       LYS  74   3.229  -0.406  -0.406
  576   1HE   LYS  74          2HE       LYS  74   5.034  -2.651  -2.651
  577   2HE   LYS  74          1HE       LYS  74   4.769  -2.133  -2.133
  578   1HZ   LYS  74          1HZ       LYS  74   2.417  -2.350  -2.350
  579   2HZ   LYS  74          3HZ       LYS  74   3.151  -3.798  -3.798
  580   3HZ   LYS  74          2HZ       LYS  74   2.597  -2.709  -2.709
  581    H    ALA  75           H        ALA  75   5.634  -1.230  -1.230
  582    HA   ALA  75           HA       ALA  75   7.759   0.563   0.563
  583   1HB   ALA  75          2HB       ALA  75   7.139  -1.452  -1.452
  584   2HB   ALA  75          1HB       ALA  75   8.550  -0.402  -0.402
  585   3HB   ALA  75          3HB       ALA  75   8.389  -1.494  -1.494
  586    H    PHE  76           H        PHE  76   5.010   0.611   0.611
  587    HA   PHE  76           HA       PHE  76   5.906   2.538   2.538
  588   1HB   PHE  76          2HB       PHE  76   3.757   1.035   1.035
  589   2HB   PHE  76          1HB       PHE  76   3.031   2.409   2.409
  590    HD1  PHE  76           HD1      PHE  76   4.561   1.252   1.252
  591    HD2  PHE  76           HD2      PHE  76   2.576   4.453   4.453
  592    HE1  PHE  76           HE1      PHE  76   4.221   2.370   2.370
  593    HE2  PHE  76           HE2      PHE  76   2.230   5.576   5.576
  594    HZ   PHE  76           HZ       PHE  76   3.052   4.536   4.536
  595    H    LYS  77           H        LYS  77   4.197   2.844   2.844
  596    HA   LYS  77           HA       LYS  77   3.960   5.681   5.681
  597   1HB   LYS  77          2HB       LYS  77   3.688   3.696   3.696
  598   2HB   LYS  77          1HB       LYS  77   3.491   5.425   5.425
  599   1HG   LYS  77          2HG       LYS  77   1.561   5.511   5.511
  600   2HG   LYS  77          1HG       LYS  77   1.901   3.962   3.962
  601   1HD   LYS  77          2HD       LYS  77   1.374   4.194   4.194
  602   2HD   LYS  77          1HD       LYS  77   0.068   4.009   4.009
  603   1HE   LYS  77          2HE       LYS  77   1.667   2.019   2.019
  604   2HE   LYS  77          1HE       LYS  77   2.114   2.069   2.069
  605   1HZ   LYS  77          2HZ       LYS  77  -0.643   2.203   2.203
  606   2HZ   LYS  77          1HZ       LYS  77  -0.225   1.013   1.013
  607   3HZ   LYS  77          3HZ       LYS  77   0.303   0.884   0.884
  608    H    LYS  78           H        LYS  78   6.615   3.694   3.694
  609    HA   LYS  78           HA       LYS  78   7.991   5.655   5.655
  610   1HB   LYS  78          2HB       LYS  78   8.063   3.246   3.246
  611   2HB   LYS  78          1HB       LYS  78   8.918   2.912   2.912
  612   1HG   LYS  78          2HG       LYS  78  10.541   3.029   3.029
  613   2HG   LYS  78          1HG       LYS  78  10.694   4.506   4.506
  614   1HD   LYS  78          2HD       LYS  78   9.060   5.495   5.495
  615   2HD   LYS  78          1HD       LYS  78   9.600   4.134   4.134
  616   1HE   LYS  78          2HE       LYS  78  11.255   5.514   5.514
  617   2HE   LYS  78          1HE       LYS  78  11.965   5.096   5.096
  618   1HZ   LYS  78          1HZ       LYS  78  10.059   7.321   7.321
  619   2HZ   LYS  78          3HZ       LYS  78  11.630   7.575   7.575
  620   3HZ   LYS  78          2HZ       LYS  78  11.382   7.094   7.094
  621    H    LYS  79           H        LYS  79   7.756   4.554   4.554
  622    HA   LYS  79           HA       LYS  79  10.330   5.748   5.748
  623   1HB   LYS  79          2HB       LYS  79   9.705   3.473   3.473
  624   2HB   LYS  79          1HB       LYS  79   8.415   4.235   4.235
  625   1HG   LYS  79          2HG       LYS  79   9.971   5.442   5.442
  626   2HG   LYS  79          1HG       LYS  79  11.317   4.967   4.967
  627   1HD   LYS  79          2HD       LYS  79  11.135   2.684   2.684
  628   2HD   LYS  79          1HD       LYS  79   9.629   3.011   3.011
  629   1HE   LYS  79          2HE       LYS  79  11.198   2.968   2.968
  630   2HE   LYS  79          1HE       LYS  79  11.046   4.690   4.690
  631   1HZ   LYS  79          3HZ       LYS  79  13.013   4.143   4.143
  632   2HZ   LYS  79          2HZ       LYS  79  13.277   2.876   2.876
  633   3HZ   LYS  79          1HZ       LYS  79  13.296   4.475   4.475
  634    H    PHE  80           H        PHE  80   6.886   5.942   5.942
  635    HA   PHE  80           HA       PHE  80   7.427   8.545   8.545
  636   1HB   PHE  80          2HB       PHE  80   4.860   7.045   7.045
  637   2HB   PHE  80          1HB       PHE  80   5.634   8.208   8.208
  638    HD1  PHE  80           HD2      PHE  80   5.739   4.739   4.739
  639    HD2  PHE  80           HD1      PHE  80   7.193   7.519   7.519
  640    HE1  PHE  80           HE2      PHE  80   6.704   2.884   2.884
  641    HE2  PHE  80           HE1      PHE  80   8.161   5.670   5.670
  642    HZ   PHE  80           HZ       PHE  80   7.917   3.350   3.350
  643    H    ALA  81           H        ALA  81   6.035   7.108   7.108
  644    HA   ALA  81           HA       ALA  81   4.813   7.927   7.927
  645   1HB   ALA  81          1HB       ALA  81   5.940  10.372  10.372
  646   2HB   ALA  81          3HB       ALA  81   4.636  10.577  10.577
  647   3HB   ALA  81          2HB       ALA  81   6.119   9.746   9.746
  648    H    CYS  82           H        CYS  82   3.351   6.930   6.930
  649    HA   CYS  82           HA       CYS  82   1.088   8.805   8.805
  650   1HB   CYS  82          2HB       CYS  82   1.750   6.500   6.500
  651   2HB   CYS  82          1HB       CYS  82   0.452   7.671   7.671
  652    HG   CYS  82           HG       CYS  82   2.041   9.031   9.031
  653    H    ASN  83           H        ASN  83  -0.872   8.184   8.184
  654    HA   ASN  83           HA       ASN  83  -1.122   6.097   6.097
  655   1HB   ASN  83          2HB       ASN  83  -2.671   8.244   8.244
  656   2HB   ASN  83          1HB       ASN  83  -3.644   6.868   6.868
  657   1HD2  ASN  83          2HD2      ASN  83  -2.667   7.020   7.020
  658   2HD2  ASN  83          1HD2      ASN  83  -1.486   7.378   7.378
  659    H    GLY  84           H        GLY  84  -0.545   4.103   4.103
  660   1HA   GLY  84          2HA       GLY  84  -2.009   3.071   3.071
  661   2HA   GLY  84          1HA       GLY  84  -0.516   2.404   2.404
  662    H    THR  85           H        THR  85  -3.377   1.391   1.391
  663    HA   THR  85           HA       THR  85  -3.601  -0.035  -0.035
  664    HB   THR  85           HB       THR  85  -6.037   0.042   0.042
  665    HG1  THR  85           HG1      THR  85  -6.477   0.216   0.216
  666   1HG2  THR  85          2HG2      THR  85  -4.607   2.046   2.046
  667   2HG2  THR  85          1HG2      THR  85  -5.360   2.895   2.895
  668   3HG2  THR  85          3HG2      THR  85  -6.364   2.134   2.134
  669    H    VAL  86           H        VAL  86  -4.691  -2.126  -2.126
  670    HA   VAL  86           HA       VAL  86  -4.342  -3.331  -3.331
  671    HB   VAL  86           HB       VAL  86  -2.722  -4.172  -4.172
  672   1HG1  VAL  86          3HG1      VAL  86  -4.736  -3.925  -3.925
  673   2HG1  VAL  86          2HG1      VAL  86  -4.607  -5.670  -5.670
  674   3HG1  VAL  86          1HG1      VAL  86  -3.191  -4.732  -4.732
  675   1HG2  VAL  86          3HG2      VAL  86  -4.264  -5.664  -5.664
  676   2HG2  VAL  86          2HG2      VAL  86  -2.834  -6.250  -6.250
  677   3HG2  VAL  86          1HG2      VAL  86  -4.438  -6.539  -6.539
  678    H    ILE  87           H        ILE  87  -6.544  -2.820  -2.820
  679    HA   ILE  87           HA       ILE  87  -8.639  -4.095  -4.095
  680    HB   ILE  87           HB       ILE  87 -10.209  -3.028  -3.028
  681   1HG1  ILE  87          2HG1      ILE  87  -7.985  -1.501  -1.501
  682   2HG1  ILE  87          1HG1      ILE  87  -8.348  -3.114  -3.114
  683   1HG2  ILE  87          1HG2      ILE  87  -8.111  -1.168  -1.168
  684   2HG2  ILE  87          3HG2      ILE  87  -9.733  -0.692  -0.692
  685   3HG2  ILE  87          2HG2      ILE  87  -9.521  -1.795  -1.795
  686   1HD1  ILE  87          2HD1      ILE  87 -10.820  -2.065  -2.065
  687   2HD1  ILE  87          1HD1      ILE  87  -9.866  -0.611  -0.611
  688   3HD1  ILE  87          3HD1      ILE  87  -9.741  -1.985  -1.985
  689    H    GLU  88           H        GLU  88 -10.223  -5.485  -5.485
  690    HA   GLU  88           HA       GLU  88  -9.104  -7.135  -7.135
  691   1HB   GLU  88          2HB       GLU  88  -9.509  -8.147  -8.147
  692   2HB   GLU  88          1HB       GLU  88 -11.222  -8.024  -8.024
  693   1HG   GLU  88          2HG       GLU  88 -10.789  -9.386  -9.386
  694   2HG   GLU  88          1HG       GLU  88  -9.141  -9.622  -9.622
  695    H    HIS  89           H        HIS  89 -10.035  -5.468  -5.468
  696    HA   HIS  89           HA       HIS  89 -12.682  -4.780  -4.780
  697   1HB   HIS  89          2HB       HIS  89 -10.500  -4.176  -4.176
  698   2HB   HIS  89          1HB       HIS  89 -11.211  -5.339  -5.339
  699    HD1  HIS  89           HD1      HIS  89 -12.955  -4.466  -4.466
  700    HD2  HIS  89           HD2      HIS  89 -12.326  -1.954  -1.954
  701    HE1  HIS  89           HE1      HIS  89 -14.362  -2.430  -2.430
  702    HE2  HIS  89           HE2      HIS  89 -13.911  -0.892  -0.892
  703    HA   PRO  90           HA       PRO  90 -14.629  -8.646  -8.646
  704   1HB   PRO  90          2HB       PRO  90 -17.108  -7.716  -7.716
  705   2HB   PRO  90          1HB       PRO  90 -16.448  -7.802  -7.802
  706   1HG   PRO  90          2HG       PRO  90 -16.659  -5.447  -5.447
  707   2HG   PRO  90          1HG       PRO  90 -17.000  -5.545  -5.545
  708   1HD   PRO  90          2HD       PRO  90 -14.673  -4.550  -4.550
  709   2HD   PRO  90          1HD       PRO  90 -14.789  -5.323  -5.323
  710    H    GLU  91           H        GLU  91 -14.265  -5.935  -5.935
  711    HA   GLU  91           HA       GLU  91 -15.453  -7.201  -7.201
  712   1HB   GLU  91          2HB       GLU  91 -14.935  -4.580  -4.580
  713   2HB   GLU  91          1HB       GLU  91 -13.751  -4.895  -4.895
  714   1HG   GLU  91          2HG       GLU  91 -16.687  -5.442  -5.442
  715   2HG   GLU  91          1HG       GLU  91 -15.925  -3.913  -3.913
  716    H    TYR  92           H        TYR  92 -12.342  -6.971  -6.971
  717    HA   TYR  92           HA       TYR  92 -11.162  -8.363  -8.363
  718   1HB   TYR  92          2HB       TYR  92  -9.440  -6.730  -6.730
  719   2HB   TYR  92          1HB       TYR  92  -9.206  -7.134  -7.134
  720    HD1  TYR  92           HD2      TYR  92 -11.555  -6.219  -6.219
  721    HD2  TYR  92           HD1      TYR  92  -9.526  -4.436  -4.436
  722    HE1  TYR  92           HE2      TYR  92 -12.451  -4.024  -4.024
  723    HE2  TYR  92           HE1      TYR  92 -10.417  -2.235  -2.235
  724    HH   TYR  92           HH       TYR  92 -12.903  -1.696  -1.696
  725    H    GLY  93           H        GLY  93 -10.717  -7.761  -7.761
  726   1HA   GLY  93          2HA       GLY  93 -10.927 -10.072 -10.072
  727   2HA   GLY  93          1HA       GLY  93  -9.478 -10.411 -10.411
  728    H    GLU  94           H        GLU  94  -7.536  -9.739  -9.739
  729    HA   GLU  94           HA       GLU  94  -7.567  -8.186  -8.186
  730   1HB   GLU  94          2HB       GLU  94  -6.675 -10.655 -10.655
  731   2HB   GLU  94          1HB       GLU  94  -5.241  -9.885  -9.885
  732   1HG   GLU  94          2HG       GLU  94  -6.426  -8.969  -8.969
  733   2HG   GLU  94          1HG       GLU  94  -5.334 -10.352 -10.352
  734    H    VAL  95           H        VAL  95  -7.469  -6.159  -6.159
  735    HA   VAL  95           HA       VAL  95  -4.918  -5.612  -5.612
  736    HB   VAL  95           HB       VAL  95  -6.043  -3.720  -3.720
  737   1HG1  VAL  95          3HG1      VAL  95  -7.005  -6.521  -6.521
  738   2HG1  VAL  95          2HG1      VAL  95  -7.686  -5.226  -5.226
  739   3HG1  VAL  95          1HG1      VAL  95  -5.951  -5.545  -5.545
  740   1HG2  VAL  95          1HG2      VAL  95  -8.013  -4.127  -4.127
  741   2HG2  VAL  95          3HG2      VAL  95  -8.045  -2.970  -2.970
  742   3HG2  VAL  95          2HG2      VAL  95  -8.766  -4.566  -4.566
  743    H    ILE  96           H        ILE  96  -3.643  -4.018  -4.018
  744    HA   ILE  96           HA       ILE  96  -4.191  -2.941  -2.941
  745    HB   ILE  96           HB       ILE  96  -1.909  -2.725  -2.725
  746   1HG1  ILE  96          2HG1      ILE  96  -2.461  -4.550  -4.550
  747   2HG1  ILE  96          1HG1      ILE  96  -0.811  -4.090  -4.090
  748   1HG2  ILE  96          3HG2      ILE  96  -2.440  -0.905  -0.905
  749   2HG2  ILE  96          2HG2      ILE  96  -0.786  -1.337  -1.337
  750   3HG2  ILE  96          1HG2      ILE  96  -1.818  -0.525  -0.525
  751   1HD1  ILE  96          1HD1      ILE  96  -2.172  -2.553  -2.553
  752   2HD1  ILE  96          3HD1      ILE  96  -1.694  -4.213  -4.213
  753   3HD1  ILE  96          2HD1      ILE  96  -0.484  -3.038  -3.038
  754    H    GLN  97           H        GLN  97  -4.399  -0.717  -0.717
  755    HA   GLN  97           HA       GLN  97  -5.292   0.981   0.981
  756   1HB   GLN  97          2HB       GLN  97  -6.813   0.042   0.042
  757   2HB   GLN  97          1HB       GLN  97  -6.548   1.757   1.757
  758   1HG   GLN  97          2HG       GLN  97  -7.367   2.129   2.129
  759   2HG   GLN  97          1HG       GLN  97  -7.874   0.439   0.439
  760   1HE2  GLN  97          2HE2      GLN  97 -10.852   2.246   2.246
  761   2HE2  GLN  97          1HE2      GLN  97  -9.875   1.931   1.931
  762    H    LEU  98           H        LEU  98  -3.754   2.462   2.462
  763    HA   LEU  98           HA       LEU  98  -2.392   3.597   3.597
  764   1HB   LEU  98          2HB       LEU  98  -1.911   3.817   3.817
  765   2HB   LEU  98          1HB       LEU  98  -1.028   4.762   4.762
  766    HG   LEU  98           HG       LEU  98  -1.058   1.748   1.748
  767   1HD1  LEU  98          1HD1      LEU  98   0.615   3.733   3.733
  768   2HD1  LEU  98          3HD1      LEU  98   1.415   2.316   2.316
  769   3HD1  LEU  98          2HD1      LEU  98   0.105   2.116   2.116
  770   1HD2  LEU  98          1HD2      LEU  98   0.269   3.834   3.834
  771   2HD2  LEU  98          3HD2      LEU  98  -0.412   2.277   2.277
  772   3HD2  LEU  98          2HD2      LEU  98   1.147   2.344   2.344
  773    H    GLN  99           H        GLN  99  -2.170   5.936   5.936
  774    HA   GLN  99           HA       GLN  99  -4.664   7.266   7.266
  775   1HB   GLN  99          2HB       GLN  99  -3.009   7.324   7.324
  776   2HB   GLN  99          1HB       GLN  99  -3.015   8.939   8.939
  777   1HG   GLN  99          2HG       GLN  99  -5.599   7.504   7.504
  778   2HG   GLN  99          1HG       GLN  99  -4.816   8.215   8.215
  779   1HE2  GLN  99          2HE2      GLN  99  -7.184  10.591  10.591
  780   2HE2  GLN  99          1HE2      GLN  99  -7.327   8.929   8.929
  781    H    GLY 100           H        GLY 100  -4.773   8.894   8.894
  782   1HA   GLY 100          2HA       GLY 100  -4.048  10.688  10.688
  783   2HA   GLY 100          1HA       GLY 100  -2.415  10.426  10.426
  784    H    ASP 101           H        ASP 101  -2.539  10.990  10.990
  785    HA   ASP 101           HA       ASP 101  -2.873   8.649   8.649
  786   1HB   ASP 101          2HB       ASP 101  -1.423  11.128  11.128
  787   2HB   ASP 101          1HB       ASP 101  -2.404  10.018  10.018
  788    H    GLN 102           H        GLN 102  -1.407   7.306   7.306
  789    HA   GLN 102           HA       GLN 102   1.430   7.854   7.854
  790   1HB   GLN 102          2HB       GLN 102  -0.293   5.993   5.993
  791   2HB   GLN 102          1HB       GLN 102   1.273   5.349   5.349
  792   1HG   GLN 102          2HG       GLN 102   1.086   6.449   6.449
  793   2HG   GLN 102          1HG       GLN 102   2.435   6.934   6.934
  794   1HE2  GLN 102          2HE2      GLN 102  -0.660   9.596   9.596
  795   2HE2  GLN 102          1HE2      GLN 102  -0.941   7.919   7.919
  796    H    ARG 103           H        ARG 103  -0.652   6.904   6.904
  797    HA   ARG 103           HA       ARG 103  -0.022   4.457   4.457
  798   1HB   ARG 103          2HB       ARG 103  -0.536   5.370   5.370
  799   2HB   ARG 103          1HB       ARG 103  -1.684   5.921   5.921
  800   1HG   ARG 103          2HG       ARG 103  -1.180   8.057   8.057
  801   2HG   ARG 103          1HG       ARG 103   0.555   7.742   7.742
  802   1HD   ARG 103          2HD       ARG 103   0.545   8.225   8.225
  803   2HD   ARG 103          1HD       ARG 103  -0.174   6.630   6.630
  804    HE   ARG 103           HE       ARG 103  -2.311   8.229   8.229
  805   1HH1  ARG 103          2HH1      ARG 103   0.342   8.369   8.369
  806   2HH1  ARG 103          1HH1      ARG 103  -0.575   9.191   9.191
  807   1HH2  ARG 103          1HH2      ARG 103  -3.519   9.311   9.311
  808   2HH2  ARG 103          2HH2      ARG 103  -2.767   9.728   9.728
  809    H    LYS 104           H        LYS 104   1.988   7.299   7.299
  810    HA   LYS 104           HA       LYS 104   3.980   6.028   6.028
  811   1HB   LYS 104          2HB       LYS 104   3.265   8.480   8.480
  812   2HB   LYS 104          1HB       LYS 104   4.189   8.762   8.762
  813   1HG   LYS 104          2HG       LYS 104   5.948   7.362   7.362
  814   2HG   LYS 104          1HG       LYS 104   5.095   8.404   8.404
  815   1HD   LYS 104          2HD       LYS 104   6.819   9.780   9.780
  816   2HD   LYS 104          1HD       LYS 104   5.548  10.248  10.248
  817   1HE   LYS 104          2HE       LYS 104   7.284   9.958   9.958
  818   2HE   LYS 104          1HE       LYS 104   6.608   8.329   8.329
  819   1HZ   LYS 104          3HZ       LYS 104   8.265   7.716   7.716
  820   2HZ   LYS 104          2HZ       LYS 104   8.940   9.263   9.263
  821   3HZ   LYS 104          1HZ       LYS 104   8.985   8.234   8.234
  822    H    ASN 105           H        ASN 105   3.325   6.708   6.708
  823    HA   ASN 105           HA       ASN 105   6.088   6.334   6.334
  824   1HB   ASN 105          2HB       ASN 105   3.531   7.025   7.025
  825   2HB   ASN 105          1HB       ASN 105   4.844   6.343   6.343
  826   1HD2  ASN 105          2HD2      ASN 105   4.875  10.191  10.191
  827   2HD2  ASN 105          1HD2      ASN 105   3.534   9.130   9.130
  828    H    ILE 106           H        ILE 106   3.077   4.508   4.508
  829    HA   ILE 106           HA       ILE 106   3.956   2.376   2.376
  830    HB   ILE 106           HB       ILE 106   1.584   2.759   2.759
  831   1HG1  ILE 106          2HG1      ILE 106   0.953   0.415   0.415
  832   2HG1  ILE 106          1HG1      ILE 106   2.565   0.059   0.059
  833   1HG2  ILE 106          1HG2      ILE 106   1.839   3.414   3.414
  834   2HG2  ILE 106          3HG2      ILE 106   2.197   1.740   1.740
  835   3HG2  ILE 106          2HG2      ILE 106   0.612   2.171   2.171
  836   1HD1  ILE 106          3HD1      ILE 106   2.543   1.294   1.294
  837   2HD1  ILE 106          2HD1      ILE 106   1.754  -0.281  -0.281
  838   3HD1  ILE 106          1HD1      ILE 106   3.430  -0.107  -0.107
  839    H    CYS 107           H        CYS 107   3.907   2.780   2.780
  840    HA   CYS 107           HA       CYS 107   4.969   0.289   0.289
  841   1HB   CYS 107          2HB       CYS 107   4.997   2.996   2.996
  842   2HB   CYS 107          1HB       CYS 107   5.994   1.714   1.714
  843    HG   CYS 107           HG       CYS 107   3.119   0.829   0.829
  844    H    GLN 108           H        GLN 108   6.421   3.186   3.186
  845    HA   GLN 108           HA       GLN 108   9.149   2.520   2.520
  846   1HB   GLN 108          2HB       GLN 108   7.653   4.517   4.517
  847   2HB   GLN 108          1HB       GLN 108   9.305   4.179   4.179
  848   1HG   GLN 108          2HG       GLN 108   8.413   5.117   5.117
  849   2HG   GLN 108          1HG       GLN 108   9.174   6.104   6.104
  850   1HE2  GLN 108          2HE2      GLN 108  12.261   4.047   4.047
  851   2HE2  GLN 108          1HE2      GLN 108  11.100   4.261   4.261
  852    H    PHE 109           H        PHE 109   6.939   2.177   2.177
  853    HA   PHE 109           HA       PHE 109   8.725   1.110   1.110
  854   1HB   PHE 109          2HB       PHE 109   6.450   1.991   1.991
  855   2HB   PHE 109          1HB       PHE 109   5.761   0.561   0.561
  856    HD1  PHE 109           HD2      PHE 109   8.212   1.478   1.478
  857    HD2  PHE 109           HD1      PHE 109   5.173  -1.198  -1.198
  858    HE1  PHE 109           HE2      PHE 109   8.327   0.301   0.301
  859    HE2  PHE 109           HE1      PHE 109   5.281  -2.380  -2.380
  860    HZ   PHE 109           HZ       PHE 109   6.860  -1.627  -1.627
  861    H    LEU 110           H        LEU 110   6.370  -0.594  -0.594
  862    HA   LEU 110           HA       LEU 110   7.010  -3.190  -3.190
  863   1HB   LEU 110          2HB       LEU 110   5.923  -1.929  -1.929
  864   2HB   LEU 110          1HB       LEU 110   6.333  -3.632  -3.632
  865    HG   LEU 110           HG       LEU 110   4.697  -4.151  -4.151
  866   1HD1  LEU 110          3HD1      LEU 110   4.392  -1.180  -1.180
  867   2HD1  LEU 110          2HD1      LEU 110   3.358  -2.410  -2.410
  868   3HD1  LEU 110          1HD1      LEU 110   5.069  -2.337  -2.337
  869   1HD2  LEU 110          2HD2      LEU 110   3.992  -3.396  -3.396
  870   2HD2  LEU 110          1HD2      LEU 110   2.772  -3.738  -3.738
  871   3HD2  LEU 110          3HD2      LEU 110   3.219  -2.070  -2.070
  872    H    VAL 111           H        VAL 111   8.720  -0.970  -0.970
  873    HA   VAL 111           HA       VAL 111  10.512  -3.059  -3.059
  874    HB   VAL 111           HB       VAL 111  10.431  -0.101  -0.101
  875   1HG1  VAL 111          3HG1      VAL 111  12.289  -2.278  -2.278
  876   2HG1  VAL 111          2HG1      VAL 111  11.852  -1.061  -1.061
  877   3HG1  VAL 111          1HG1      VAL 111  12.614  -0.573  -0.573
  878   1HG2  VAL 111          3HG2      VAL 111   8.593  -1.836  -1.836
  879   2HG2  VAL 111          2HG2      VAL 111   9.181  -0.557  -0.557
  880   3HG2  VAL 111          1HG2      VAL 111   9.812  -2.196  -2.196
  881    H    GLU 112           H        GLU 112  10.398  -0.485  -0.485
  882    HA   GLU 112           HA       GLU 112  13.230  -0.318  -0.318
  883   1HB   GLU 112          2HB       GLU 112  10.842   0.708   0.708
  884   2HB   GLU 112          1HB       GLU 112  12.480   0.905   0.905
  885   1HG   GLU 112          2HG       GLU 112  12.198   1.751   1.751
  886   2HG   GLU 112          1HG       GLU 112  11.136   2.629   2.629
  887    H    ILE 113           H        ILE 113  10.530  -1.879  -1.879
  888    HA   ILE 113           HA       ILE 113  12.324  -3.099  -3.099
  889    HB   ILE 113           HB       ILE 113  10.397  -3.903  -3.903
  890   1HG1  ILE 113          2HG1      ILE 113   8.822  -3.185  -3.185
  891   2HG1  ILE 113          1HG1      ILE 113   9.185  -4.812  -4.812
  892   1HG2  ILE 113          3HG2      ILE 113  10.864  -1.317  -1.317
  893   2HG2  ILE 113          2HG2      ILE 113   9.272  -1.343  -1.343
  894   3HG2  ILE 113          1HG2      ILE 113   9.468  -1.919  -1.919
  895   1HD1  ILE 113          2HD1      ILE 113   7.851  -3.220  -3.220
  896   2HD1  ILE 113          1HD1      ILE 113   6.911  -3.370  -3.370
  897   3HD1  ILE 113          3HD1      ILE 113   7.454  -4.818  -4.818
  898    H    GLY 114           H        GLY 114  11.185  -3.847  -3.847
  899   1HA   GLY 114          2HA       GLY 114  11.654  -5.718  -5.718
  900   2HA   GLY 114          1HA       GLY 114  12.331  -6.492  -6.492
  901    H    LEU 115           H        LEU 115   9.117  -5.099  -5.099
  902    HA   LEU 115           HA       LEU 115   7.944  -7.596  -7.596
  903   1HB   LEU 115          2HB       LEU 115   7.352  -4.978  -4.978
  904   2HB   LEU 115          1HB       LEU 115   6.167  -5.377  -5.377
  905    HG   LEU 115           HG       LEU 115   5.266  -7.142  -7.142
  906   1HD1  LEU 115          2HD1      LEU 115   7.773  -7.132  -7.132
  907   2HD1  LEU 115          1HD1      LEU 115   6.632  -6.617  -6.617
  908   3HD1  LEU 115          3HD1      LEU 115   6.386  -8.146  -8.146
  909   1HD2  LEU 115          3HD2      LEU 115   4.909  -4.523  -4.523
  910   2HD2  LEU 115          2HD2      LEU 115   4.049  -5.777  -5.777
  911   3HD2  LEU 115          1HD2      LEU 115   5.471  -5.007  -5.007
  912    H    ALA 116           H        ALA 116   6.820  -5.348  -5.348
  913    HA   ALA 116           HA       ALA 116   5.759  -7.569  -7.569
  914   1HB   ALA 116          3HB       ALA 116   4.664  -5.266  -5.266
  915   2HB   ALA 116          2HB       ALA 116   5.782  -4.718  -4.718
  916   3HB   ALA 116          1HB       ALA 116   4.619  -5.991  -5.991
  917    H    LYS 117           H        LYS 117   6.110  -6.580  -6.580
  918    HA   LYS 117           HA       LYS 117   9.024  -6.793  -6.793
  919   1HB   LYS 117          2HB       LYS 117   6.930  -8.534  -8.534
  920   2HB   LYS 117          1HB       LYS 117   7.805  -7.826  -7.826
  921   1HG   LYS 117          2HG       LYS 117   8.705 -10.006 -10.006
  922   2HG   LYS 117          1HG       LYS 117   9.881  -8.690  -8.690
  923   1HD   LYS 117          2HD       LYS 117   8.552  -8.771  -8.771
  924   2HD   LYS 117          1HD       LYS 117   9.082 -10.406 -10.406
  925   1HE   LYS 117          2HE       LYS 117  10.987  -8.158  -8.158
  926   2HE   LYS 117          1HE       LYS 117  10.672  -8.697  -8.697
  927   1HZ   LYS 117          2HZ       LYS 117  11.089 -11.028 -11.028
  928   2HZ   LYS 117          1HZ       LYS 117  12.063 -10.056 -10.056
  929   3HZ   LYS 117          3HZ       LYS 117  12.335 -10.114 -10.114
  930    H    ASP 118           H        ASP 118   9.919  -5.634  -5.634
  931    HA   ASP 118           HA       ASP 118   8.741  -3.161  -3.161
  932   1HB   ASP 118          2HB       ASP 118  10.530  -2.824  -2.824
  933   2HB   ASP 118          1HB       ASP 118  11.169  -3.581  -3.581
  934    H    ASP 119           H        ASP 119   8.591  -6.220  -6.220
  935    HA   ASP 119           HA       ASP 119   7.318  -5.132  -5.132
  936   1HB   ASP 119          2HB       ASP 119   8.775  -7.266  -7.266
  937   2HB   ASP 119          1HB       ASP 119   7.324  -8.040  -8.040
  938    H    GLN 120           H        GLN 120   6.387  -6.458  -6.458
  939    HA   GLN 120           HA       GLN 120   3.635  -6.899  -6.899
  940   1HB   GLN 120          2HB       GLN 120   5.024  -6.881  -6.881
  941   2HB   GLN 120          1HB       GLN 120   3.338  -7.309  -7.309
  942   1HG   GLN 120          2HG       GLN 120   4.062  -9.160  -9.160
  943   2HG   GLN 120          1HG       GLN 120   5.737  -8.760  -8.760
  944   1HE2  GLN 120          2HE2      GLN 120   3.419 -10.109 -10.109
  945   2HE2  GLN 120          1HE2      GLN 120   2.779  -8.998  -8.998
  946    H    LEU 121           H        LEU 121   5.447  -4.174  -4.174
  947    HA   LEU 121           HA       LEU 121   3.867  -2.623  -2.623
  948   1HB   LEU 121          2HB       LEU 121   5.593  -1.865  -1.865
  949   2HB   LEU 121          1HB       LEU 121   4.808  -0.671  -0.671
  950    HG   LEU 121           HG       LEU 121   6.691  -2.747  -2.747
  951   1HD1  LEU 121          3HD1      LEU 121   7.261  -0.102  -0.102
  952   2HD1  LEU 121          2HD1      LEU 121   8.256  -0.670  -0.670
  953   3HD1  LEU 121          1HD1      LEU 121   8.141  -1.624  -1.624
  954   1HD2  LEU 121          3HD2      LEU 121   4.933  -1.063  -1.063
  955   2HD2  LEU 121          2HD2      LEU 121   6.376  -1.770  -1.770
  956   3HD2  LEU 121          1HD2      LEU 121   6.438  -0.146  -0.146
  957    H    LYS 122           H        LYS 122   1.684  -3.062  -3.062
  958    HA   LYS 122           HA       LYS 122   0.629  -2.046  -2.046
  959   1HB   LYS 122          2HB       LYS 122  -0.178  -4.205  -4.205
  960   2HB   LYS 122          1HB       LYS 122  -1.502  -3.247  -3.247
  961   1HG   LYS 122          2HG       LYS 122   0.613  -4.572  -4.572
  962   2HG   LYS 122          1HG       LYS 122  -0.968  -5.271  -5.271
  963   1HD   LYS 122          2HD       LYS 122  -2.029  -3.913  -3.913
  964   2HD   LYS 122          1HD       LYS 122  -1.024  -2.522  -2.522
  965   1HE   LYS 122          2HE       LYS 122   0.835  -3.718  -3.718
  966   2HE   LYS 122          1HE       LYS 122  -0.442  -4.752  -4.752
  967   1HZ   LYS 122          3HZ       LYS 122  -1.488  -2.359  -2.359
  968   2HZ   LYS 122          2HZ       LYS 122   0.153  -1.968  -1.968
  969   3HZ   LYS 122          1HZ       LYS 122  -0.505  -3.165  -3.165
  970    H    VAL 123           H        VAL 123   0.950   0.154   0.154
  971    HA   VAL 123           HA       VAL 123  -0.809   0.973   0.973
  972    HB   VAL 123           HB       VAL 123   1.472   1.935   1.935
  973   1HG1  VAL 123          2HG1      VAL 123   1.139   2.072   2.072
  974   2HG1  VAL 123          1HG1      VAL 123   0.545   3.687   3.687
  975   3HG1  VAL 123          3HG1      VAL 123   2.181   3.216   3.216
  976   1HG2  VAL 123          1HG2      VAL 123  -0.791   3.130   3.130
  977   2HG2  VAL 123          3HG2      VAL 123   0.808   3.864   3.864
  978   3HG2  VAL 123          2HG2      VAL 123  -0.258   4.289   4.289
  979    H    HIS 124           H        HIS 124  -2.861   1.463   1.463
  980    HA   HIS 124           HA       HIS 124  -3.602   2.544   2.544
  981   1HB   HIS 124          2HB       HIS 124  -5.282   0.902   0.902
  982   2HB   HIS 124          1HB       HIS 124  -5.833   1.558   1.558
  983    HD1  HIS 124           HD1      HIS 124  -5.310   0.231   0.231
  984    HD2  HIS 124           HD2      HIS 124  -3.347  -1.207  -1.207
  985    HE1  HIS 124           HE1      HIS 124  -4.287  -1.957  -1.957
  986    HE2  HIS 124           HE2      HIS 124  -3.131  -2.825  -2.825
  987    H    GLY 125           H        GLY 125  -3.126   4.687   4.687
  988   1HA   GLY 125          2HA       GLY 125  -4.243   5.877   5.877
  989   2HA   GLY 125          1HA       GLY 125  -3.824   6.736   6.736
  990    H    PHE 126           HN       PHE 126  -6.282   6.110   6.110
  991    HA   PHE 126           HA       PHE 126  -8.527   5.515   5.515
  992   1HB   PHE 126          2HB       PHE 126  -9.707   6.212   6.212
  993   2HB   PHE 126          1HB       PHE 126  -8.105   6.225   6.225
  994    HD1  PHE 126           HD2      PHE 126  -6.825   8.456   8.456
  995    HD2  PHE 126           HD1      PHE 126 -11.014   8.119   8.119
  996    HE1  PHE 126           HE2      PHE 126  -7.103  10.838  10.838
  997    HE2  PHE 126           HE1      PHE 126 -11.299  10.499  10.499
  998    HZ   PHE 126           HZ       PHE 126  -9.344  11.861  11.861

  Start of MODEL   13
    1   1H    MET   1          2H        MET   1  13.992  16.691  16.691
    2   2H    MET   1          1H        MET   1  13.657  17.590  17.590
    3   3H    MET   1          3H        MET   1  14.018  18.407  18.407
    4    HA   MET   1           HA       MET   1  12.041  17.620  17.620
    5   1HB   MET   1          2HB       MET   1  11.840  18.932  18.932
    6   2HB   MET   1          1HB       MET   1  10.426  18.709  18.709
    7   1HG   MET   1          2HG       MET   1  11.056  20.305  20.305
    8   2HG   MET   1          1HG       MET   1  12.775  19.975  19.975
    9   1HE   MET   1          2HE       MET   1  14.059  20.473  20.473
   10   2HE   MET   1          1HE       MET   1  13.899  21.990  21.990
   11   3HE   MET   1          3HE       MET   1  14.274  22.011  22.011
   12    H    ARG   2           H        ARG   2  11.853  16.834  16.834
   13    HA   ARG   2           HA       ARG   2  10.839  14.185  14.185
   14   1HB   ARG   2          2HB       ARG   2   9.259  16.086  16.086
   15   2HB   ARG   2          1HB       ARG   2   8.841  14.418  14.418
   16   1HG   ARG   2          2HG       ARG   2   8.783  15.144  15.144
   17   2HG   ARG   2          1HG       ARG   2   8.805  16.798  16.798
   18   1HD   ARG   2          2HD       ARG   2   6.846  15.168  15.168
   19   2HD   ARG   2          1HD       ARG   2   6.574  15.176  15.176
   20    HE   ARG   2           HE       ARG   2   7.036  17.803  17.803
   21   1HH1  ARG   2          2HH1      ARG   2   4.608  15.299  15.299
   22   2HH1  ARG   2          1HH1      ARG   2   3.281  16.407  16.407
   23   1HH2  ARG   2          1HH2      ARG   2   5.292  19.262  19.262
   24   2HH2  ARG   2          2HH2      ARG   2   3.669  18.657  18.657
   25    H    GLY   3           H        GLY   3  13.250  15.233  15.233
   26   1HA   GLY   3          2HA       GLY   3  12.937  14.458  14.458
   27   2HA   GLY   3          1HA       GLY   3  14.326  15.281  15.281
   28    H    SER   4           H        SER   4  13.920  13.104  13.104
   29    HA   SER   4           HA       SER   4  16.061  11.482  11.482
   30   1HB   SER   4          2HB       SER   4  15.464  10.091  10.091
   31   2HB   SER   4          1HB       SER   4  15.230  11.788  11.788
   32    HG   SER   4           HG       SER   4  13.045  11.533  11.533
   33    H    HIS   5           H        HIS   5  12.737  11.274  11.274
   34    HA   HIS   5           HA       HIS   5  12.356   8.589   8.589
   35   1HB   HIS   5          2HB       HIS   5  10.855  10.761  10.761
   36   2HB   HIS   5          1HB       HIS   5  11.388  10.487  10.487
   37    HD1  HIS   5           HD1      HIS   5   9.367   9.517   9.517
   38    HD2  HIS   5           HD2      HIS   5  10.222   7.705   7.705
   39    HE1  HIS   5           HE1      HIS   5   7.755   7.597   7.597
   40    HE2  HIS   5           HE2      HIS   5   8.223   6.580   6.580
   41    H    HIS   6           H        HIS   6  14.332  10.863  10.863
   42    HA   HIS   6           HA       HIS   6  15.127   8.695   8.695
   43   1HB   HIS   6          2HB       HIS   6  15.518  10.401  10.401
   44   2HB   HIS   6          1HB       HIS   6  13.829  10.322  10.322
   45    HD1  HIS   6           HD1      HIS   6  16.509  12.668  12.668
   46    HD2  HIS   6           HD2      HIS   6  13.169  12.486  12.486
   47    HE1  HIS   6           HE1      HIS   6  16.107  15.031  15.031
   48    HE2  HIS   6           HE2      HIS   6  14.125  14.884  14.884
   49    H    HIS   7           H        HIS   7  16.669   8.433   8.433
   50    HA   HIS   7           HA       HIS   7  18.877  10.360  10.360
   51   1HB   HIS   7          2HB       HIS   7  17.787   9.511   9.511
   52   2HB   HIS   7          1HB       HIS   7  18.690   8.029   8.029
   53    HD1  HIS   7           HD1      HIS   7  21.379   9.100   9.100
   54    HD2  HIS   7           HD2      HIS   7  19.199  10.737  10.737
   55    HE1  HIS   7           HE1      HIS   7  23.062  10.296  10.296
   56    HE2  HIS   7           HE2      HIS   7  21.707  11.350  11.350
   57    H    HIS   8           H        HIS   8  19.920   9.803   9.803
   58    HA   HIS   8           HA       HIS   8  21.387   8.689   8.689
   59   1HB   HIS   8          2HB       HIS   8  21.947   7.709   7.709
   60   2HB   HIS   8          1HB       HIS   8  22.438   6.591   6.591
   61    HD1  HIS   8           HD1      HIS   8  24.153   8.649   8.649
   62    HD2  HIS   8           HD2      HIS   8  23.614   8.776   8.776
   63    HE1  HIS   8           HE1      HIS   8  26.096   9.974   9.974
   64    HE2  HIS   8           HE2      HIS   8  25.794   9.965   9.965
   65    H    HIS   9           H        HIS   9  19.360   8.022   8.022
   66    HA   HIS   9           HA       HIS   9  18.141   6.467   6.467
   67   1HB   HIS   9          2HB       HIS   9  20.086   4.375   4.375
   68   2HB   HIS   9          1HB       HIS   9  19.162   4.402   4.402
   69    HD1  HIS   9           HD1      HIS   9  22.321   5.584   5.584
   70    HD2  HIS   9           HD2      HIS   9  20.213   6.119   6.119
   71    HE1  HIS   9           HE1      HIS   9  23.941   6.665   6.665
   72    HE2  HIS   9           HE2      HIS   9  22.665   6.915   6.915
   73    H    HIS  10           H        HIS  10  17.199   4.060   4.060
   74    HA   HIS  10           HA       HIS  10  16.223   3.971   3.971
   75   1HB   HIS  10          2HB       HIS  10  14.068   3.155   3.155
   76   2HB   HIS  10          1HB       HIS  10  14.459   4.762   4.762
   77    HD1  HIS  10           HD1      HIS  10  14.379   5.064   5.064
   78    HD2  HIS  10           HD2      HIS  10  14.607   1.060   1.060
   79    HE1  HIS  10           HE1      HIS  10  14.117   3.771   3.771
   80    HE2  HIS  10           HE2      HIS  10  14.174   1.349   1.349
   81    H    THR  11           H        THR  11  15.437   1.826   1.826
   82    HA   THR  11           HA       THR  11  16.267  -0.497  -0.497
   83    HB   THR  11           HB       THR  11  17.680  -1.060  -1.060
   84    HG1  THR  11           HG1      THR  11  19.018   0.777   0.777
   85   1HG2  THR  11          3HG2      THR  11  18.287  -1.099  -1.099
   86   2HG2  THR  11          2HG2      THR  11  19.196   0.344   0.344
   87   3HG2  THR  11          1HG2      THR  11  19.519  -1.192  -1.192
   88    H    ASP  12           H        ASP  12  14.638  -1.842  -1.842
   89    HA   ASP  12           HA       ASP  12  13.565  -2.056  -2.056
   90   1HB   ASP  12          2HB       ASP  12  12.069  -1.999  -1.999
   91   2HB   ASP  12          1HB       ASP  12  11.353  -2.621  -2.621
   92    HA   PRO  13           HA       PRO  13  15.338  -6.164  -6.164
   93   1HB   PRO  13          2HB       PRO  13  15.226  -6.353  -6.353
   94   2HB   PRO  13          1HB       PRO  13  16.513  -6.836  -6.836
   95   1HG   PRO  13          2HG       PRO  13  16.742  -4.621  -4.621
   96   2HG   PRO  13          1HG       PRO  13  17.316  -4.671  -4.671
   97   1HD   PRO  13          2HD       PRO  13  14.856  -3.411  -3.411
   98   2HD   PRO  13          1HD       PRO  13  15.904  -2.859  -2.859
   99    H    MET  14           H        MET  14  12.710  -5.202  -5.202
  100    HA   MET  14           HA       MET  14  11.555  -7.821  -7.821
  101   1HB   MET  14          2HB       MET  14  10.252  -5.157  -5.157
  102   2HB   MET  14          1HB       MET  14   9.712  -6.735  -6.735
  103   1HG   MET  14          2HG       MET  14  11.562  -6.954  -6.954
  104   2HG   MET  14          1HG       MET  14  12.375  -5.563  -5.563
  105   1HE   MET  14          1HE       MET  14  12.863  -5.039  -5.039
  106   2HE   MET  14          3HE       MET  14  11.867  -3.944  -3.944
  107   3HE   MET  14          2HE       MET  14  11.687  -5.688  -5.688
  108    H    SER  15           H        SER  15  11.646  -5.515  -5.515
  109    HA   SER  15           HA       SER  15   9.057  -6.307  -6.307
  110   1HB   SER  15          2HB       SER  15   9.510  -3.921  -3.921
  111   2HB   SER  15          1HB       SER  15  11.032  -4.187  -4.187
  112    HG   SER  15           HG       SER  15   9.973  -4.316  -4.316
  113    H    ALA  16           H        ALA  16  11.404  -8.112  -8.112
  114    HA   ALA  16           HA       ALA  16  11.150  -9.371  -9.371
  115   1HB   ALA  16          1HB       ALA  16  13.373  -7.400  -7.400
  116   2HB   ALA  16          3HB       ALA  16  13.659  -8.921  -8.921
  117   3HB   ALA  16          2HB       ALA  16  12.362  -7.849  -7.849
  118    H    ILE  17           H        ILE  17  10.914 -10.715 -10.715
  119    HA   ILE  17           HA       ILE  17  13.521 -11.833 -11.833
  120    HB   ILE  17           HB       ILE  17  10.895 -12.118 -12.118
  121   1HG1  ILE  17          2HG1      ILE  17  13.246 -10.360 -10.360
  122   2HG1  ILE  17          1HG1      ILE  17  11.790  -9.771  -9.771
  123   1HG2  ILE  17          1HG2      ILE  17  13.720 -12.835 -12.835
  124   2HG2  ILE  17          3HG2      ILE  17  12.338 -12.890 -12.890
  125   3HG2  ILE  17          2HG2      ILE  17  12.391 -13.951 -13.951
  126   1HD1  ILE  17          2HD1      ILE  17  11.289 -11.289 -11.289
  127   2HD1  ILE  17          1HD1      ILE  17  12.209  -9.802  -9.802
  128   3HD1  ILE  17          3HD1      ILE  17  10.626  -9.745  -9.745
  129    H    GLN  18           H        GLN  18  14.031 -13.780 -13.780
  130    HA   GLN  18           HA       GLN  18  11.880 -15.666 -15.666
  131   1HB   GLN  18          2HB       GLN  18  14.253 -14.905 -14.905
  132   2HB   GLN  18          1HB       GLN  18  13.383 -16.414 -16.414
  133   1HG   GLN  18          2HG       GLN  18  11.506 -15.371 -15.371
  134   2HG   GLN  18          1HG       GLN  18  11.857 -13.860 -13.860
  135   1HE2  GLN  18          2HE2      GLN  18  13.303 -14.586 -14.586
  136   2HE2  GLN  18          1HE2      GLN  18  12.523 -15.816 -15.816
  137    H    ASN  19           H        ASN  19  13.593 -15.426 -15.426
  138    HA   ASN  19           HA       ASN  19  15.040 -17.984 -17.984
  139   1HB   ASN  19          2HB       ASN  19  16.249 -15.624 -15.624
  140   2HB   ASN  19          1HB       ASN  19  15.826 -16.087 -16.087
  141   1HD2  ASN  19          2HD2      ASN  19  19.126 -17.452 -17.452
  142   2HD2  ASN  19          1HD2      ASN  19  18.333 -15.938 -15.938
  143    H    LEU  20           H        LEU  20  12.309 -17.822 -17.822
  144    HA   LEU  20           HA       LEU  20  12.361 -18.813 -18.813
  145   1HB   LEU  20          2HB       LEU  20  10.721 -16.619 -16.619
  146   2HB   LEU  20          1HB       LEU  20   9.875 -17.764 -17.764
  147    HG   LEU  20           HG       LEU  20  12.267 -16.097 -16.097
  148   1HD1  LEU  20          2HD1      LEU  20   9.333 -15.925 -15.925
  149   2HD1  LEU  20          1HD1      LEU  20  10.469 -15.343 -15.343
  150   3HD1  LEU  20          3HD1      LEU  20  10.481 -14.649 -14.649
  151   1HD2  LEU  20          2HD2      LEU  20  10.893 -18.387 -18.387
  152   2HD2  LEU  20          1HD2      LEU  20  12.611 -17.997 -17.997
  153   3HD2  LEU  20          3HD2      LEU  20  11.547 -17.077 -17.077
  154    H    HIS  21           H        HIS  21  12.377 -20.150 -20.150
  155    HA   HIS  21           HA       HIS  21   9.947 -21.756 -21.756
  156   1HB   HIS  21          2HB       HIS  21  10.998 -20.617 -20.617
  157   2HB   HIS  21          1HB       HIS  21   9.981 -22.054 -22.054
  158    HD1  HIS  21           HD1      HIS  21   7.693 -21.505 -21.505
  159    HD2  HIS  21           HD2      HIS  21   9.486 -18.443 -18.443
  160    HE1  HIS  21           HE1      HIS  21   5.944 -19.711 -19.711
  161    HE2  HIS  21           HE2      HIS  21   7.025 -17.902 -17.902
  162    H    SER  22           H        SER  22  10.124 -23.936 -23.936
  163    HA   SER  22           HA       SER  22  12.522 -25.194 -25.194
  164   1HB   SER  22          2HB       SER  22  10.409 -26.386 -26.386
  165   2HB   SER  22          1HB       SER  22  11.513 -27.243 -27.243
  166    HG   SER  22           HG       SER  22  10.343 -26.651 -26.651
  167    H    PHE  23           H        PHE  23  14.126 -26.227 -26.227
  168    HA   PHE  23           HA       PHE  23  14.188 -26.062 -26.062
  169   1HB   PHE  23          2HB       PHE  23  15.478 -23.975 -23.975
  170   2HB   PHE  23          1HB       PHE  23  16.540 -24.724 -24.724
  171    HD1  PHE  23           HD1      PHE  23  15.404 -25.015 -25.015
  172    HD2  PHE  23           HD2      PHE  23  14.295 -22.130 -22.130
  173    HE1  PHE  23           HE1      PHE  23  14.431 -23.606 -23.606
  174    HE2  PHE  23           HE2      PHE  23  13.318 -20.715 -20.715
  175    HZ   PHE  23           HZ       PHE  23  13.385 -21.454 -21.454
  176    H    ASP  24           H        ASP  24  14.347 -28.358 -28.358
  177    HA   ASP  24           HA       ASP  24  17.111 -29.172 -29.172
  178   1HB   ASP  24          2HB       ASP  24  15.469 -29.937 -29.937
  179   2HB   ASP  24          1HB       ASP  24  17.086 -30.521 -30.521
  180    HA   PRO  25           HA       PRO  25  13.859 -31.912 -31.912
  181   1HB   PRO  25          2HB       PRO  25  15.729 -31.659 -31.659
  182   2HB   PRO  25          1HB       PRO  25  13.974 -31.464 -31.464
  183   1HG   PRO  25          2HG       PRO  25  15.599 -29.356 -29.356
  184   2HG   PRO  25          1HG       PRO  25  14.102 -29.252 -29.252
  185   1HD   PRO  25          2HD       PRO  25  16.928 -29.546 -29.546
  186   2HD   PRO  25          1HD       PRO  25  15.620 -28.534 -28.534
  187    H    PHE  26           H        PHE  26  17.334 -31.904 -31.904
  188    HA   PHE  26           HA       PHE  26  17.540 -34.742 -34.742
  189   1HB   PHE  26          2HB       PHE  26  19.893 -33.302 -33.302
  190   2HB   PHE  26          1HB       PHE  26  19.777 -34.408 -34.408
  191    HD1  PHE  26           HD2      PHE  26  17.832 -33.143 -33.143
  192    HD2  PHE  26           HD1      PHE  26  20.924 -31.387 -31.387
  193    HE1  PHE  26           HE2      PHE  26  17.914 -31.235 -31.235
  194    HE2  PHE  26           HE1      PHE  26  21.011 -29.474 -29.474
  195    HZ   PHE  26           HZ       PHE  26  19.505 -29.397 -29.397
  196    H    ALA  27           H        ALA  27  17.583 -32.578 -32.578
  197    HA   ALA  27           HA       ALA  27  18.000 -34.880 -34.880
  198   1HB   ALA  27          1HB       ALA  27  18.665 -31.975 -31.975
  199   2HB   ALA  27          3HB       ALA  27  18.475 -33.004 -33.004
  200   3HB   ALA  27          2HB       ALA  27  19.705 -33.384 -33.384
  201    H    ASP  28           H        ASP  28  15.921 -35.614 -35.614
  202    HA   ASP  28           HA       ASP  28  13.813 -35.740 -35.740
  203   1HB   ASP  28          2HB       ASP  28  15.099 -34.635 -34.635
  204   2HB   ASP  28          1HB       ASP  28  14.257 -33.166 -33.166
  205    H    ALA  29           H        ALA  29  12.912 -35.343 -35.343
  206    HA   ALA  29           HA       ALA  29  12.131 -32.605 -32.605
  207   1HB   ALA  29          2HB       ALA  29  12.125 -35.180 -35.180
  208   2HB   ALA  29          1HB       ALA  29  11.188 -33.796 -33.796
  209   3HB   ALA  29          3HB       ALA  29  12.937 -33.661 -33.661
  210    H    SER  30           H        SER  30  10.862 -33.324 -33.324
  211    HA   SER  30           HA       SER  30   8.430 -34.684 -34.684
  212   1HB   SER  30          2HB       SER  30   9.352 -32.509 -32.509
  213   2HB   SER  30          1HB       SER  30   7.756 -33.248 -33.248
  214    HG   SER  30           HG       SER  30  10.182 -34.717 -34.717
  215    H    LYS  31           H        LYS  31   6.264 -33.474 -33.474
  216    HA   LYS  31           HA       LYS  31   6.063 -31.151 -31.151
  217   1HB   LYS  31          2HB       LYS  31   5.310 -33.456 -33.456
  218   2HB   LYS  31          1HB       LYS  31   3.907 -33.235 -33.235
  219   1HG   LYS  31          2HG       LYS  31   3.439 -31.098 -31.098
  220   2HG   LYS  31          1HG       LYS  31   4.810 -31.390 -31.390
  221   1HD   LYS  31          2HD       LYS  31   2.871 -33.594 -33.594
  222   2HD   LYS  31          1HD       LYS  31   2.251 -32.110 -32.110
  223   1HE   LYS  31          2HE       LYS  31   4.154 -32.109 -32.109
  224   2HE   LYS  31          1HE       LYS  31   4.717 -33.623 -33.623
  225   1HZ   LYS  31          3HZ       LYS  31   1.967 -33.669 -33.669
  226   2HZ   LYS  31          2HZ       LYS  31   3.081 -33.439 -33.439
  227   3HZ   LYS  31          1HZ       LYS  31   3.203 -34.797 -34.797
  228    H    GLY  32           H        GLY  32   6.219 -31.125 -31.125
  229   1HA   GLY  32          2HA       GLY  32   5.198 -29.862 -29.862
  230   2HA   GLY  32          1HA       GLY  32   3.839 -29.610 -29.610
  231    H    ASP  33           H        ASP  33   4.368 -30.619 -30.619
  232    HA   ASP  33           HA       ASP  33   2.283 -32.682 -32.682
  233   1HB   ASP  33          2HB       ASP  33   4.796 -33.455 -33.455
  234   2HB   ASP  33          1HB       ASP  33   4.400 -32.980 -32.980
  235    H    ASP  34           H        ASP  34   4.185 -30.770 -30.770
  236    HA   ASP  34           HA       ASP  34   1.661 -29.913 -29.913
  237   1HB   ASP  34          2HB       ASP  34   3.183 -31.806 -31.806
  238   2HB   ASP  34          1HB       ASP  34   3.924 -30.354 -30.354
  239    H    LEU  35           H        LEU  35   3.495 -28.592 -28.592
  240    HA   LEU  35           HA       LEU  35   4.825 -26.583 -26.583
  241   1HB   LEU  35          2HB       LEU  35   5.518 -27.714 -27.714
  242   2HB   LEU  35          1HB       LEU  35   4.718 -26.265 -26.265
  243    HG   LEU  35           HG       LEU  35   6.248 -24.892 -24.892
  244   1HD1  LEU  35          1HD1      LEU  35   7.103 -27.569 -27.569
  245   2HD1  LEU  35          3HD1      LEU  35   8.380 -26.384 -26.384
  246   3HD1  LEU  35          2HD1      LEU  35   7.075 -26.032 -26.032
  247   1HD2  LEU  35          2HD2      LEU  35   6.686 -25.701 -25.701
  248   2HD2  LEU  35          1HD2      LEU  35   8.008 -24.967 -24.967
  249   3HD2  LEU  35          3HD2      LEU  35   7.922 -26.720 -26.720
  250    H    LEU  36           H        LEU  36   2.985 -25.594 -25.594
  251    HA   LEU  36           HA       LEU  36   0.884 -24.493 -24.493
  252   1HB   LEU  36          2HB       LEU  36   1.774 -24.166 -24.166
  253   2HB   LEU  36          1HB       LEU  36   0.521 -23.132 -23.132
  254    HG   LEU  36           HG       LEU  36  -0.446 -25.006 -25.006
  255   1HD1  LEU  36          1HD1      LEU  36  -1.410 -24.043 -24.043
  256   2HD1  LEU  36          3HD1      LEU  36  -0.962 -25.610 -25.610
  257   3HD1  LEU  36          2HD1      LEU  36  -2.096 -25.521 -25.521
  258   1HD2  LEU  36          1HD2      LEU  36   1.512 -26.540 -26.540
  259   2HD2  LEU  36          3HD2      LEU  36  -0.095 -27.265 -27.265
  260   3HD2  LEU  36          2HD2      LEU  36   0.739 -26.847 -26.847
  261    HA   PRO  37           HA       PRO  37   2.814 -20.738 -20.738
  262   1HB   PRO  37          2HB       PRO  37   0.643 -19.230 -19.230
  263   2HB   PRO  37          1HB       PRO  37   1.081 -20.622 -20.622
  264   1HG   PRO  37          2HG       PRO  37  -0.968 -20.420 -20.420
  265   2HG   PRO  37          1HG       PRO  37  -1.090 -21.212 -21.212
  266   1HD   PRO  37          2HD       PRO  37  -0.583 -22.560 -22.560
  267   2HD   PRO  37          1HD       PRO  37  -0.010 -23.104 -23.104
  268    H    ALA  38           H        ALA  38   2.337 -18.215 -18.215
  269    HA   ALA  38           HA       ALA  38   1.548 -17.587 -17.587
  270   1HB   ALA  38          1HB       ALA  38   4.110 -18.283 -18.283
  271   2HB   ALA  38          3HB       ALA  38   4.243 -16.581 -16.581
  272   3HB   ALA  38          2HB       ALA  38   3.570 -17.034 -17.034
  273    H    GLY  39           H        GLY  39  -0.021 -16.243 -16.243
  274   1HA   GLY  39          2HA       GLY  39   1.005 -13.900 -13.900
  275   2HA   GLY  39          1HA       GLY  39  -0.592 -14.584 -14.584
  276    H    THR  40           H        THR  40   1.227 -13.688 -13.688
  277    HA   THR  40           HA       THR  40  -0.486 -11.472 -11.472
  278    HB   THR  40           HB       THR  40  -1.225 -12.553 -12.553
  279    HG1  THR  40           HG1      THR  40  -1.354 -14.737 -14.737
  280   1HG2  THR  40          1HG2      THR  40  -2.638 -12.064 -12.064
  281   2HG2  THR  40          3HG2      THR  40  -2.663 -13.823 -13.823
  282   3HG2  THR  40          2HG2      THR  40  -3.294 -13.026 -13.026
  283    H    GLU  41           H        GLU  41   1.785 -13.859 -13.859
  284    HA   GLU  41           HA       GLU  41   3.659 -13.644 -13.644
  285   1HB   GLU  41          2HB       GLU  41   3.522 -11.250 -11.250
  286   2HB   GLU  41          1HB       GLU  41   4.143 -10.855 -10.855
  287   1HG   GLU  41          2HG       GLU  41   5.259 -13.137 -13.137
  288   2HG   GLU  41          1HG       GLU  41   5.809 -11.481 -11.481
  289    H    ASP  42           H        ASP  42   0.803 -12.886 -12.886
  290    HA   ASP  42           HA       ASP  42  -0.183 -12.253 -12.253
  291   1HB   ASP  42          2HB       ASP  42   2.406 -13.476 -13.476
  292   2HB   ASP  42          1HB       ASP  42   1.602 -12.537 -12.537
  293    H    TYR  43           H        TYR  43   0.236 -10.066 -10.066
  294    HA   TYR  43           HA       TYR  43   2.079  -8.221  -8.221
  295   1HB   TYR  43          2HB       TYR  43  -0.610  -7.722  -7.722
  296   2HB   TYR  43          1HB       TYR  43   0.619  -6.494  -6.494
  297    HD1  TYR  43           HD2      TYR  43   2.854  -8.723  -8.723
  298    HD2  TYR  43           HD1      TYR  43  -0.564  -7.084  -7.084
  299    HE1  TYR  43           HE2      TYR  43   3.850  -9.236  -9.236
  300    HE2  TYR  43           HE1      TYR  43   0.426  -7.591  -7.591
  301    HH   TYR  43           HH       TYR  43   2.124  -9.218  -9.218
  302    H    ILE  44           H        ILE  44   1.519  -6.227  -6.227
  303    HA   ILE  44           HA       ILE  44  -0.357  -6.839  -6.839
  304    HB   ILE  44           HB       ILE  44   2.172  -5.189  -5.189
  305   1HG1  ILE  44          2HG1      ILE  44   2.670  -7.552  -7.552
  306   2HG1  ILE  44          1HG1      ILE  44   2.929  -6.972  -6.972
  307   1HG2  ILE  44          3HG2      ILE  44   0.109  -5.797  -5.797
  308   2HG2  ILE  44          2HG2      ILE  44   1.708  -5.139  -5.139
  309   3HG2  ILE  44          1HG2      ILE  44   0.566  -4.214  -4.214
  310   1HD1  ILE  44          2HD1      ILE  44   0.453  -7.789  -7.789
  311   2HD1  ILE  44          1HD1      ILE  44   0.859  -8.811  -8.811
  312   3HD1  ILE  44          3HD1      ILE  44   1.812  -8.908  -8.908
  313    H    HIS  45           H        HIS  45  -2.159  -5.805  -5.805
  314    HA   HIS  45           HA       HIS  45  -2.205  -3.288  -3.288
  315   1HB   HIS  45          2HB       HIS  45  -4.048  -5.347  -5.347
  316   2HB   HIS  45          1HB       HIS  45  -4.703  -3.842  -3.842
  317    HD1  HIS  45           HD1      HIS  45  -3.638  -5.455  -5.455
  318    HD2  HIS  45           HD2      HIS  45  -5.711  -2.115  -2.115
  319    HE1  HIS  45           HE1      HIS  45  -4.706  -4.459  -4.459
  320    HE2  HIS  45           HE2      HIS  45  -5.900  -2.401  -2.401
  321    H    ILE  46           H        ILE  46  -2.050  -1.331  -1.331
  322    HA   ILE  46           HA       ILE  46  -2.081  -0.923  -0.923
  323    HB   ILE  46           HB       ILE  46  -1.540   1.057   1.057
  324   1HG1  ILE  46          2HG1      ILE  46   0.080  -0.859  -0.859
  325   2HG1  ILE  46          1HG1      ILE  46   0.789   0.736   0.736
  326   1HG2  ILE  46          2HG2      ILE  46  -1.230   1.287   1.287
  327   2HG2  ILE  46          1HG2      ILE  46  -0.530   2.419   2.419
  328   3HG2  ILE  46          3HG2      ILE  46  -2.282   2.240   2.240
  329   1HD1  ILE  46          1HD1      ILE  46   0.277   0.190   0.190
  330   2HD1  ILE  46          3HD1      ILE  46   0.416  -1.461  -1.461
  331   3HD1  ILE  46          2HD1      ILE  46   1.759  -0.332  -0.332
  332    H    ARG  47           H        ARG  47  -3.273   1.659   1.659
  333    HA   ARG  47           HA       ARG  47  -5.384   2.448   2.448
  334   1HB   ARG  47          2HB       ARG  47  -6.116  -0.015  -0.015
  335   2HB   ARG  47          1HB       ARG  47  -6.611   0.563   0.563
  336   1HG   ARG  47          2HG       ARG  47  -7.528   2.145   2.145
  337   2HG   ARG  47          1HG       ARG  47  -8.225   0.535   0.535
  338   1HD   ARG  47          2HD       ARG  47  -8.188   1.796   1.796
  339   2HD   ARG  47          1HD       ARG  47  -8.884   2.922   2.922
  340    HE   ARG  47           HE       ARG  47 -10.083   0.540   0.540
  341   1HH1  ARG  47          2HH1      ARG  47  -9.886   2.593   2.593
  342   2HH1  ARG  47          1HH1      ARG  47 -11.445   2.133   2.133
  343   1HH2  ARG  47          1HH2      ARG  47 -12.133  -0.066  -0.066
  344   2HH2  ARG  47          2HH2      ARG  47 -12.720   0.624   0.624
  345    H    ILE  48           H        ILE  48  -6.358   4.166   4.166
  346    HA   ILE  48           HA       ILE  48  -5.962   4.745   4.745
  347    HB   ILE  48           HB       ILE  48  -5.625   6.458   6.458
  348   1HG1  ILE  48          2HG1      ILE  48  -4.230   6.368   6.368
  349   2HG1  ILE  48          1HG1      ILE  48  -3.680   5.564   5.564
  350   1HG2  ILE  48          3HG2      ILE  48  -6.585   7.501   7.501
  351   2HG2  ILE  48          2HG2      ILE  48  -5.839   8.504   8.504
  352   3HG2  ILE  48          1HG2      ILE  48  -7.364   7.682   7.682
  353   1HD1  ILE  48          3HD1      ILE  48  -3.996   8.539   8.539
  354   2HD1  ILE  48          2HD1      ILE  48  -2.476   7.653   7.653
  355   3HD1  ILE  48          1HD1      ILE  48  -3.340   7.696   7.696
  356    H    GLN  49           H        GLN  49  -7.630   6.019   6.019
  357    HA   GLN  49           HA       GLN  49 -10.171   6.186   6.186
  358   1HB   GLN  49          2HB       GLN  49 -11.410   5.113   5.113
  359   2HB   GLN  49          1HB       GLN  49 -10.176   4.018   4.018
  360   1HG   GLN  49          2HG       GLN  49  -8.841   5.206   5.206
  361   2HG   GLN  49          1HG       GLN  49 -10.488   5.246   5.246
  362   1HE2  GLN  49          2HE2      GLN  49 -10.538   1.910   1.910
  363   2HE2  GLN  49          1HE2      GLN  49 -11.259   3.480   3.480
  364    H    GLN  50           H        GLN  50 -10.256   8.371   8.371
  365    HA   GLN  50           HA       GLN  50  -9.892   9.780   9.780
  366   1HB   GLN  50          2HB       GLN  50  -9.151  10.397  10.397
  367   2HB   GLN  50          1HB       GLN  50 -10.550  11.425  11.425
  368   1HG   GLN  50          2HG       GLN  50  -9.499  12.373  12.373
  369   2HG   GLN  50          1HG       GLN  50  -8.125  11.287  11.287
  370   1HE2  GLN  50          2HE2      GLN  50  -6.434  13.661  13.661
  371   2HE2  GLN  50          1HE2      GLN  50  -6.455  12.475  12.475
  372    H    ARG  51           H        ARG  51 -11.681   9.735   9.735
  373    HA   ARG  51           HA       ARG  51 -14.299   9.456   9.456
  374   1HB   ARG  51          2HB       ARG  51 -13.226  10.566  10.566
  375   2HB   ARG  51          1HB       ARG  51 -14.937  10.286  10.286
  376   1HG   ARG  51          2HG       ARG  51 -14.488   7.909   7.909
  377   2HG   ARG  51          1HG       ARG  51 -12.772   8.192   8.192
  378   1HD   ARG  51          2HD       ARG  51 -14.108   7.300   7.300
  379   2HD   ARG  51          1HD       ARG  51 -13.173   8.760   8.760
  380    HE   ARG  51           HE       ARG  51 -16.068   8.519   8.519
  381   1HH1  ARG  51          2HH1      ARG  51 -13.296  10.642  10.642
  382   2HH1  ARG  51          1HH1      ARG  51 -14.209  11.987  11.987
  383   1HH2  ARG  51          1HH2      ARG  51 -17.262  10.290  10.290
  384   2HH2  ARG  51          2HH2      ARG  51 -16.457  11.789  11.789
  385    H    ASN  52           H        ASN  52 -13.342  12.370  12.370
  386    HA   ASN  52           HA       ASN  52 -15.140  13.929  13.929
  387   1HB   ASN  52          2HB       ASN  52 -15.035  14.017  14.017
  388   2HB   ASN  52          1HB       ASN  52 -13.597  15.007  15.007
  389   1HD2  ASN  52          2HD2      ASN  52 -15.824  17.691  17.691
  390   2HD2  ASN  52          1HD2      ASN  52 -14.622  16.774  16.774
  391    H    GLY  53           H        GLY  53 -12.991  13.163  13.163
  392   1HA   GLY  53          2HA       GLY  53 -11.276  13.941  13.941
  393   2HA   GLY  53          1HA       GLY  53 -12.038  15.511  15.511
  394    H    ARG  54           H        ARG  54 -10.845  13.764  13.764
  395    HA   ARG  54           HA       ARG  54  -8.288  15.091  15.091
  396   1HB   ARG  54          2HB       ARG  54  -8.612  16.538  16.538
  397   2HB   ARG  54          1HB       ARG  54 -10.055  16.759  16.759
  398   1HG   ARG  54          2HG       ARG  54 -10.958  16.628  16.628
  399   2HG   ARG  54          1HG       ARG  54 -11.059  14.944  14.944
  400   1HD   ARG  54          2HD       ARG  54  -9.460  14.263  14.263
  401   2HD   ARG  54          1HD       ARG  54  -8.565  15.778  15.778
  402    HE   ARG  54           HE       ARG  54 -11.063  16.111  16.111
  403   1HH1  ARG  54          2HH1      ARG  54  -7.785  14.995  14.995
  404   2HH1  ARG  54          1HH1      ARG  54  -7.781  15.293  15.293
  405   1HH2  ARG  54          1HH2      ARG  54 -11.058  16.504  16.504
  406   2HH2  ARG  54          2HH2      ARG  54  -9.638  16.150  16.150
  407    H    LYS  55           H        LYS  55 -10.685  13.178  13.178
  408    HA   LYS  55           HA       LYS  55  -8.772  12.054  12.054
  409   1HB   LYS  55          2HB       LYS  55 -11.431  12.273  12.273
  410   2HB   LYS  55          1HB       LYS  55 -11.341  10.659  10.659
  411   1HG   LYS  55          2HG       LYS  55 -11.458  10.304  10.304
  412   2HG   LYS  55          1HG       LYS  55  -9.747  10.115  10.115
  413   1HD   LYS  55          2HD       LYS  55 -10.036  12.827  12.827
  414   2HD   LYS  55          1HD       LYS  55 -11.060  12.033  12.033
  415   1HE   LYS  55          2HE       LYS  55  -8.183  11.312  11.312
  416   2HE   LYS  55          1HE       LYS  55  -8.717  12.391  12.391
  417   1HZ   LYS  55          2HZ       LYS  55  -9.765   9.638   9.638
  418   2HZ   LYS  55          1HZ       LYS  55  -8.325   9.964   9.964
  419   3HZ   LYS  55          3HZ       LYS  55  -9.778  10.655  10.655
  420    H    THR  56           H        THR  56  -7.385  11.638  11.638
  421    HA   THR  56           HA       THR  56  -8.003   9.398   9.398
  422    HB   THR  56           HB       THR  56  -5.157  10.025  10.025
  423    HG1  THR  56           HG1      THR  56  -5.616  12.085  12.085
  424   1HG2  THR  56          3HG2      THR  56  -7.006   9.469   9.469
  425   2HG2  THR  56          2HG2      THR  56  -5.788  10.691  10.691
  426   3HG2  THR  56          1HG2      THR  56  -5.295   9.085   9.085
  427    H    LEU  57           H        LEU  57  -7.435   7.279   7.279
  428    HA   LEU  57           HA       LEU  57  -5.810   6.430   6.430
  429   1HB   LEU  57          2HB       LEU  57  -8.696   5.849   5.849
  430   2HB   LEU  57          1HB       LEU  57  -7.692   4.543   4.543
  431    HG   LEU  57           HG       LEU  57  -7.615   7.209   7.209
  432   1HD1  LEU  57          3HD1      LEU  57  -9.842   5.234   5.234
  433   2HD1  LEU  57          2HD1      LEU  57  -9.395   6.043   6.043
  434   3HD1  LEU  57          1HD1      LEU  57  -9.889   6.993   6.993
  435   1HD2  LEU  57          2HD2      LEU  57  -6.940   4.381   4.381
  436   2HD2  LEU  57          1HD2      LEU  57  -6.033   5.859   5.859
  437   3HD2  LEU  57          3HD2      LEU  57  -7.429   5.449   5.449
  438    H    THR  58           H        THR  58  -4.216   5.753   5.753
  439    HA   THR  58           HA       THR  58  -4.690   4.182   4.182
  440    HB   THR  58           HB       THR  58  -2.187   4.374   4.374
  441    HG1  THR  58           HG1      THR  58  -3.207   6.339   6.339
  442   1HG2  THR  58          1HG2      THR  58  -2.646   2.660   2.660
  443   2HG2  THR  58          3HG2      THR  58  -1.827   4.034   4.034
  444   3HG2  THR  58          2HG2      THR  58  -1.075   3.182   3.182
  445    H    THR  59           H        THR  59  -4.674   1.987   1.987
  446    HA   THR  59           HA       THR  59  -4.589   0.306   0.306
  447    HB   THR  59           HB       THR  59  -6.084  -1.169  -1.169
  448    HG1  THR  59           HG1      THR  59  -7.582   0.249   0.249
  449   1HG2  THR  59          1HG2      THR  59  -6.780   0.653   0.653
  450   2HG2  THR  59          3HG2      THR  59  -8.090   0.047   0.047
  451   3HG2  THR  59          2HG2      THR  59  -7.031  -1.085  -1.085
  452    H    VAL  60           H        VAL  60  -3.913  -1.901  -1.901
  453    HA   VAL  60           HA       VAL  60  -2.203  -2.305  -2.305
  454    HB   VAL  60           HB       VAL  60  -1.469  -3.069  -3.069
  455   1HG1  VAL  60          1HG1      VAL  60  -0.668  -4.550  -4.550
  456   2HG1  VAL  60          3HG1      VAL  60   0.292  -3.169  -3.169
  457   3HG1  VAL  60          2HG1      VAL  60   0.575  -3.885  -3.885
  458   1HG2  VAL  60          1HG2      VAL  60  -0.869  -0.703  -0.703
  459   2HG2  VAL  60          3HG2      VAL  60  -1.023  -0.846  -0.846
  460   3HG2  VAL  60          2HG2      VAL  60   0.457  -1.375  -1.375
  461    H    GLN  61           H        GLN  61  -2.987  -3.974  -3.974
  462    HA   GLN  61           HA       GLN  61  -4.060  -6.272  -6.272
  463   1HB   GLN  61          2HB       GLN  61  -4.858  -6.229  -6.229
  464   2HB   GLN  61          1HB       GLN  61  -5.849  -6.354  -6.354
  465   1HG   GLN  61          2HG       GLN  61  -5.525  -3.822  -3.822
  466   2HG   GLN  61          1HG       GLN  61  -4.969  -3.900  -3.900
  467   1HE2  GLN  61          2HE2      GLN  61  -8.317  -5.334  -5.334
  468   2HE2  GLN  61          1HE2      GLN  61  -6.722  -5.997  -5.997
  469    H    GLY  62           H        GLY  62  -3.437  -8.328  -8.328
  470   1HA   GLY  62          2HA       GLY  62  -2.384  -9.828  -9.828
  471   2HA   GLY  62          1HA       GLY  62  -1.321  -8.500  -8.500
  472    H    ILE  63           H        ILE  63  -1.051  -7.741  -7.741
  473    HA   ILE  63           HA       ILE  63   1.316  -9.160  -9.160
  474    HB   ILE  63           HB       ILE  63  -0.379  -7.327  -7.327
  475   1HG1  ILE  63          2HG1      ILE  63   0.623  -6.010  -6.010
  476   2HG1  ILE  63          1HG1      ILE  63   1.800  -5.920  -5.920
  477   1HG2  ILE  63          3HG2      ILE  63   1.887  -8.998  -8.998
  478   2HG2  ILE  63          2HG2      ILE  63   2.050  -7.298  -7.298
  479   3HG2  ILE  63          1HG2      ILE  63   0.654  -8.219  -8.219
  480   1HD1  ILE  63          1HD1      ILE  63   2.898  -7.930  -7.930
  481   2HD1  ILE  63          3HD1      ILE  63   1.958  -7.349  -7.349
  482   3HD1  ILE  63          2HD1      ILE  63   3.132  -6.286  -6.286
  483    H    ALA  64           H        ALA  64   1.800 -10.671 -10.671
  484    HA   ALA  64           HA       ALA  64  -0.373 -12.499 -12.499
  485   1HB   ALA  64          1HB       ALA  64   1.990 -13.111 -13.111
  486   2HB   ALA  64          3HB       ALA  64   2.464 -12.923 -12.923
  487   3HB   ALA  64          2HB       ALA  64   1.241 -14.114 -14.114
  488    H    ASP  65           H        ASP  65  -1.307 -12.811 -12.811
  489    HA   ASP  65           HA       ASP  65  -1.026 -10.968 -10.968
  490   1HB   ASP  65          2HB       ASP  65  -3.027 -12.449 -12.449
  491   2HB   ASP  65          1HB       ASP  65  -2.137 -13.763 -13.763
  492    H    ASP  66           H        ASP  66   0.778 -13.782 -13.782
  493    HA   ASP  66           HA       ASP  66   1.715 -14.511 -14.511
  494   1HB   ASP  66          2HB       ASP  66   2.198 -15.273 -15.273
  495   2HB   ASP  66          1HB       ASP  66   3.753 -15.002 -15.002
  496    H    TYR  67           H        TYR  67   2.515 -11.895 -11.895
  497    HA   TYR  67           HA       TYR  67   5.103 -11.259 -11.259
  498   1HB   TYR  67          2HB       TYR  67   2.759  -9.455  -9.455
  499   2HB   TYR  67          1HB       TYR  67   4.403  -8.865  -8.865
  500    HD1  TYR  67           HD2      TYR  67   4.288 -12.097 -12.097
  501    HD2  TYR  67           HD1      TYR  67   3.900  -7.931  -7.931
  502    HE1  TYR  67           HE2      TYR  67   4.721 -12.496 -12.496
  503    HE2  TYR  67           HE1      TYR  67   4.329  -8.313  -8.313
  504    HH   TYR  67           HH       TYR  67   4.126 -10.201 -10.201
  505    H    ASP  68           H        ASP  68   5.468  -9.008  -9.008
  506    HA   ASP  68           HA       ASP  68   4.668  -9.589  -9.589
  507   1HB   ASP  68          2HB       ASP  68   6.681  -7.617  -7.617
  508   2HB   ASP  68          1HB       ASP  68   6.388  -7.905  -7.905
  509    H    LYS  69           H        LYS  69   2.512  -8.891  -8.891
  510    HA   LYS  69           HA       LYS  69   1.387  -6.634  -6.634
  511   1HB   LYS  69          2HB       LYS  69   0.808  -7.703  -7.703
  512   2HB   LYS  69          1HB       LYS  69  -0.279  -6.761  -6.761
  513   1HG   LYS  69          2HG       LYS  69  -0.003  -8.706  -8.706
  514   2HG   LYS  69          1HG       LYS  69   0.563  -9.612  -9.612
  515   1HD   LYS  69          2HD       LYS  69  -1.936  -8.072  -8.072
  516   2HD   LYS  69          1HD       LYS  69  -2.021  -9.467  -9.467
  517   1HE   LYS  69          2HE       LYS  69  -0.617 -10.444 -10.444
  518   2HE   LYS  69          1HE       LYS  69  -1.769  -9.347  -9.347
  519   1HZ   LYS  69          3HZ       LYS  69  -2.800 -11.161 -11.161
  520   2HZ   LYS  69          2HZ       LYS  69  -2.360 -11.846 -11.846
  521   3HZ   LYS  69          1HZ       LYS  69  -3.522 -10.618 -10.618
  522    H    LYS  70           H        LYS  70   3.434  -6.855  -6.855
  523    HA   LYS  70           HA       LYS  70   2.979  -4.127  -4.127
  524   1HB   LYS  70          2HB       LYS  70   4.727  -4.547  -4.547
  525   2HB   LYS  70          1HB       LYS  70   3.515  -5.821  -5.821
  526   1HG   LYS  70          2HG       LYS  70   5.229  -6.967  -6.967
  527   2HG   LYS  70          1HG       LYS  70   6.366  -5.915  -5.915
  528   1HD   LYS  70          2HD       LYS  70   6.467  -7.680  -7.680
  529   2HD   LYS  70          1HD       LYS  70   5.038  -6.905  -6.905
  530   1HE   LYS  70          2HE       LYS  70   4.022  -8.872  -8.872
  531   2HE   LYS  70          1HE       LYS  70   3.983  -8.444  -8.444
  532   1HZ   LYS  70          3HZ       LYS  70   6.255  -9.888  -9.888
  533   2HZ   LYS  70          2HZ       LYS  70   4.932 -10.685 -10.685
  534   3HZ   LYS  70          1HZ       LYS  70   5.918  -9.699  -9.699
  535    H    LYS  71           H        LYS  71   5.553  -5.925  -5.925
  536    HA   LYS  71           HA       LYS  71   7.225  -3.610  -3.610
  537   1HB   LYS  71          2HB       LYS  71   7.696  -6.288  -6.288
  538   2HB   LYS  71          1HB       LYS  71   7.705  -5.901  -5.901
  539   1HG   LYS  71          2HG       LYS  71   9.486  -4.367  -4.367
  540   2HG   LYS  71          1HG       LYS  71   9.346  -4.399  -4.399
  541   1HD   LYS  71          2HD       LYS  71  10.054  -6.817  -6.817
  542   2HD   LYS  71          1HD       LYS  71  11.258  -5.728  -5.728
  543   1HE   LYS  71          2HE       LYS  71   9.809  -6.203  -6.203
  544   2HE   LYS  71          1HE       LYS  71   9.491  -7.702  -7.702
  545   1HZ   LYS  71          3HZ       LYS  71  12.263  -6.780  -6.780
  546   2HZ   LYS  71          2HZ       LYS  71  11.554  -7.453  -7.453
  547   3HZ   LYS  71          1HZ       LYS  71  11.651  -8.357  -8.357
  548    H    LEU  72           H        LEU  72   4.368  -4.169  -4.169
  549    HA   LEU  72           HA       LEU  72   5.181  -3.186  -3.186
  550   1HB   LEU  72          2HB       LEU  72   2.834  -4.794  -4.794
  551   2HB   LEU  72          1HB       LEU  72   2.726  -3.859  -3.859
  552    HG   LEU  72           HG       LEU  72   4.025  -5.295  -5.295
  553   1HD1  LEU  72          3HD1      LEU  72   5.567  -5.839  -5.839
  554   2HD1  LEU  72          2HD1      LEU  72   5.915  -6.575  -6.575
  555   3HD1  LEU  72          1HD1      LEU  72   6.070  -4.828  -4.828
  556   1HD2  LEU  72          3HD2      LEU  72   2.301  -6.581  -6.581
  557   2HD2  LEU  72          2HD2      LEU  72   3.130  -7.315  -7.315
  558   3HD2  LEU  72          1HD2      LEU  72   3.811  -7.458  -7.458
  559    H    VAL  73           H        VAL  73   2.318  -2.927  -2.927
  560    HA   VAL  73           HA       VAL  73   1.762  -0.291  -0.291
  561    HB   VAL  73           HB       VAL  73   0.042  -2.062  -2.062
  562   1HG1  VAL  73          1HG1      VAL  73   1.046  -2.449  -2.449
  563   2HG1  VAL  73          3HG1      VAL  73   0.565  -0.817  -0.817
  564   3HG1  VAL  73          2HG1      VAL  73  -0.663  -2.020  -2.020
  565   1HG2  VAL  73          2HG2      VAL  73  -0.437   0.281   0.281
  566   2HG2  VAL  73          1HG2      VAL  73  -1.579  -0.374  -0.374
  567   3HG2  VAL  73          3HG2      VAL  73  -0.320   0.744   0.744
  568    H    LYS  74           H        LYS  74   2.888  -1.656  -1.656
  569    HA   LYS  74           HA       LYS  74   3.021   0.823   0.823
  570   1HB   LYS  74          2HB       LYS  74   3.378  -1.797  -1.797
  571   2HB   LYS  74          1HB       LYS  74   5.027  -1.189  -1.189
  572   1HG   LYS  74          2HG       LYS  74   3.909   0.768   0.768
  573   2HG   LYS  74          1HG       LYS  74   2.693  -0.470  -0.470
  574   1HD   LYS  74          2HD       LYS  74   4.121  -0.854  -0.854
  575   2HD   LYS  74          1HD       LYS  74   4.826  -1.930  -1.930
  576   1HE   LYS  74          2HE       LYS  74   6.480  -0.262  -0.262
  577   2HE   LYS  74          1HE       LYS  74   5.735   0.897   0.897
  578   1HZ   LYS  74          1HZ       LYS  74   6.980  -1.677  -1.677
  579   2HZ   LYS  74          3HZ       LYS  74   7.695  -0.152  -0.152
  580   3HZ   LYS  74          2HZ       LYS  74   6.303  -0.532  -0.532
  581    H    ALA  75           H        ALA  75   5.368  -1.061  -1.061
  582    HA   ALA  75           HA       ALA  75   7.579   0.641   0.641
  583   1HB   ALA  75          1HB       ALA  75   6.835  -1.387  -1.387
  584   2HB   ALA  75          3HB       ALA  75   8.291  -0.407  -0.407
  585   3HB   ALA  75          2HB       ALA  75   8.100  -1.464  -1.464
  586    H    PHE  76           H        PHE  76   4.992   0.538   0.538
  587    HA   PHE  76           HA       PHE  76   5.831   2.462   2.462
  588   1HB   PHE  76          2HB       PHE  76   3.648   1.065   1.065
  589   2HB   PHE  76          1HB       PHE  76   2.979   2.405   2.405
  590    HD1  PHE  76           HD2      PHE  76   4.307   1.355   1.355
  591    HD2  PHE  76           HD1      PHE  76   2.503   4.517   4.517
  592    HE1  PHE  76           HE2      PHE  76   3.847   2.548   2.548
  593    HE2  PHE  76           HE1      PHE  76   2.036   5.713   5.713
  594    HZ   PHE  76           HZ       PHE  76   2.708   4.727   4.727
  595    H    LYS  77           H        LYS  77   4.292   2.912   2.912
  596    HA   LYS  77           HA       LYS  77   4.064   5.742   5.742
  597   1HB   LYS  77          2HB       LYS  77   4.134   4.048   4.048
  598   2HB   LYS  77          1HB       LYS  77   3.450   5.660   5.660
  599   1HG   LYS  77          2HG       LYS  77   2.059   4.316   4.316
  600   2HG   LYS  77          1HG       LYS  77   2.325   3.044   3.044
  601   1HD   LYS  77          2HD       LYS  77   1.244   5.763   5.763
  602   2HD   LYS  77          1HD       LYS  77   0.209   4.398   4.398
  603   1HE   LYS  77          2HE       LYS  77   0.543   3.362   3.362
  604   2HE   LYS  77          1HE       LYS  77   2.245   3.817   3.817
  605   1HZ   LYS  77          2HZ       LYS  77   1.528   6.069   6.069
  606   2HZ   LYS  77          1HZ       LYS  77  -0.075   5.531   5.531
  607   3HZ   LYS  77          3HZ       LYS  77   1.071   4.887   4.887
  608    H    LYS  78           H        LYS  78   6.738   3.749   3.749
  609    HA   LYS  78           HA       LYS  78   8.215   5.783   5.783
  610   1HB   LYS  78          2HB       LYS  78   8.260   3.384   3.384
  611   2HB   LYS  78          1HB       LYS  78   9.111   2.996   2.996
  612   1HG   LYS  78          2HG       LYS  78  11.060   3.679   3.679
  613   2HG   LYS  78          1HG       LYS  78  10.364   5.184   5.184
  614   1HD   LYS  78          2HD       LYS  78  11.203   3.971   3.971
  615   2HD   LYS  78          1HD       LYS  78   9.441   3.876   3.876
  616   1HE   LYS  78          2HE       LYS  78  10.669   1.706   1.706
  617   2HE   LYS  78          1HE       LYS  78  11.182   1.752   1.752
  618   1HZ   LYS  78          2HZ       LYS  78   8.325   2.019   2.019
  619   2HZ   LYS  78          1HZ       LYS  78   9.027   0.485   0.485
  620   3HZ   LYS  78          3HZ       LYS  78   9.089   1.321   1.321
  621    H    LYS  79           H        LYS  79   7.808   4.495   4.495
  622    HA   LYS  79           HA       LYS  79  10.383   5.512   5.512
  623   1HB   LYS  79          2HB       LYS  79   9.009   3.286   3.286
  624   2HB   LYS  79          1HB       LYS  79   8.478   4.400   4.400
  625   1HG   LYS  79          2HG       LYS  79  11.158   4.836   4.836
  626   2HG   LYS  79          1HG       LYS  79  11.081   3.122   3.122
  627   1HD   LYS  79          2HD       LYS  79  10.992   2.857   2.857
  628   2HD   LYS  79          1HD       LYS  79   9.279   3.211   3.211
  629   1HE   LYS  79          2HE       LYS  79  10.183   4.544   4.544
  630   2HE   LYS  79          1HE       LYS  79   9.712   5.578   5.578
  631   1HZ   LYS  79          3HZ       LYS  79  12.484   4.644   4.644
  632   2HZ   LYS  79          2HZ       LYS  79  12.014   5.858   5.858
  633   3HZ   LYS  79          1HZ       LYS  79  11.861   6.103   6.103
  634    H    PHE  80           H        PHE  80   6.928   6.122   6.122
  635    HA   PHE  80           HA       PHE  80   7.596   8.570   8.570
  636   1HB   PHE  80          2HB       PHE  80   4.904   7.240   7.240
  637   2HB   PHE  80          1HB       PHE  80   5.622   8.385   8.385
  638    HD1  PHE  80           HD2      PHE  80   7.229   7.655   7.655
  639    HD2  PHE  80           HD1      PHE  80   5.472   4.898   4.898
  640    HE1  PHE  80           HE2      PHE  80   8.006   5.785   5.785
  641    HE2  PHE  80           HE1      PHE  80   6.247   3.023   3.023
  642    HZ   PHE  80           HZ       PHE  80   7.516   3.465   3.465
  643    H    ALA  81           H        ALA  81   6.118   7.287   7.287
  644    HA   ALA  81           HA       ALA  81   5.308   8.353   8.353
  645   1HB   ALA  81          2HB       ALA  81   6.904  10.217  10.217
  646   2HB   ALA  81          1HB       ALA  81   5.430  11.010  11.010
  647   3HB   ALA  81          3HB       ALA  81   5.633  10.624  10.624
  648    H    CYS  82           H        CYS  82   3.669   7.324   7.324
  649    HA   CYS  82           HA       CYS  82   1.341   9.118   9.118
  650   1HB   CYS  82          2HB       CYS  82   2.474   7.826   7.826
  651   2HB   CYS  82          1HB       CYS  82   1.102   6.802   6.802
  652    HG   CYS  82           HG       CYS  82  -0.317   8.425   8.425
  653    H    ASN  83           H        ASN  83  -0.793   7.683   7.683
  654    HA   ASN  83           HA       ASN  83  -0.649   5.767   5.767
  655   1HB   ASN  83          2HB       ASN  83  -2.137   7.339   7.339
  656   2HB   ASN  83          1HB       ASN  83  -2.656   7.800   7.800
  657   1HD2  ASN  83          2HD2      ASN  83  -5.141   5.291   5.291
  658   2HD2  ASN  83          1HD2      ASN  83  -3.987   6.180   6.180
  659    H    GLY  84           H        GLY  84  -1.105   3.684   3.684
  660   1HA   GLY  84          2HA       GLY  84  -2.479   3.048   3.048
  661   2HA   GLY  84          1HA       GLY  84  -1.086   2.139   2.139
  662    H    THR  85           H        THR  85  -3.905   1.371   1.371
  663    HA   THR  85           HA       THR  85  -4.473   0.068   0.068
  664    HB   THR  85           HB       THR  85  -6.885   0.117   0.117
  665    HG1  THR  85           HG1      THR  85  -7.486   0.879   0.879
  666   1HG2  THR  85          2HG2      THR  85  -5.355   2.615   2.615
  667   2HG2  THR  85          1HG2      THR  85  -7.071   2.735   2.735
  668   3HG2  THR  85          3HG2      THR  85  -6.552   1.807   1.807
  669    H    VAL  86           H        VAL  86  -5.632  -2.000  -2.000
  670    HA   VAL  86           HA       VAL  86  -4.905  -3.407  -3.407
  671    HB   VAL  86           HB       VAL  86  -3.571  -4.146  -4.146
  672   1HG1  VAL  86          3HG1      VAL  86  -5.849  -3.756  -3.756
  673   2HG1  VAL  86          2HG1      VAL  86  -5.724  -5.514  -5.514
  674   3HG1  VAL  86          1HG1      VAL  86  -4.381  -4.560  -4.560
  675   1HG2  VAL  86          2HG2      VAL  86  -4.730  -5.716  -5.716
  676   2HG2  VAL  86          1HG2      VAL  86  -3.632  -6.329  -6.329
  677   3HG2  VAL  86          3HG2      VAL  86  -5.376  -6.457  -6.457
  678    H    ILE  87           H        ILE  87  -7.108  -2.595  -2.595
  679    HA   ILE  87           HA       ILE  87  -9.384  -3.867  -3.867
  680    HB   ILE  87           HB       ILE  87 -10.720  -2.774  -2.774
  681   1HG1  ILE  87          2HG1      ILE  87  -8.549  -1.166  -1.166
  682   2HG1  ILE  87          1HG1      ILE  87  -8.402  -2.876  -2.876
  683   1HG2  ILE  87          2HG2      ILE  87  -8.682  -0.980  -0.980
  684   2HG2  ILE  87          1HG2      ILE  87 -10.198  -0.435  -0.435
  685   3HG2  ILE  87          3HG2      ILE  87 -10.220  -1.508  -1.508
  686   1HD1  ILE  87          3HD1      ILE  87 -10.988  -1.434  -1.434
  687   2HD1  ILE  87          2HD1      ILE  87  -9.697  -1.341  -1.341
  688   3HD1  ILE  87          1HD1      ILE  87 -10.398  -2.903  -2.903
  689    H    GLU  88           H        GLU  88 -10.742  -5.398  -5.398
  690    HA   GLU  88           HA       GLU  88  -9.462  -7.043  -7.043
  691   1HB   GLU  88          2HB       GLU  88 -10.194  -7.929  -7.929
  692   2HB   GLU  88          1HB       GLU  88 -11.796  -7.966  -7.966
  693   1HG   GLU  88          2HG       GLU  88 -10.723  -9.322  -9.322
  694   2HG   GLU  88          1HG       GLU  88  -9.356  -9.514  -9.514
  695    H    HIS  89           H        HIS  89 -10.229  -5.465  -5.465
  696    HA   HIS  89           HA       HIS  89 -12.837  -4.757  -4.757
  697   1HB   HIS  89          2HB       HIS  89 -10.522  -4.227  -4.227
  698   2HB   HIS  89          1HB       HIS  89 -11.148  -5.419  -5.419
  699    HD1  HIS  89           HD1      HIS  89 -12.731  -4.574  -4.574
  700    HD2  HIS  89           HD2      HIS  89 -12.370  -1.968  -1.968
  701    HE1  HIS  89           HE1      HIS  89 -14.070  -2.542  -2.542
  702    HE2  HIS  89           HE2      HIS  89 -13.844  -0.978  -0.978
  703    HA   PRO  90           HA       PRO  90 -14.703  -8.664  -8.664
  704   1HB   PRO  90          2HB       PRO  90 -17.127  -7.740  -7.740
  705   2HB   PRO  90          1HB       PRO  90 -16.614  -7.792  -7.792
  706   1HG   PRO  90          2HG       PRO  90 -16.649  -5.479  -5.479
  707   2HG   PRO  90          1HG       PRO  90 -17.142  -5.535  -5.535
  708   1HD   PRO  90          2HD       PRO  90 -14.733  -4.569  -4.569
  709   2HD   PRO  90          1HD       PRO  90 -14.985  -5.324  -5.324
  710    H    GLU  91           H        GLU  91 -14.162  -6.023  -6.023
  711    HA   GLU  91           HA       GLU  91 -15.166  -7.359  -7.359
  712   1HB   GLU  91          2HB       GLU  91 -14.547  -4.708  -4.708
  713   2HB   GLU  91          1HB       GLU  91 -13.438  -5.138  -5.138
  714   1HG   GLU  91          2HG       GLU  91 -16.439  -5.324  -5.324
  715   2HG   GLU  91          1HG       GLU  91 -15.437  -4.113  -4.113
  716    H    TYR  92           H        TYR  92 -12.163  -7.088  -7.088
  717    HA   TYR  92           HA       TYR  92 -10.849  -8.605  -8.605
  718   1HB   TYR  92          2HB       TYR  92  -9.230  -6.884  -6.884
  719   2HB   TYR  92          1HB       TYR  92  -8.900  -7.374  -7.374
  720    HD1  TYR  92           HD2      TYR  92 -11.068  -6.518  -6.518
  721    HD2  TYR  92           HD1      TYR  92  -9.420  -4.595  -4.595
  722    HE1  TYR  92           HE2      TYR  92 -11.925  -4.362  -4.362
  723    HE2  TYR  92           HE1      TYR  92 -10.272  -2.431  -2.431
  724    HH   TYR  92           HH       TYR  92 -12.522  -2.167  -2.167
  725    H    GLY  93           H        GLY  93 -10.651  -7.819  -7.819
  726   1HA   GLY  93          2HA       GLY  93 -10.937 -10.075 -10.075
  727   2HA   GLY  93          1HA       GLY  93  -9.410 -10.431 -10.431
  728    H    GLU  94           H        GLU  94  -7.607  -9.913  -9.913
  729    HA   GLU  94           HA       GLU  94  -7.850  -8.125  -8.125
  730   1HB   GLU  94          2HB       GLU  94  -6.912 -10.645 -10.645
  731   2HB   GLU  94          1HB       GLU  94  -5.417  -9.784  -9.784
  732   1HG   GLU  94          2HG       GLU  94  -5.340  -8.812  -8.812
  733   2HG   GLU  94          1HG       GLU  94  -7.091  -8.818  -8.818
  734    H    VAL  95           H        VAL  95  -7.552  -6.138  -6.138
  735    HA   VAL  95           HA       VAL  95  -4.893  -5.720  -5.720
  736    HB   VAL  95           HB       VAL  95  -5.853  -3.876  -3.876
  737   1HG1  VAL  95          1HG1      VAL  95  -5.892  -6.458  -6.458
  738   2HG1  VAL  95          3HG1      VAL  95  -7.630  -6.156  -6.156
  739   3HG1  VAL  95          2HG1      VAL  95  -6.548  -5.219  -5.219
  740   1HG2  VAL  95          1HG2      VAL  95  -7.733  -3.408  -3.408
  741   2HG2  VAL  95          3HG2      VAL  95  -8.207  -3.469  -3.469
  742   3HG2  VAL  95          2HG2      VAL  95  -8.550  -4.836  -4.836
  743    H    ILE  96           H        ILE  96  -3.671  -4.060  -4.060
  744    HA   ILE  96           HA       ILE  96  -4.415  -2.902  -2.902
  745    HB   ILE  96           HB       ILE  96  -1.993  -2.742  -2.742
  746   1HG1  ILE  96          2HG1      ILE  96  -2.693  -4.445  -4.445
  747   2HG1  ILE  96          1HG1      ILE  96  -1.021  -4.047  -4.047
  748   1HG2  ILE  96          3HG2      ILE  96  -2.538  -0.923  -0.923
  749   2HG2  ILE  96          2HG2      ILE  96  -0.948  -1.175  -1.175
  750   3HG2  ILE  96          1HG2      ILE  96  -2.245  -0.450  -0.450
  751   1HD1  ILE  96          2HD1      ILE  96  -2.607  -2.566  -2.566
  752   2HD1  ILE  96          1HD1      ILE  96  -1.677  -4.020  -4.020
  753   3HD1  ILE  96          3HD1      ILE  96  -0.860  -2.577  -2.577
  754    H    GLN  97           H        GLN  97  -4.474  -0.585  -0.585
  755    HA   GLN  97           HA       GLN  97  -5.271   1.005   1.005
  756   1HB   GLN  97          2HB       GLN  97  -6.938   0.145   0.145
  757   2HB   GLN  97          1HB       GLN  97  -6.762   1.891   1.891
  758   1HG   GLN  97          2HG       GLN  97  -7.437   2.011   2.011
  759   2HG   GLN  97          1HG       GLN  97  -7.790   0.284   0.284
  760   1HE2  GLN  97          2HE2      GLN  97 -10.088   2.770   2.770
  761   2HE2  GLN  97          1HE2      GLN  97  -8.393   3.053   3.053
  762    H    LEU  98           H        LEU  98  -3.473   2.286   2.286
  763    HA   LEU  98           HA       LEU  98  -2.430   3.537   3.537
  764   1HB   LEU  98          2HB       LEU  98  -1.619   4.044   4.044
  765   2HB   LEU  98          1HB       LEU  98  -0.718   4.448   4.448
  766    HG   LEU  98           HG       LEU  98  -1.366   1.587   1.587
  767   1HD1  LEU  98          2HD1      LEU  98   0.385   3.344   3.344
  768   2HD1  LEU  98          1HD1      LEU  98   1.209   1.924   1.924
  769   3HD1  LEU  98          3HD1      LEU  98  -0.216   1.728   1.728
  770   1HD2  LEU  98          2HD2      LEU  98   0.459   3.100   3.100
  771   2HD2  LEU  98          1HD2      LEU  98  -0.418   1.597   1.597
  772   3HD2  LEU  98          3HD2      LEU  98   1.061   1.585   1.585
  773    H    GLN  99           H        GLN  99  -2.221   5.850   5.850
  774    HA   GLN  99           HA       GLN  99  -4.630   7.204   7.204
  775   1HB   GLN  99          2HB       GLN  99  -2.964   7.357   7.357
  776   2HB   GLN  99          1HB       GLN  99  -3.024   8.942   8.942
  777   1HG   GLN  99          2HG       GLN  99  -5.634   7.673   7.673
  778   2HG   GLN  99          1HG       GLN  99  -4.872   7.901   7.901
  779   1HE2  GLN  99          2HE2      GLN  99  -6.251  11.055  11.055
  780   2HE2  GLN  99          1HE2      GLN  99  -6.197   9.458   9.458
  781    H    GLY 100           H        GLY 100  -4.685   9.070   9.070
  782   1HA   GLY 100          2HA       GLY 100  -3.932  10.744  10.744
  783   2HA   GLY 100          1HA       GLY 100  -2.304  10.442  10.442
  784    H    ASP 101           H        ASP 101  -2.413  11.028  11.028
  785    HA   ASP 101           HA       ASP 101  -2.839   8.753   8.753
  786   1HB   ASP 101          2HB       ASP 101  -1.771  10.198  10.198
  787   2HB   ASP 101          1HB       ASP 101  -3.156  10.938  10.938
  788    H    GLN 102           H        GLN 102  -1.495   7.232   7.232
  789    HA   GLN 102           HA       GLN 102   1.383   7.633   7.633
  790   1HB   GLN 102          2HB       GLN 102  -0.428   5.913   5.913
  791   2HB   GLN 102          1HB       GLN 102   1.065   5.137   5.137
  792   1HG   GLN 102          2HG       GLN 102   1.030   6.280   6.280
  793   2HG   GLN 102          1HG       GLN 102   2.392   6.617   6.617
  794   1HE2  GLN 102          2HE2      GLN 102  -0.428   9.567   9.567
  795   2HE2  GLN 102          1HE2      GLN 102  -0.878   7.918   7.918
  796    H    ARG 103           H        ARG 103  -0.687   6.895   6.895
  797    HA   ARG 103           HA       ARG 103  -0.198   4.372   4.372
  798   1HB   ARG 103          2HB       ARG 103  -0.747   5.279   5.279
  799   2HB   ARG 103          1HB       ARG 103  -1.834   5.912   5.912
  800   1HG   ARG 103          2HG       ARG 103  -1.132   8.028   8.028
  801   2HG   ARG 103          1HG       ARG 103   0.548   7.551   7.551
  802   1HD   ARG 103          2HD       ARG 103   0.256   7.944   7.944
  803   2HD   ARG 103          1HD       ARG 103  -0.840   6.565   6.565
  804    HE   ARG 103           HE       ARG 103  -2.338   8.710   8.710
  805   1HH1  ARG 103          2HH1      ARG 103  -0.508   7.884   7.884
  806   2HH1  ARG 103          1HH1      ARG 103  -1.498   8.832   8.832
  807   1HH2  ARG 103          1HH2      ARG 103  -3.639   9.956   9.956
  808   2HH2  ARG 103          2HH2      ARG 103  -3.274  10.009  10.009
  809    H    LYS 104           H        LYS 104   1.893   7.141   7.141
  810    HA   LYS 104           HA       LYS 104   3.852   5.796   5.796
  811   1HB   LYS 104          2HB       LYS 104   3.096   8.317   8.317
  812   2HB   LYS 104          1HB       LYS 104   4.273   8.543   8.543
  813   1HG   LYS 104          2HG       LYS 104   5.388   6.940   6.940
  814   2HG   LYS 104          1HG       LYS 104   4.749   8.458   8.458
  815   1HD   LYS 104          2HD       LYS 104   6.675   8.193   8.193
  816   2HD   LYS 104          1HD       LYS 104   7.107   8.655   8.655
  817   1HE   LYS 104          2HE       LYS 104   4.945  10.237  10.237
  818   2HE   LYS 104          1HE       LYS 104   6.515  10.404  10.404
  819   1HZ   LYS 104          2HZ       LYS 104   7.261  10.648  10.648
  820   2HZ   LYS 104          1HZ       LYS 104   5.677  11.222  11.222
  821   3HZ   LYS 104          3HZ       LYS 104   6.746  11.972  11.972
  822    H    ASN 105           H        ASN 105   3.183   6.609   6.609
  823    HA   ASN 105           HA       ASN 105   5.926   6.317   6.317
  824   1HB   ASN 105          2HB       ASN 105   3.329   7.006   7.006
  825   2HB   ASN 105          1HB       ASN 105   4.525   6.232   6.232
  826   1HD2  ASN 105          1HD2      ASN 105   3.403   9.122   9.122
  827   2HD2  ASN 105          2HD2      ASN 105   4.787  10.106  10.106
  828    H    ILE 106           H        ILE 106   3.000   4.376   4.376
  829    HA   ILE 106           HA       ILE 106   3.914   2.274   2.274
  830    HB   ILE 106           HB       ILE 106   1.536   2.588   2.588
  831   1HG1  ILE 106          2HG1      ILE 106   1.023   0.185   0.185
  832   2HG1  ILE 106          1HG1      ILE 106   2.723  -0.075  -0.075
  833   1HG2  ILE 106          1HG2      ILE 106   1.966   3.170   3.170
  834   2HG2  ILE 106          3HG2      ILE 106   2.155   1.444   1.444
  835   3HG2  ILE 106          2HG2      ILE 106   0.618   2.075   2.075
  836   1HD1  ILE 106          3HD1      ILE 106   2.701   1.185   1.185
  837   2HD1  ILE 106          2HD1      ILE 106   1.403  -0.007  -0.007
  838   3HD1  ILE 106          1HD1      ILE 106   3.044  -0.510  -0.510
  839    H    CYS 107           H        CYS 107   3.866   2.660   2.660
  840    HA   CYS 107           HA       CYS 107   5.010   0.244   0.244
  841   1HB   CYS 107          2HB       CYS 107   4.235   1.687   1.687
  842   2HB   CYS 107          1HB       CYS 107   5.238   3.019   3.019
  843    HG   CYS 107           HG       CYS 107   7.268   1.966   1.966
  844    H    GLN 108           H        GLN 108   6.401   3.110   3.110
  845    HA   GLN 108           HA       GLN 108   9.146   2.397   2.397
  846   1HB   GLN 108          2HB       GLN 108   7.633   4.467   4.467
  847   2HB   GLN 108          1HB       GLN 108   9.282   4.124   4.124
  848   1HG   GLN 108          2HG       GLN 108   8.864   4.564   4.564
  849   2HG   GLN 108          1HG       GLN 108   8.621   5.960   5.960
  850   1HE2  GLN 108          2HE2      GLN 108  12.307   4.261   4.261
  851   2HE2  GLN 108          1HE2      GLN 108  10.868   3.318   3.318
  852    H    PHE 109           H        PHE 109   6.792   2.152   2.152
  853    HA   PHE 109           HA       PHE 109   8.497   1.103   1.103
  854   1HB   PHE 109          2HB       PHE 109   6.179   2.041   2.041
  855   2HB   PHE 109          1HB       PHE 109   5.545   0.532   0.532
  856    HD1  PHE 109           HD2      PHE 109   8.025   1.633   1.633
  857    HD2  PHE 109           HD1      PHE 109   4.858  -1.013  -1.013
  858    HE1  PHE 109           HE2      PHE 109   8.122   0.641   0.641
  859    HE2  PHE 109           HE1      PHE 109   4.948  -2.008  -2.008
  860    HZ   PHE 109           HZ       PHE 109   6.582  -1.181  -1.181
  861    H    LEU 110           H        LEU 110   6.317  -0.520  -0.520
  862    HA   LEU 110           HA       LEU 110   6.800  -3.148  -3.148
  863   1HB   LEU 110          2HB       LEU 110   5.847  -1.826  -1.826
  864   2HB   LEU 110          1HB       LEU 110   6.343  -3.502  -3.502
  865    HG   LEU 110           HG       LEU 110   4.646  -4.228  -4.228
  866   1HD1  LEU 110          3HD1      LEU 110   4.132  -1.326  -1.326
  867   2HD1  LEU 110          2HD1      LEU 110   3.194  -2.694  -2.694
  868   3HD1  LEU 110          1HD1      LEU 110   4.885  -2.511  -2.511
  869   1HD2  LEU 110          1HD2      LEU 110   3.921  -3.578  -3.578
  870   2HD2  LEU 110          3HD2      LEU 110   2.635  -3.527  -3.527
  871   3HD2  LEU 110          2HD2      LEU 110   3.391  -2.031  -2.031
  872    H    VAL 111           H        VAL 111   8.703  -0.971  -0.971
  873    HA   VAL 111           HA       VAL 111  10.525  -3.114  -3.114
  874    HB   VAL 111           HB       VAL 111  10.585  -0.174  -0.174
  875   1HG1  VAL 111          1HG1      VAL 111  12.357  -2.464  -2.464
  876   2HG1  VAL 111          3HG1      VAL 111  12.023  -1.299  -1.299
  877   3HG1  VAL 111          2HG1      VAL 111  12.748  -0.761  -0.761
  878   1HG2  VAL 111          3HG2      VAL 111   8.675  -1.798  -1.798
  879   2HG2  VAL 111          2HG2      VAL 111   9.405  -0.614  -0.614
  880   3HG2  VAL 111          1HG2      VAL 111   9.918  -2.300  -2.300
  881    H    GLU 112           H        GLU 112  10.265  -0.508  -0.508
  882    HA   GLU 112           HA       GLU 112  13.067  -0.326  -0.326
  883   1HB   GLU 112          2HB       GLU 112  10.591   0.725   0.725
  884   2HB   GLU 112          1HB       GLU 112  12.194   0.942   0.942
  885   1HG   GLU 112          2HG       GLU 112  12.043   1.726   1.726
  886   2HG   GLU 112          1HG       GLU 112  10.944   2.633   2.633
  887    H    ILE 113           H        ILE 113  10.280  -1.945  -1.945
  888    HA   ILE 113           HA       ILE 113  12.005  -3.162  -3.162
  889    HB   ILE 113           HB       ILE 113  10.065  -3.802  -3.802
  890   1HG1  ILE 113          2HG1      ILE 113   8.511  -3.179  -3.179
  891   2HG1  ILE 113          1HG1      ILE 113   8.770  -4.767  -4.767
  892   1HG2  ILE 113          3HG2      ILE 113  10.626  -1.306  -1.306
  893   2HG2  ILE 113          2HG2      ILE 113   9.177  -1.198  -1.198
  894   3HG2  ILE 113          1HG2      ILE 113   9.056  -1.755  -1.755
  895   1HD1  ILE 113          3HD1      ILE 113   7.507  -2.868  -2.868
  896   2HD1  ILE 113          2HD1      ILE 113   6.568  -3.214  -3.214
  897   3HD1  ILE 113          1HD1      ILE 113   7.074  -4.531  -4.531
  898    H    GLY 114           H        GLY 114  11.144  -3.847  -3.847
  899   1HA   GLY 114          2HA       GLY 114  11.392  -5.763  -5.763
  900   2HA   GLY 114          1HA       GLY 114  11.981  -6.567  -6.567
  901    H    LEU 115           H        LEU 115   8.878  -4.960  -4.960
  902    HA   LEU 115           HA       LEU 115   7.506  -7.306  -7.306
  903   1HB   LEU 115          2HB       LEU 115   7.010  -4.668  -4.668
  904   2HB   LEU 115          1HB       LEU 115   5.960  -5.042  -5.042
  905    HG   LEU 115           HG       LEU 115   4.720  -6.627  -6.627
  906   1HD1  LEU 115          3HD1      LEU 115   6.920  -6.232  -6.232
  907   2HD1  LEU 115          2HD1      LEU 115   5.322  -6.774  -6.774
  908   3HD1  LEU 115          1HD1      LEU 115   6.251  -7.732  -7.732
  909   1HD2  LEU 115          2HD2      LEU 115   4.511  -4.019  -4.019
  910   2HD2  LEU 115          1HD2      LEU 115   3.559  -5.134  -5.134
  911   3HD2  LEU 115          3HD2      LEU 115   5.019  -4.400  -4.400
  912    H    ALA 116           H        ALA 116   6.709  -5.285  -5.285
  913    HA   ALA 116           HA       ALA 116   5.707  -7.644  -7.644
  914   1HB   ALA 116          3HB       ALA 116   4.486  -5.416  -5.416
  915   2HB   ALA 116          2HB       ALA 116   5.692  -4.829  -4.829
  916   3HB   ALA 116          1HB       ALA 116   4.638  -6.172  -6.172
  917    H    LYS 117           H        LYS 117   6.147  -6.920  -6.920
  918    HA   LYS 117           HA       LYS 117   9.083  -6.956  -6.956
  919   1HB   LYS 117          2HB       LYS 117   7.144  -8.935  -8.935
  920   2HB   LYS 117          1HB       LYS 117   8.119  -8.351  -8.351
  921   1HG   LYS 117          2HG       LYS 117   9.237  -9.424  -9.424
  922   2HG   LYS 117          1HG       LYS 117   9.036 -10.365 -10.365
  923   1HD   LYS 117          2HD       LYS 117  11.079  -9.687  -9.687
  924   2HD   LYS 117          1HD       LYS 117  10.390  -8.080  -8.080
  925   1HE   LYS 117          2HE       LYS 117  10.776  -7.838  -7.838
  926   2HE   LYS 117          1HE       LYS 117  11.905  -9.172  -9.172
  927   1HZ   LYS 117          3HZ       LYS 117  12.995  -7.809  -7.809
  928   2HZ   LYS 117          2HZ       LYS 117  11.993  -6.514  -6.514
  929   3HZ   LYS 117          1HZ       LYS 117  13.095  -7.132  -7.132
  930    H    ASP 118           H        ASP 118   9.968  -5.915  -5.915
  931    HA   ASP 118           HA       ASP 118   8.714  -3.602  -3.602
  932   1HB   ASP 118          2HB       ASP 118  10.490  -3.335  -3.335
  933   2HB   ASP 118          1HB       ASP 118  11.166  -4.065  -4.065
  934    H    ASP 119           H        ASP 119   8.518  -6.820  -6.820
  935    HA   ASP 119           HA       ASP 119   7.272  -5.998  -5.998
  936   1HB   ASP 119          2HB       ASP 119   8.604  -8.262  -8.262
  937   2HB   ASP 119          1HB       ASP 119   6.927  -8.796  -8.796
  938    H    GLN 120           H        GLN 120   6.284  -6.758  -6.758
  939    HA   GLN 120           HA       GLN 120   3.516  -7.214  -7.214
  940   1HB   GLN 120          2HB       GLN 120   4.732  -7.034  -7.034
  941   2HB   GLN 120          1HB       GLN 120   3.131  -7.639  -7.639
  942   1HG   GLN 120          2HG       GLN 120   4.281  -9.423  -9.423
  943   2HG   GLN 120          1HG       GLN 120   5.787  -8.892  -8.892
  944   1HE2  GLN 120          2HE2      GLN 120   4.169  -9.767  -9.767
  945   2HE2  GLN 120          1HE2      GLN 120   4.509  -8.258  -8.258
  946    H    LEU 121           H        LEU 121   5.468  -4.562  -4.562
  947    HA   LEU 121           HA       LEU 121   3.949  -2.859  -2.859
  948   1HB   LEU 121          2HB       LEU 121   5.695  -2.259  -2.259
  949   2HB   LEU 121          1HB       LEU 121   4.998  -1.012  -1.012
  950    HG   LEU 121           HG       LEU 121   6.830  -3.178  -3.178
  951   1HD1  LEU 121          3HD1      LEU 121   7.399  -0.422  -0.422
  952   2HD1  LEU 121          2HD1      LEU 121   8.435  -1.175  -1.175
  953   3HD1  LEU 121          1HD1      LEU 121   8.224  -1.938  -1.938
  954   1HD2  LEU 121          3HD2      LEU 121   5.337  -0.952  -0.952
  955   2HD2  LEU 121          2HD2      LEU 121   5.870  -2.485  -2.485
  956   3HD2  LEU 121          1HD2      LEU 121   7.009  -1.149  -1.149
  957    H    LYS 122           H        LYS 122   1.777  -3.038  -3.038
  958    HA   LYS 122           HA       LYS 122   0.748  -2.117  -2.117
  959   1HB   LYS 122          2HB       LYS 122  -0.091  -4.253  -4.253
  960   2HB   LYS 122          1HB       LYS 122  -1.405  -3.265  -3.265
  961   1HG   LYS 122          2HG       LYS 122   0.646  -4.646  -4.646
  962   2HG   LYS 122          1HG       LYS 122  -0.959  -5.283  -5.283
  963   1HD   LYS 122          2HD       LYS 122  -1.998  -3.818  -3.818
  964   2HD   LYS 122          1HD       LYS 122  -0.837  -2.527  -2.527
  965   1HE   LYS 122          2HE       LYS 122   0.825  -3.798  -3.798
  966   2HE   LYS 122          1HE       LYS 122  -0.469  -4.914  -4.914
  967   1HZ   LYS 122          1HZ       LYS 122  -1.643  -2.678  -2.678
  968   2HZ   LYS 122          3HZ       LYS 122  -0.047  -2.139  -2.139
  969   3HZ   LYS 122          2HZ       LYS 122  -0.586  -3.466  -3.466
  970    H    VAL 123           H        VAL 123   0.949   0.094   0.094
  971    HA   VAL 123           HA       VAL 123  -0.730   0.972   0.972
  972    HB   VAL 123           HB       VAL 123   1.547   1.897   1.897
  973   1HG1  VAL 123          1HG1      VAL 123   1.233   1.947   1.947
  974   2HG1  VAL 123          3HG1      VAL 123   0.858   3.630   3.630
  975   3HG1  VAL 123          2HG1      VAL 123   2.411   2.946   2.946
  976   1HG2  VAL 123          1HG2      VAL 123  -0.243   3.188   3.188
  977   2HG2  VAL 123          3HG2      VAL 123   0.954   4.237   4.237
  978   3HG2  VAL 123          2HG2      VAL 123  -0.602   3.961   3.961
  979    H    HIS 124           H        HIS 124  -2.729   1.712   1.712
  980    HA   HIS 124           HA       HIS 124  -3.408   2.832   2.832
  981   1HB   HIS 124          2HB       HIS 124  -5.297   1.150   1.150
  982   2HB   HIS 124          1HB       HIS 124  -5.513   1.708   1.708
  983    HD1  HIS 124           HD1      HIS 124  -4.813   0.130   0.130
  984    HD2  HIS 124           HD2      HIS 124  -3.129  -0.820  -0.820
  985    HE1  HIS 124           HE1      HIS 124  -3.610  -2.048  -2.048
  986    HE2  HIS 124           HE2      HIS 124  -2.731  -2.673  -2.673
  987    H    GLY 125           H        GLY 125  -3.041   4.910   4.910
  988   1HA   GLY 125          2HA       GLY 125  -4.451   5.803   5.803
  989   2HA   GLY 125          1HA       GLY 125  -3.755   6.835   6.835
  990    H    PHE 126           HN       PHE 126  -6.548   6.147   6.147
  991    HA   PHE 126           HA       PHE 126  -8.540   5.779   5.779
  992   1HB   PHE 126          2HB       PHE 126 -10.032   6.707   6.707
  993   2HB   PHE 126          1HB       PHE 126  -8.691   6.148   6.148
  994    HD1  PHE 126           HD2      PHE 126  -6.729   8.146   8.146
  995    HD2  PHE 126           HD1      PHE 126 -10.952   8.639   8.639
  996    HE1  PHE 126           HE2      PHE 126  -6.505  10.403  10.403
  997    HE2  PHE 126           HE1      PHE 126 -10.736  10.897  10.897
  998    HZ   PHE 126           HZ       PHE 126  -8.510  11.782  11.782

  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  24.866 -47.815 -47.815
    2   2H    MET   1          3H        MET   1  24.081 -46.301 -46.301
    3   3H    MET   1          2H        MET   1  25.746 -46.453 -46.453
    4    HA   MET   1           HA       MET   1  24.600 -46.405 -46.405
    5   1HB   MET   1          2HB       MET   1  22.407 -46.958 -46.958
    6   2HB   MET   1          1HB       MET   1  22.886 -48.649 -48.649
    7   1HG   MET   1          2HG       MET   1  22.499 -48.863 -48.863
    8   2HG   MET   1          1HG       MET   1  23.019 -47.219 -47.219
    9   1HE   MET   1          1HE       MET   1  20.956 -48.844 -48.844
   10   2HE   MET   1          3HE       MET   1  19.560 -47.790 -47.790
   11   3HE   MET   1          2HE       MET   1  19.472 -49.137 -49.137
   12    H    ARG   2           H        ARG   2  26.992 -47.354 -47.354
   13    HA   ARG   2           HA       ARG   2  27.045 -50.029 -50.029
   14   1HB   ARG   2          2HB       ARG   2  27.860 -49.800 -49.800
   15   2HB   ARG   2          1HB       ARG   2  29.243 -48.955 -48.955
   16   1HG   ARG   2          2HG       ARG   2  29.332 -51.115 -51.115
   17   2HG   ARG   2          1HG       ARG   2  28.510 -51.821 -51.821
   18   1HD   ARG   2          2HD       ARG   2  30.306 -51.476 -51.476
   19   2HD   ARG   2          1HD       ARG   2  30.944 -50.151 -50.151
   20    HE   ARG   2           HE       ARG   2  32.134 -51.671 -51.671
   21   1HH1  ARG   2          2HH1      ARG   2  29.652 -53.363 -53.363
   22   2HH1  ARG   2          1HH1      ARG   2  30.239 -54.934 -54.934
   23   1HH2  ARG   2          1HH2      ARG   2  32.908 -53.737 -53.737
   24   2HH2  ARG   2          2HH2      ARG   2  32.087 -55.147 -55.147
   25    H    GLY   3           H        GLY   3  26.886 -47.848 -47.848
   26   1HA   GLY   3          2HA       GLY   3  29.461 -46.845 -46.845
   27   2HA   GLY   3          1HA       GLY   3  27.966 -46.654 -46.654
   28    H    SER   4           H        SER   4  28.676 -47.169 -47.169
   29    HA   SER   4           HA       SER   4  28.943 -49.915 -49.915
   30   1HB   SER   4          2HB       SER   4  31.288 -49.612 -49.612
   31   2HB   SER   4          1HB       SER   4  31.186 -49.850 -49.850
   32    HG   SER   4           HG       SER   4  31.913 -47.598 -47.598
   33    H    HIS   5           H        HIS   5  27.295 -47.778 -47.778
   34    HA   HIS   5           HA       HIS   5  28.137 -47.365 -47.365
   35   1HB   HIS   5          2HB       HIS   5  26.118 -45.583 -45.583
   36   2HB   HIS   5          1HB       HIS   5  27.812 -45.198 -45.198
   37    HD1  HIS   5           HD1      HIS   5  24.895 -46.522 -46.522
   38    HD2  HIS   5           HD2      HIS   5  28.205 -44.031 -44.031
   39    HE1  HIS   5           HE1      HIS   5  24.794 -45.575 -45.575
   40    HE2  HIS   5           HE2      HIS   5  26.858 -44.144 -44.144
   41    H    HIS   6           H        HIS   6  25.539 -48.405 -48.405
   42    HA   HIS   6           HA       HIS   6  23.943 -49.174 -49.174
   43   1HB   HIS   6          2HB       HIS   6  23.286 -48.350 -48.350
   44   2HB   HIS   6          1HB       HIS   6  22.321 -49.682 -49.682
   45    HD1  HIS   6           HD1      HIS   6  21.474 -49.032 -49.032
   46    HD2  HIS   6           HD2      HIS   6  22.080 -46.000 -46.000
   47    HE1  HIS   6           HE1      HIS   6  20.158 -47.066 -47.066
   48    HE2  HIS   6           HE2      HIS   6  20.606 -45.219 -45.219
   49    H    HIS   7           H        HIS   7  24.292 -51.181 -51.181
   50    HA   HIS   7           HA       HIS   7  25.483 -53.199 -53.199
   51   1HB   HIS   7          2HB       HIS   7  23.961 -53.463 -53.463
   52   2HB   HIS   7          1HB       HIS   7  25.008 -54.692 -54.692
   53    HD1  HIS   7           HD1      HIS   7  25.112 -52.434 -52.434
   54    HD2  HIS   7           HD2      HIS   7  27.738 -53.233 -53.233
   55    HE1  HIS   7           HE1      HIS   7  27.350 -51.580 -51.580
   56    HE2  HIS   7           HE2      HIS   7  28.939 -52.152 -52.152
   57    H    HIS   8           H        HIS   8  24.070 -53.158 -53.158
   58    HA   HIS   8           HA       HIS   8  21.966 -55.135 -55.135
   59   1HB   HIS   8          2HB       HIS   8  21.159 -52.553 -52.553
   60   2HB   HIS   8          1HB       HIS   8  21.092 -52.764 -52.764
   61    HD1  HIS   8           HD1      HIS   8  18.744 -52.628 -52.628
   62    HD2  HIS   8           HD2      HIS   8  19.835 -55.779 -55.779
   63    HE1  HIS   8           HE1      HIS   8  16.734 -54.134 -54.134
   64    HE2  HIS   8           HE2      HIS   8  17.443 -56.074 -56.074
   65    H    HIS   9           H        HIS   9  24.562 -55.017 -55.017
   66    HA   HIS   9           HA       HIS   9  24.147 -54.699 -54.699
   67   1HB   HIS   9          2HB       HIS   9  26.333 -54.221 -54.221
   68   2HB   HIS   9          1HB       HIS   9  26.478 -55.916 -55.916
   69    HD1  HIS   9           HD1      HIS   9  28.025 -57.091 -57.091
   70    HD2  HIS   9           HD2      HIS   9  25.857 -54.168 -54.168
   71    HE1  HIS   9           HE1      HIS   9  28.799 -57.202 -57.202
   72    HE2  HIS   9           HE2      HIS   9  27.530 -55.371 -55.371
   73    H    HIS  10           H        HIS  10  22.743 -56.131 -56.131
   74    HA   HIS  10           HA       HIS  10  22.554 -58.849 -58.849
   75   1HB   HIS  10          2HB       HIS  10  20.807 -57.303 -57.303
   76   2HB   HIS  10          1HB       HIS  10  21.572 -57.915 -57.915
   77    HD1  HIS  10           HD1      HIS  10  20.213 -59.746 -59.746
   78    HD2  HIS  10           HD2      HIS  10  20.249 -59.822 -59.822
   79    HE1  HIS  10           HE1      HIS  10  18.846 -61.755 -61.755
   80    HE2  HIS  10           HE2      HIS  10  18.810 -61.730 -61.730
   81    H    THR  11           H        THR  11  23.281 -60.709 -60.709
   82    HA   THR  11           HA       THR  11  25.781 -60.588 -60.588
   83    HB   THR  11           HB       THR  11  23.880 -62.937 -62.937
   84    HG1  THR  11           HG1      THR  11  24.975 -63.472 -63.472
   85   1HG2  THR  11          2HG2      THR  11  26.643 -62.621 -62.621
   86   2HG2  THR  11          1HG2      THR  11  26.430 -63.862 -63.862
   87   3HG2  THR  11          3HG2      THR  11  25.520 -63.953 -63.953
   88    H    ASP  12           H        ASP  12  22.526 -61.274 -61.274
   89    HA   ASP  12           HA       ASP  12  23.481 -60.588 -60.588
   90   1HB   ASP  12          2HB       ASP  12  21.744 -62.980 -62.980
   91   2HB   ASP  12          1HB       ASP  12  22.166 -62.434 -62.434
   92    HA   PRO  13           HA       PRO  13  19.631 -58.261 -58.261
   93   1HB   PRO  13          2HB       PRO  13  20.419 -55.933 -55.933
   94   2HB   PRO  13          1HB       PRO  13  20.866 -56.390 -56.390
   95   1HG   PRO  13          2HG       PRO  13  22.462 -56.608 -56.608
   96   2HG   PRO  13          1HG       PRO  13  22.977 -56.053 -56.053
   97   1HD   PRO  13          2HD       PRO  13  23.498 -58.548 -58.548
   98   2HD   PRO  13          1HD       PRO  13  23.226 -58.200 -58.200
   99    H    MET  14           H        MET  14  21.439 -58.696 -58.696
  100    HA   MET  14           HA       MET  14  19.634 -57.646 -57.646
  101   1HB   MET  14          2HB       MET  14  21.493 -60.009 -60.009
  102   2HB   MET  14          1HB       MET  14  20.709 -59.157 -59.157
  103   1HG   MET  14          2HG       MET  14  21.902 -57.113 -57.113
  104   2HG   MET  14          1HG       MET  14  22.695 -57.977 -57.977
  105   1HE   MET  14          3HE       MET  14  24.083 -60.060 -60.060
  106   2HE   MET  14          2HE       MET  14  23.324 -60.922 -60.922
  107   3HE   MET  14          1HE       MET  14  25.021 -60.454 -60.454
  108    H    SER  15           H        SER  15  19.438 -60.503 -60.503
  109    HA   SER  15           HA       SER  15  17.827 -62.159 -62.159
  110   1HB   SER  15          2HB       SER  15  18.734 -62.946 -62.946
  111   2HB   SER  15          1HB       SER  15  17.857 -61.713 -61.713
  112    HG   SER  15           HG       SER  15  16.944 -64.094 -64.094
  113    H    ALA  16           H        ALA  16  17.022 -59.230 -59.230
  114    HA   ALA  16           HA       ALA  16  14.338 -59.338 -59.338
  115   1HB   ALA  16          2HB       ALA  16  14.990 -59.225 -59.225
  116   2HB   ALA  16          1HB       ALA  16  13.659 -58.221 -58.221
  117   3HB   ALA  16          3HB       ALA  16  13.618 -59.966 -59.966
  118    H    ILE  17           H        ILE  17  15.160 -57.792 -57.792
  119    HA   ILE  17           HA       ILE  17  16.022 -55.216 -55.216
  120    HB   ILE  17           HB       ILE  17  15.657 -56.010 -56.010
  121   1HG1  ILE  17          2HG1      ILE  17  18.143 -56.133 -56.133
  122   2HG1  ILE  17          1HG1      ILE  17  17.251 -57.518 -57.518
  123   1HG2  ILE  17          3HG2      ILE  17  15.915 -53.532 -53.532
  124   2HG2  ILE  17          2HG2      ILE  17  17.620 -53.975 -53.975
  125   3HG2  ILE  17          1HG2      ILE  17  16.618 -54.042 -54.042
  126   1HD1  ILE  17          3HD1      ILE  17  17.763 -56.687 -56.687
  127   2HD1  ILE  17          2HD1      ILE  17  18.838 -55.503 -55.503
  128   3HD1  ILE  17          1HD1      ILE  17  19.157 -57.227 -57.227
  129    H    GLN  18           H        GLN  18  13.631 -55.350 -55.350
  130    HA   GLN  18           HA       GLN  18  11.736 -54.211 -54.211
  131   1HB   GLN  18          2HB       GLN  18  11.216 -55.014 -55.014
  132   2HB   GLN  18          1HB       GLN  18  10.021 -54.667 -54.667
  133   1HG   GLN  18          2HG       GLN  18  11.190 -56.647 -56.647
  134   2HG   GLN  18          1HG       GLN  18  11.719 -57.080 -57.080
  135   1HE2  GLN  18          2HE2      GLN  18   8.216 -57.385 -57.385
  136   2HE2  GLN  18          1HE2      GLN  18   9.585 -56.425 -56.425
  137    H    ASN  19           H        ASN  19  10.665 -52.244 -52.244
  138    HA   ASN  19           HA       ASN  19  11.287 -50.593 -50.593
  139   1HB   ASN  19          2HB       ASN  19  13.294 -50.563 -50.563
  140   2HB   ASN  19          1HB       ASN  19  12.267 -49.311 -49.311
  141   1HD2  ASN  19          2HD2      ASN  19  14.421 -47.431 -47.431
  142   2HD2  ASN  19          1HD2      ASN  19  14.397 -48.200 -48.200
  143    H    LEU  20           H        LEU  20   8.913 -51.494 -51.494
  144    HA   LEU  20           HA       LEU  20   7.715 -49.688 -49.688
  145   1HB   LEU  20          2HB       LEU  20   6.759 -51.739 -51.739
  146   2HB   LEU  20          1HB       LEU  20   5.585 -50.545 -50.545
  147    HG   LEU  20           HG       LEU  20   5.444 -52.540 -52.540
  148   1HD1  LEU  20          1HD1      LEU  20   5.476 -49.990 -49.990
  149   2HD1  LEU  20          3HD1      LEU  20   6.705 -50.718 -50.718
  150   3HD1  LEU  20          2HD1      LEU  20   5.074 -51.388 -51.388
  151   1HD2  LEU  20          3HD2      LEU  20   8.370 -52.032 -52.032
  152   2HD2  LEU  20          2HD2      LEU  20   7.559 -53.520 -53.520
  153   3HD2  LEU  20          1HD2      LEU  20   7.422 -52.946 -52.946
  154    H    HIS  21           H        HIS  21   7.625 -49.801 -49.801
  155    HA   HIS  21           HA       HIS  21   7.501 -46.951 -46.951
  156   1HB   HIS  21          2HB       HIS  21   5.032 -48.308 -48.308
  157   2HB   HIS  21          1HB       HIS  21   5.171 -47.820 -47.820
  158    HD1  HIS  21           HD1      HIS  21   5.437 -46.260 -46.260
  159    HD2  HIS  21           HD2      HIS  21   4.474 -45.237 -45.237
  160    HE1  HIS  21           HE1      HIS  21   4.644 -43.877 -43.877
  161    HE2  HIS  21           HE2      HIS  21   3.983 -43.308 -43.308
  162    H    SER  22           H        SER  22   8.662 -46.462 -46.462
  163    HA   SER  22           HA       SER  22   8.586 -48.292 -48.292
  164   1HB   SER  22          2HB       SER  22  11.035 -46.675 -46.675
  165   2HB   SER  22          1HB       SER  22  10.858 -48.335 -48.335
  166    HG   SER  22           HG       SER  22  11.077 -47.351 -47.351
  167    H    PHE  23           H        PHE  23   6.797 -46.255 -46.255
  168    HA   PHE  23           HA       PHE  23   5.980 -44.520 -44.520
  169   1HB   PHE  23          2HB       PHE  23   6.825 -45.789 -45.789
  170   2HB   PHE  23          1HB       PHE  23   8.408 -45.043 -45.043
  171    HD1  PHE  23           HD1      PHE  23   4.899 -43.767 -43.767
  172    HD2  PHE  23           HD2      PHE  23   8.855 -43.531 -43.531
  173    HE1  PHE  23           HE1      PHE  23   4.205 -41.925 -41.925
  174    HE2  PHE  23           HE2      PHE  23   8.168 -41.689 -41.689
  175    HZ   PHE  23           HZ       PHE  23   5.841 -40.885 -40.885
  176    H    ASP  24           H        ASP  24   6.049 -42.327 -42.327
  177    HA   ASP  24           HA       ASP  24   7.964 -41.113 -41.113
  178   1HB   ASP  24          2HB       ASP  24   5.778 -40.039 -40.039
  179   2HB   ASP  24          1HB       ASP  24   6.857 -38.953 -38.953
  180    HA   PRO  25           HA       PRO  25  11.171 -40.703 -40.703
  181   1HB   PRO  25          2HB       PRO  25  12.421 -39.113 -39.113
  182   2HB   PRO  25          1HB       PRO  25  13.080 -40.463 -40.463
  183   1HG   PRO  25          2HG       PRO  25  12.321 -40.790 -40.790
  184   2HG   PRO  25          1HG       PRO  25  12.042 -42.056 -42.056
  185   1HD   PRO  25          2HD       PRO  25  10.113 -40.093 -40.093
  186   2HD   PRO  25          1HD       PRO  25   9.870 -41.802 -41.802
  187    H    PHE  26           H        PHE  26   9.686 -38.153 -38.153
  188    HA   PHE  26           HA       PHE  26  10.443 -36.198 -36.198
  189   1HB   PHE  26          2HB       PHE  26   9.382 -35.489 -35.489
  190   2HB   PHE  26          1HB       PHE  26  10.287 -34.477 -34.477
  191    HD1  PHE  26           HD1      PHE  26  10.526 -37.267 -37.267
  192    HD2  PHE  26           HD2      PHE  26  12.661 -34.500 -34.500
  193    HE1  PHE  26           HE1      PHE  26  12.613 -37.869 -37.869
  194    HE2  PHE  26           HE2      PHE  26  14.752 -35.096 -35.096
  195    HZ   PHE  26           HZ       PHE  26  14.729 -36.782 -36.782
  196    H    ALA  27           H        ALA  27   7.763 -36.735 -36.735
  197    HA   ALA  27           HA       ALA  27   5.505 -36.576 -36.576
  198   1HB   ALA  27          1HB       ALA  27   5.852 -38.270 -38.270
  199   2HB   ALA  27          3HB       ALA  27   6.064 -36.986 -36.986
  200   3HB   ALA  27          2HB       ALA  27   4.510 -37.192 -37.192
  201    H    ASP  28           H        ASP  28   6.831 -34.188 -34.188
  202    HA   ASP  28           HA       ASP  28   5.097 -32.427 -32.427
  203   1HB   ASP  28          2HB       ASP  28   7.680 -32.662 -32.662
  204   2HB   ASP  28          1HB       ASP  28   7.841 -31.430 -31.430
  205    H    ALA  29           H        ALA  29   3.809 -31.652 -31.652
  206    HA   ALA  29           HA       ALA  29   3.111 -30.528 -30.528
  207   1HB   ALA  29          1HB       ALA  29   5.806 -29.416 -29.416
  208   2HB   ALA  29          3HB       ALA  29   5.085 -29.085 -29.085
  209   3HB   ALA  29          2HB       ALA  29   4.242 -28.606 -28.606
  210    H    SER  30           H        SER  30   4.161 -33.224 -33.224
  211    HA   SER  30           HA       SER  30   5.350 -33.188 -33.188
  212   1HB   SER  30          2HB       SER  30   5.350 -35.801 -35.801
  213   2HB   SER  30          1HB       SER  30   6.633 -34.705 -34.705
  214    HG   SER  30           HG       SER  30   5.640 -36.083 -36.083
  215    H    LYS  31           H        LYS  31   2.530 -34.270 -34.270
  216    HA   LYS  31           HA       LYS  31   1.285 -35.072 -35.072
  217   1HB   LYS  31          2HB       LYS  31   0.793 -36.097 -36.097
  218   2HB   LYS  31          1HB       LYS  31  -0.234 -36.483 -36.483
  219   1HG   LYS  31          2HG       LYS  31   2.122 -37.201 -37.201
  220   2HG   LYS  31          1HG       LYS  31   2.467 -37.458 -37.458
  221   1HD   LYS  31          2HD       LYS  31   0.416 -38.845 -38.845
  222   2HD   LYS  31          1HD       LYS  31   0.201 -38.661 -38.661
  223   1HE   LYS  31          2HE       LYS  31   2.297 -39.779 -39.779
  224   2HE   LYS  31          1HE       LYS  31   2.641 -39.856 -39.856
  225   1HZ   LYS  31          3HZ       LYS  31   0.144 -41.056 -41.056
  226   2HZ   LYS  31          2HZ       LYS  31   1.574 -41.865 -41.865
  227   3HZ   LYS  31          1HZ       LYS  31   1.203 -41.559 -41.559
  228    H    GLY  32           H        GLY  32   0.631 -33.629 -33.629
  229   1HA   GLY  32          2HA       GLY  32  -0.510 -31.402 -31.402
  230   2HA   GLY  32          1HA       GLY  32  -1.650 -32.207 -32.207
  231    H    ASP  33           H        ASP  33  -0.752 -31.565 -31.565
  232    HA   ASP  33           HA       ASP  33  -2.822 -33.375 -33.375
  233   1HB   ASP  33          2HB       ASP  33  -1.854 -32.818 -32.818
  234   2HB   ASP  33          1HB       ASP  33  -0.706 -33.581 -33.581
  235    H    ASP  34           H        ASP  34  -3.667 -31.110 -31.110
  236    HA   ASP  34           HA       ASP  34  -5.191 -29.427 -29.427
  237   1HB   ASP  34          2HB       ASP  34  -6.005 -31.210 -31.210
  238   2HB   ASP  34          1HB       ASP  34  -5.774 -29.782 -29.782
  239    H    LEU  35           H        LEU  35  -3.468 -27.907 -27.907
  240    HA   LEU  35           HA       LEU  35  -2.684 -26.515 -26.515
  241   1HB   LEU  35          2HB       LEU  35  -1.459 -26.654 -26.654
  242   2HB   LEU  35          1HB       LEU  35  -1.010 -25.398 -25.398
  243    HG   LEU  35           HG       LEU  35  -0.856 -28.221 -28.221
  244   1HD1  LEU  35          1HD1      LEU  35   0.137 -28.216 -28.216
  245   2HD1  LEU  35          3HD1      LEU  35   1.267 -26.977 -26.977
  246   3HD1  LEU  35          2HD1      LEU  35   1.291 -28.577 -28.577
  247   1HD2  LEU  35          2HD2      LEU  35   0.585 -25.641 -25.641
  248   2HD2  LEU  35          1HD2      LEU  35  -0.288 -26.668 -26.668
  249   3HD2  LEU  35          3HD2      LEU  35   1.272 -27.187 -27.187
  250    H    LEU  36           H        LEU  36  -4.329 -25.110 -25.110
  251    HA   LEU  36           HA       LEU  36  -5.787 -23.698 -23.698
  252   1HB   LEU  36          2HB       LEU  36  -5.249 -22.975 -22.975
  253   2HB   LEU  36          1HB       LEU  36  -6.482 -22.241 -22.241
  254    HG   LEU  36           HG       LEU  36  -6.429 -25.184 -25.184
  255   1HD1  LEU  36          2HD1      LEU  36  -7.772 -22.898 -22.898
  256   2HD1  LEU  36          1HD1      LEU  36  -8.311 -24.570 -24.570
  257   3HD1  LEU  36          3HD1      LEU  36  -6.690 -24.116 -24.116
  258   1HD2  LEU  36          3HD2      LEU  36  -7.671 -24.367 -24.367
  259   2HD2  LEU  36          2HD2      LEU  36  -8.646 -25.221 -25.221
  260   3HD2  LEU  36          1HD2      LEU  36  -8.712 -23.461 -23.461
  261    HA   PRO  37           HA       PRO  37  -2.757 -20.650 -20.650
  262   1HB   PRO  37          2HB       PRO  37  -4.364 -19.042 -19.042
  263   2HB   PRO  37          1HB       PRO  37  -3.833 -20.626 -20.626
  264   1HG   PRO  37          2HG       PRO  37  -6.438 -19.841 -19.841
  265   2HG   PRO  37          1HG       PRO  37  -6.140 -20.887 -20.887
  266   1HD   PRO  37          2HD       PRO  37  -6.663 -21.855 -21.855
  267   2HD   PRO  37          1HD       PRO  37  -5.646 -22.711 -22.711
  268    H    ALA  38           H        ALA  38  -1.990 -19.127 -19.127
  269    HA   ALA  38           HA       ALA  38  -3.573 -16.847 -16.847
  270   1HB   ALA  38          1HB       ALA  38  -4.335 -18.415 -18.415
  271   2HB   ALA  38          3HB       ALA  38  -2.667 -18.726 -18.726
  272   3HB   ALA  38          2HB       ALA  38  -3.374 -17.128 -17.128
  273    H    GLY  39           H        GLY  39  -2.137 -15.341 -15.341
  274   1HA   GLY  39          2HA       GLY  39   0.611 -15.592 -15.592
  275   2HA   GLY  39          1HA       GLY  39   0.264 -14.920 -14.920
  276    H    THR  40           H        THR  40  -0.372 -14.428 -14.428
  277    HA   THR  40           HA       THR  40  -0.621 -11.545 -11.545
  278    HB   THR  40           HB       THR  40  -1.769 -11.436 -11.436
  279    HG1  THR  40           HG1      THR  40  -1.680 -14.265 -14.265
  280   1HG2  THR  40          2HG2      THR  40  -2.911 -13.189 -13.189
  281   2HG2  THR  40          1HG2      THR  40  -3.812 -12.808 -12.808
  282   3HG2  THR  40          3HG2      THR  40  -3.297 -11.513 -11.513
  283    H    GLU  41           H        GLU  41   1.276 -13.950 -13.950
  284    HA   GLU  41           HA       GLU  41   3.238 -13.849 -13.849
  285   1HB   GLU  41          2HB       GLU  41   3.118 -11.319 -11.319
  286   2HB   GLU  41          1HB       GLU  41   4.049 -11.202 -11.202
  287   1HG   GLU  41          2HG       GLU  41   4.570 -13.477 -13.477
  288   2HG   GLU  41          1HG       GLU  41   5.179 -11.876 -11.876
  289    H    ASP  42           H        ASP  42   0.493 -12.923 -12.923
  290    HA   ASP  42           HA       ASP  42  -0.354 -12.270 -12.270
  291   1HB   ASP  42          2HB       ASP  42   2.009 -13.826 -13.826
  292   2HB   ASP  42          1HB       ASP  42   1.843 -12.596 -12.596
  293    H    TYR  43           H        TYR  43  -0.019 -10.079 -10.079
  294    HA   TYR  43           HA       TYR  43   1.977  -8.321  -8.321
  295   1HB   TYR  43          2HB       TYR  43  -0.650  -7.731  -7.731
  296   2HB   TYR  43          1HB       TYR  43   0.600  -6.536  -6.536
  297    HD1  TYR  43           HD1      TYR  43   2.756  -8.908  -8.908
  298    HD2  TYR  43           HD2      TYR  43  -0.447  -7.015  -7.015
  299    HE1  TYR  43           HE1      TYR  43   3.822  -9.453  -9.453
  300    HE2  TYR  43           HE2      TYR  43   0.615  -7.558  -7.558
  301    HH   TYR  43           HH       TYR  43   2.382  -9.534  -9.534
  302    H    ILE  44           H        ILE  44   1.491  -6.305  -6.305
  303    HA   ILE  44           HA       ILE  44  -0.414  -6.835  -6.835
  304    HB   ILE  44           HB       ILE  44   2.131  -5.204  -5.204
  305   1HG1  ILE  44          2HG1      ILE  44   2.597  -7.575  -7.575
  306   2HG1  ILE  44          1HG1      ILE  44   2.882  -6.952  -6.952
  307   1HG2  ILE  44          2HG2      ILE  44   0.365  -4.263  -4.263
  308   2HG2  ILE  44          1HG2      ILE  44   0.226  -5.822  -5.822
  309   3HG2  ILE  44          3HG2      ILE  44   1.725  -4.897  -4.897
  310   1HD1  ILE  44          1HD1      ILE  44   0.490  -7.744  -7.744
  311   2HD1  ILE  44          3HD1      ILE  44   0.670  -8.698  -8.698
  312   3HD1  ILE  44          2HD1      ILE  44   1.775  -8.945  -8.945
  313    H    HIS  45           H        HIS  45  -2.223  -5.776  -5.776
  314    HA   HIS  45           HA       HIS  45  -2.204  -3.253  -3.253
  315   1HB   HIS  45          2HB       HIS  45  -4.062  -5.337  -5.337
  316   2HB   HIS  45          1HB       HIS  45  -4.773  -3.863  -3.863
  317    HD1  HIS  45           HD1      HIS  45  -3.712  -5.472  -5.472
  318    HD2  HIS  45           HD2      HIS  45  -5.429  -1.917  -1.917
  319    HE1  HIS  45           HE1      HIS  45  -4.572  -4.348  -4.348
  320    HE2  HIS  45           HE2      HIS  45  -5.524  -2.155  -2.155
  321    H    ILE  46           H        ILE  46  -1.845  -1.386  -1.386
  322    HA   ILE  46           HA       ILE  46  -2.050  -0.992  -0.992
  323    HB   ILE  46           HB       ILE  46  -1.622   1.039   1.039
  324   1HG1  ILE  46          2HG1      ILE  46   0.111  -0.765  -0.765
  325   2HG1  ILE  46          1HG1      ILE  46   0.723   0.862   0.862
  326   1HG2  ILE  46          2HG2      ILE  46  -1.252   1.286   1.286
  327   2HG2  ILE  46          1HG2      ILE  46  -0.749   2.486   2.486
  328   3HG2  ILE  46          3HG2      ILE  46  -2.461   2.114   2.114
  329   1HD1  ILE  46          2HD1      ILE  46   0.256   0.256   0.256
  330   2HD1  ILE  46          1HD1      ILE  46   0.407  -1.391  -1.391
  331   3HD1  ILE  46          3HD1      ILE  46   1.739  -0.250  -0.250
  332    H    ARG  47           H        ARG  47  -3.393   1.512   1.512
  333    HA   ARG  47           HA       ARG  47  -5.537   2.228   2.228
  334   1HB   ARG  47          2HB       ARG  47  -6.090  -0.325  -0.325
  335   2HB   ARG  47          1HB       ARG  47  -6.801   0.462   0.462
  336   1HG   ARG  47          2HG       ARG  47  -7.473   1.623   1.623
  337   2HG   ARG  47          1HG       ARG  47  -8.127   0.022   0.022
  338   1HD   ARG  47          2HD       ARG  47  -9.568   0.811   0.811
  339   2HD   ARG  47          1HD       ARG  47  -8.379   1.916   1.916
  340    HE   ARG  47           HE       ARG  47  -9.056   3.031   3.031
  341   1HH1  ARG  47          2HH1      ARG  47 -10.819   2.034   2.034
  342   2HH1  ARG  47          1HH1      ARG  47 -12.057   3.230   3.230
  343   1HH2  ARG  47          1HH2      ARG  47 -10.684   4.604   4.604
  344   2HH2  ARG  47          2HH2      ARG  47 -11.980   4.689   4.689
  345    H    ILE  48           H        ILE  48  -6.208   4.067   4.067
  346    HA   ILE  48           HA       ILE  48  -5.890   4.604   4.604
  347    HB   ILE  48           HB       ILE  48  -5.597   6.316   6.316
  348   1HG1  ILE  48          2HG1      ILE  48  -4.132   6.199   6.199
  349   2HG1  ILE  48          1HG1      ILE  48  -3.617   5.433   5.433
  350   1HG2  ILE  48          3HG2      ILE  48  -6.447   7.385   7.385
  351   2HG2  ILE  48          2HG2      ILE  48  -5.781   8.366   8.366
  352   3HG2  ILE  48          1HG2      ILE  48  -7.316   7.528   7.528
  353   1HD1  ILE  48          1HD1      ILE  48  -4.012   8.396   8.396
  354   2HD1  ILE  48          3HD1      ILE  48  -2.474   7.586   7.586
  355   3HD1  ILE  48          2HD1      ILE  48  -3.205   7.522   7.522
  356    H    GLN  49           H        GLN  49  -7.537   5.984   5.984
  357    HA   GLN  49           HA       GLN  49 -10.102   6.101   6.101
  358   1HB   GLN  49          2HB       GLN  49 -11.328   5.064   5.064
  359   2HB   GLN  49          1HB       GLN  49 -10.067   3.961   3.961
  360   1HG   GLN  49          2HG       GLN  49  -8.718   5.074   5.074
  361   2HG   GLN  49          1HG       GLN  49 -10.332   5.456   5.456
  362   1HE2  GLN  49          2HE2      GLN  49 -11.235   2.010   2.010
  363   2HE2  GLN  49          1HE2      GLN  49 -11.869   3.500   3.500
  364    H    GLN  50           H        GLN  50 -10.302   8.265   8.265
  365    HA   GLN  50           HA       GLN  50  -9.844   9.722   9.722
  366   1HB   GLN  50          2HB       GLN  50  -8.999  10.282  10.282
  367   2HB   GLN  50          1HB       GLN  50 -10.400  11.331  11.331
  368   1HG   GLN  50          2HG       GLN  50  -9.436  12.275  12.275
  369   2HG   GLN  50          1HG       GLN  50  -8.041  11.220  11.220
  370   1HE2  GLN  50          2HE2      GLN  50  -6.401  13.767  13.767
  371   2HE2  GLN  50          1HE2      GLN  50  -6.457  12.645  12.645
  372    H    ARG  51           H        ARG  51 -11.512  10.375  10.375
  373    HA   ARG  51           HA       ARG  51 -14.199  10.188  10.188
  374   1HB   ARG  51          2HB       ARG  51 -13.486  11.081  11.081
  375   2HB   ARG  51          1HB       ARG  51 -14.981  10.348  10.348
  376   1HG   ARG  51          2HG       ARG  51 -12.450   8.791   8.791
  377   2HG   ARG  51          1HG       ARG  51 -13.238   8.967   8.967
  378   1HD   ARG  51          2HD       ARG  51 -14.424   7.805   7.805
  379   2HD   ARG  51          1HD       ARG  51 -14.010   6.940   6.940
  380    HE   ARG  51           HE       ARG  51 -15.795   8.810   8.810
  381   1HH1  ARG  51          2HH1      ARG  51 -15.840   6.359   6.359
  382   2HH1  ARG  51          1HH1      ARG  51 -17.553   6.121   6.121
  383   1HH2  ARG  51          1HH2      ARG  51 -18.047   8.498   8.498
  384   2HH2  ARG  51          2HH2      ARG  51 -18.807   7.335   7.335
  385    H    ASN  52           H        ASN  52 -15.107  11.869  11.869
  386    HA   ASN  52           HA       ASN  52 -15.709  13.993  13.993
  387   1HB   ASN  52          2HB       ASN  52 -15.921  13.981  13.981
  388   2HB   ASN  52          1HB       ASN  52 -14.591  15.128  15.128
  389   1HD2  ASN  52          2HD2      ASN  52 -16.558  17.769  17.769
  390   2HD2  ASN  52          1HD2      ASN  52 -14.991  17.165  17.165
  391    H    GLY  53           H        GLY  53 -12.900  12.910  12.910
  392   1HA   GLY  53          2HA       GLY  53 -11.030  13.662  13.662
  393   2HA   GLY  53          1HA       GLY  53 -11.802  15.234  15.234
  394    H    ARG  54           H        ARG  54 -11.008  13.449  13.449
  395    HA   ARG  54           HA       ARG  54  -8.752  15.186  15.186
  396   1HB   ARG  54          2HB       ARG  54 -11.075  15.191  15.191
  397   2HB   ARG  54          1HB       ARG  54  -9.602  16.144  16.144
  398   1HG   ARG  54          2HG       ARG  54 -10.304  17.244  17.244
  399   2HG   ARG  54          1HG       ARG  54 -11.866  16.450  16.450
  400   1HD   ARG  54          2HD       ARG  54 -12.189  18.550  18.550
  401   2HD   ARG  54          1HD       ARG  54 -11.856  17.516  17.516
  402    HE   ARG  54           HE       ARG  54 -10.008  18.779  18.779
  403   1HH1  ARG  54          2HH1      ARG  54 -10.873  19.181  19.181
  404   2HH1  ARG  54          1HH1      ARG  54  -9.650  20.370  20.370
  405   1HH2  ARG  54          1HH2      ARG  54  -8.400  20.342  20.342
  406   2HH2  ARG  54          2HH2      ARG  54  -8.246  21.029  21.029
  407    H    LYS  55           H        LYS  55 -10.969  13.145  13.145
  408    HA   LYS  55           HA       LYS  55  -8.921  12.029  12.029
  409   1HB   LYS  55          2HB       LYS  55 -11.606  10.782  10.782
  410   2HB   LYS  55          1HB       LYS  55 -10.587  10.482  10.482
  411   1HG   LYS  55          2HG       LYS  55 -11.931  13.097  13.097
  412   2HG   LYS  55          1HG       LYS  55 -12.486  11.922  11.922
  413   1HD   LYS  55          2HD       LYS  55 -11.009  12.621  12.621
  414   2HD   LYS  55          1HD       LYS  55  -9.693  12.684  12.684
  415   1HE   LYS  55          2HE       LYS  55 -10.272  14.860  14.860
  416   2HE   LYS  55          1HE       LYS  55 -11.854  14.770  14.770
  417   1HZ   LYS  55          3HZ       LYS  55 -10.240  14.414  14.414
  418   2HZ   LYS  55          2HZ       LYS  55  -9.269  15.420  15.420
  419   3HZ   LYS  55          1HZ       LYS  55 -10.815  15.928  15.928
  420    H    THR  56           H        THR  56  -7.374  11.521  11.521
  421    HA   THR  56           HA       THR  56  -7.930   9.354   9.354
  422    HB   THR  56           HB       THR  56  -5.114  10.009  10.009
  423    HG1  THR  56           HG1      THR  56  -5.609  12.045  12.045
  424   1HG2  THR  56          3HG2      THR  56  -6.738   9.233   9.233
  425   2HG2  THR  56          2HG2      THR  56  -6.170  10.857  10.857
  426   3HG2  THR  56          1HG2      THR  56  -5.008   9.577   9.577
  427    H    LEU  57           H        LEU  57  -7.229   7.256   7.256
  428    HA   LEU  57           HA       LEU  57  -5.654   6.386   6.386
  429   1HB   LEU  57          2HB       LEU  57  -8.513   6.034   6.034
  430   2HB   LEU  57          1HB       LEU  57  -7.700   4.480   4.480
  431    HG   LEU  57           HG       LEU  57  -6.494   5.344   5.344
  432   1HD1  LEU  57          3HD1      LEU  57  -8.315   7.588   7.588
  433   2HD1  LEU  57          2HD1      LEU  57  -8.224   7.073   7.073
  434   3HD1  LEU  57          1HD1      LEU  57  -6.762   7.567   7.567
  435   1HD2  LEU  57          3HD2      LEU  57  -9.297   4.489   4.489
  436   2HD2  LEU  57          2HD2      LEU  57  -7.981   3.778   3.778
  437   3HD2  LEU  57          1HD2      LEU  57  -8.861   5.168   5.168
  438    H    THR  58           H        THR  58  -4.017   5.640   5.640
  439    HA   THR  58           HA       THR  58  -4.457   4.128   4.128
  440    HB   THR  58           HB       THR  58  -1.957   4.432   4.432
  441    HG1  THR  58           HG1      THR  58  -3.097   6.329   6.329
  442   1HG2  THR  58          1HG2      THR  58  -2.472   3.004   3.004
  443   2HG2  THR  58          3HG2      THR  58  -1.140   4.155   4.155
  444   3HG2  THR  58          2HG2      THR  58  -1.123   2.878   2.878
  445    H    THR  59           H        THR  59  -4.874   2.020   2.020
  446    HA   THR  59           HA       THR  59  -4.498   0.310   0.310
  447    HB   THR  59           HB       THR  59  -6.044  -1.161  -1.161
  448    HG1  THR  59           HG1      THR  59  -6.924   1.529   1.529
  449   1HG2  THR  59          1HG2      THR  59  -6.453   0.271   0.271
  450   2HG2  THR  59          3HG2      THR  59  -7.900   0.305   0.305
  451   3HG2  THR  59          2HG2      THR  59  -7.171  -1.239  -1.239
  452    H    VAL  60           H        VAL  60  -3.852  -1.915  -1.915
  453    HA   VAL  60           HA       VAL  60  -2.165  -2.265  -2.265
  454    HB   VAL  60           HB       VAL  60  -1.484  -3.121  -3.121
  455   1HG1  VAL  60          1HG1      VAL  60  -0.726  -4.744  -4.744
  456   2HG1  VAL  60          3HG1      VAL  60   0.096  -3.450  -3.450
  457   3HG1  VAL  60          2HG1      VAL  60   0.632  -3.900  -3.900
  458   1HG2  VAL  60          1HG2      VAL  60  -0.742  -0.807  -0.807
  459   2HG2  VAL  60          3HG2      VAL  60  -0.877  -0.939  -0.939
  460   3HG2  VAL  60          2HG2      VAL  60   0.553  -1.561  -1.561
  461    H    GLN  61           H        GLN  61  -2.713  -3.973  -3.973
  462    HA   GLN  61           HA       GLN  61  -4.048  -6.232  -6.232
  463   1HB   GLN  61          2HB       GLN  61  -5.227  -4.616  -4.616
  464   2HB   GLN  61          1HB       GLN  61  -4.544  -5.846  -5.846
  465   1HG   GLN  61          2HG       GLN  61  -5.793  -7.154  -7.154
  466   2HG   GLN  61          1HG       GLN  61  -6.910  -5.949  -5.949
  467   1HE2  GLN  61          2HE2      GLN  61  -6.594  -7.534  -7.534
  468   2HE2  GLN  61          1HE2      GLN  61  -6.136  -6.011  -6.011
  469    H    GLY  62           H        GLY  62  -3.371  -8.270  -8.270
  470   1HA   GLY  62          2HA       GLY  62  -2.315  -9.830  -9.830
  471   2HA   GLY  62          1HA       GLY  62  -1.219  -8.535  -8.535
  472    H    ILE  63           H        ILE  63  -0.975  -7.719  -7.719
  473    HA   ILE  63           HA       ILE  63   1.336  -9.223  -9.223
  474    HB   ILE  63           HB       ILE  63  -0.260  -7.247  -7.247
  475   1HG1  ILE  63          2HG1      ILE  63   0.774  -6.038  -6.038
  476   2HG1  ILE  63          1HG1      ILE  63   1.971  -5.946  -5.946
  477   1HG2  ILE  63          3HG2      ILE  63   1.885  -9.019  -9.019
  478   2HG2  ILE  63          2HG2      ILE  63   2.230  -7.319  -7.319
  479   3HG2  ILE  63          1HG2      ILE  63   0.768  -8.052  -8.052
  480   1HD1  ILE  63          2HD1      ILE  63   2.940  -8.067  -8.067
  481   2HD1  ILE  63          1HD1      ILE  63   2.040  -7.446  -7.446
  482   3HD1  ILE  63          3HD1      ILE  63   3.280  -6.451  -6.451
  483    H    ALA  64           H        ALA  64   1.738 -10.717 -10.717
  484    HA   ALA  64           HA       ALA  64  -0.541 -12.367 -12.367
  485   1HB   ALA  64          3HB       ALA  64   1.757 -13.158 -13.158
  486   2HB   ALA  64          2HB       ALA  64   2.274 -12.996 -12.996
  487   3HB   ALA  64          1HB       ALA  64   0.954 -14.091 -14.091
  488    H    ASP  65           H        ASP  65  -1.399 -12.588 -12.588
  489    HA   ASP  65           HA       ASP  65  -0.906 -10.705 -10.705
  490   1HB   ASP  65          2HB       ASP  65  -2.307 -12.254 -12.254
  491   2HB   ASP  65          1HB       ASP  65  -3.054 -11.743 -11.743
  492    H    ASP  66           H        ASP  66   0.666 -13.653 -13.653
  493    HA   ASP  66           HA       ASP  66   1.660 -14.380 -14.380
  494   1HB   ASP  66          2HB       ASP  66   1.684 -15.849 -15.849
  495   2HB   ASP  66          1HB       ASP  66   2.962 -14.843 -14.843
  496    H    TYR  67           H        TYR  67   2.518 -11.862 -11.862
  497    HA   TYR  67           HA       TYR  67   5.184 -11.401 -11.401
  498   1HB   TYR  67          2HB       TYR  67   2.931  -9.456  -9.456
  499   2HB   TYR  67          1HB       TYR  67   4.616  -8.969  -8.969
  500    HD1  TYR  67           HD2      TYR  67   4.237 -12.203 -12.203
  501    HD2  TYR  67           HD1      TYR  67   4.034  -8.034  -8.034
  502    HE1  TYR  67           HE2      TYR  67   4.519 -12.656 -12.656
  503    HE2  TYR  67           HE1      TYR  67   4.314  -8.468  -8.468
  504    HH   TYR  67           HH       TYR  67   5.405 -10.436 -10.436
  505    H    ASP  68           H        ASP  68   5.750  -9.142  -9.142
  506    HA   ASP  68           HA       ASP  68   5.133  -9.656  -9.656
  507   1HB   ASP  68          2HB       ASP  68   7.178  -7.965  -7.965
  508   2HB   ASP  68          1HB       ASP  68   6.871  -7.761  -7.761
  509    H    LYS  69           H        LYS  69   3.009  -8.918  -8.918
  510    HA   LYS  69           HA       LYS  69   1.826  -6.669  -6.669
  511   1HB   LYS  69          2HB       LYS  69   1.363  -8.475  -8.475
  512   2HB   LYS  69          1HB       LYS  69   0.960  -6.837  -6.837
  513   1HG   LYS  69          2HG       LYS  69  -0.653  -6.607  -6.607
  514   2HG   LYS  69          1HG       LYS  69  -0.065  -8.030  -8.030
  515   1HD   LYS  69          2HD       LYS  69  -1.051  -9.499  -9.499
  516   2HD   LYS  69          1HD       LYS  69  -1.067  -8.323  -8.323
  517   1HE   LYS  69          2HE       LYS  69  -3.139  -7.711  -7.711
  518   2HE   LYS  69          1HE       LYS  69  -2.660  -7.353  -7.353
  519   1HZ   LYS  69          3HZ       LYS  69  -2.851  -9.852  -9.852
  520   2HZ   LYS  69          2HZ       LYS  69  -3.704  -9.886  -9.886
  521   3HZ   LYS  69          1HZ       LYS  69  -4.292  -8.980  -8.980
  522    H    LYS  70           H        LYS  70   4.164  -6.846  -6.846
  523    HA   LYS  70           HA       LYS  70   3.778  -4.131  -4.131
  524   1HB   LYS  70          2HB       LYS  70   6.000  -6.097  -6.097
  525   2HB   LYS  70          1HB       LYS  70   5.821  -4.529  -4.529
  526   1HG   LYS  70          2HG       LYS  70   4.188  -5.244  -5.244
  527   2HG   LYS  70          1HG       LYS  70   3.456  -6.268  -6.268
  528   1HD   LYS  70          2HD       LYS  70   6.042  -6.955  -6.955
  529   2HD   LYS  70          1HD       LYS  70   4.466  -7.472  -7.472
  530   1HE   LYS  70          2HE       LYS  70   5.405  -8.033  -8.033
  531   2HE   LYS  70          1HE       LYS  70   5.726  -9.125  -9.125
  532   1HZ   LYS  70          2HZ       LYS  70   2.991  -8.232  -8.232
  533   2HZ   LYS  70          1HZ       LYS  70   3.693  -9.613  -9.613
  534   3HZ   LYS  70          3HZ       LYS  70   3.444  -9.525  -9.525
  535    H    LYS  71           H        LYS  71   6.388  -5.845  -5.845
  536    HA   LYS  71           HA       LYS  71   7.878  -3.516  -3.516
  537   1HB   LYS  71          2HB       LYS  71   8.646  -5.962  -5.962
  538   2HB   LYS  71          1HB       LYS  71   7.960  -6.042  -6.042
  539   1HG   LYS  71          2HG       LYS  71   9.554  -4.658  -4.658
  540   2HG   LYS  71          1HG       LYS  71   9.888  -3.865  -3.865
  541   1HD   LYS  71          2HD       LYS  71  10.486  -6.744  -6.744
  542   2HD   LYS  71          1HD       LYS  71  11.479  -5.747  -5.747
  543   1HE   LYS  71          2HE       LYS  71  12.355  -4.513  -4.513
  544   2HE   LYS  71          1HE       LYS  71  11.038  -4.951  -4.951
  545   1HZ   LYS  71          1HZ       LYS  71  12.657  -7.157  -7.157
  546   2HZ   LYS  71          3HZ       LYS  71  13.447  -6.076  -6.076
  547   3HZ   LYS  71          2HZ       LYS  71  12.038  -6.862  -6.862
  548    H    LEU  72           H        LEU  72   4.893  -4.356  -4.356
  549    HA   LEU  72           HA       LEU  72   5.395  -3.223  -3.223
  550   1HB   LEU  72          2HB       LEU  72   3.160  -4.860  -4.860
  551   2HB   LEU  72          1HB       LEU  72   2.945  -3.961  -3.961
  552    HG   LEU  72           HG       LEU  72   4.168  -5.418  -5.418
  553   1HD1  LEU  72          3HD1      LEU  72   5.906  -5.897  -5.897
  554   2HD1  LEU  72          2HD1      LEU  72   6.158  -6.617  -6.617
  555   3HD1  LEU  72          1HD1      LEU  72   6.281  -4.868  -4.868
  556   1HD2  LEU  72          2HD2      LEU  72   2.642  -6.689  -6.689
  557   2HD2  LEU  72          1HD2      LEU  72   3.265  -7.401  -7.401
  558   3HD2  LEU  72          3HD2      LEU  72   4.172  -7.563  -7.563
  559    H    VAL  73           H        VAL  73   2.528  -3.085  -3.085
  560    HA   VAL  73           HA       VAL  73   1.995  -0.401  -0.401
  561    HB   VAL  73           HB       VAL  73   0.289  -2.229  -2.229
  562   1HG1  VAL  73          3HG1      VAL  73   1.247  -2.667  -2.667
  563   2HG1  VAL  73          2HG1      VAL  73   0.781  -1.039  -1.039
  564   3HG1  VAL  73          1HG1      VAL  73  -0.458  -2.218  -2.218
  565   1HG2  VAL  73          1HG2      VAL  73  -0.217   0.115   0.115
  566   2HG2  VAL  73          3HG2      VAL  73  -1.356  -0.561  -0.561
  567   3HG2  VAL  73          2HG2      VAL  73  -0.105   0.560   0.560
  568    H    LYS  74           H        LYS  74   3.144  -1.909  -1.909
  569    HA   LYS  74           HA       LYS  74   3.209   0.458   0.458
  570   1HB   LYS  74          2HB       LYS  74   3.729  -2.192  -2.192
  571   2HB   LYS  74          1HB       LYS  74   5.335  -1.481  -1.481
  572   1HG   LYS  74          2HG       LYS  74   3.998   0.283   0.283
  573   2HG   LYS  74          1HG       LYS  74   3.011  -1.151  -1.151
  574   1HD   LYS  74          2HD       LYS  74   4.741  -2.302  -2.302
  575   2HD   LYS  74          1HD       LYS  74   5.984  -1.347  -1.347
  576   1HE   LYS  74          2HE       LYS  74   6.097  -0.538  -0.538
  577   2HE   LYS  74          1HE       LYS  74   5.001   0.615   0.615
  578   1HZ   LYS  74          2HZ       LYS  74   3.156  -0.851  -0.851
  579   2HZ   LYS  74          1HZ       LYS  74   4.323  -1.618  -1.618
  580   3HZ   LYS  74          3HZ       LYS  74   4.012   0.033   0.033
  581    H    ALA  75           H        ALA  75   5.629  -1.149  -1.149
  582    HA   ALA  75           HA       ALA  75   7.728   0.681   0.681
  583   1HB   ALA  75          3HB       ALA  75   8.112  -1.534  -1.534
  584   2HB   ALA  75          2HB       ALA  75   7.218  -1.071  -1.071
  585   3HB   ALA  75          1HB       ALA  75   8.742  -0.272  -0.272
  586    H    PHE  76           H        PHE  76   5.214   0.479   0.479
  587    HA   PHE  76           HA       PHE  76   5.929   2.510   2.510
  588   1HB   PHE  76          2HB       PHE  76   3.829   0.988   0.988
  589   2HB   PHE  76          1HB       PHE  76   3.078   2.276   2.276
  590    HD1  PHE  76           HD2      PHE  76   2.605   4.439   4.439
  591    HD2  PHE  76           HD1      PHE  76   4.394   1.292   1.292
  592    HE1  PHE  76           HE2      PHE  76   2.109   5.643   5.643
  593    HE2  PHE  76           HE1      PHE  76   3.902   2.492   2.492
  594    HZ   PHE  76           HZ       PHE  76   2.758   4.670   4.670
  595    H    LYS  77           H        LYS  77   4.103   2.861   2.861
  596    HA   LYS  77           HA       LYS  77   3.809   5.660   5.660
  597   1HB   LYS  77          2HB       LYS  77   3.868   3.886   3.886
  598   2HB   LYS  77          1HB       LYS  77   3.242   5.528   5.528
  599   1HG   LYS  77          2HG       LYS  77   1.259   4.784   4.784
  600   2HG   LYS  77          1HG       LYS  77   1.973   3.974   3.974
  601   1HD   LYS  77          2HD       LYS  77   1.055   2.179   2.179
  602   2HD   LYS  77          1HD       LYS  77   2.663   2.193   2.193
  603   1HE   LYS  77          2HE       LYS  77   1.393   2.050   2.050
  604   2HE   LYS  77          1HE       LYS  77   1.483   3.802   3.802
  605   1HZ   LYS  77          2HZ       LYS  77  -0.749   2.157   2.157
  606   2HZ   LYS  77          1HZ       LYS  77  -0.781   2.938   2.938
  607   3HZ   LYS  77          3HZ       LYS  77  -0.673   3.845   3.845
  608    H    LYS  78           H        LYS  78   6.557   3.762   3.762
  609    HA   LYS  78           HA       LYS  78   7.871   5.909   5.909
  610   1HB   LYS  78          2HB       LYS  78   7.945   3.273   3.273
  611   2HB   LYS  78          1HB       LYS  78   9.301   3.391   3.391
  612   1HG   LYS  78          2HG       LYS  78  10.616   4.396   4.396
  613   2HG   LYS  78          1HG       LYS  78   9.305   5.399   5.399
  614   1HD   LYS  78          2HD       LYS  78   9.508   4.084   4.084
  615   2HD   LYS  78          1HD       LYS  78   8.527   2.962   2.962
  616   1HE   LYS  78          2HE       LYS  78  10.501   1.877   1.877
  617   2HE   LYS  78          1HE       LYS  78  10.516   1.820   1.820
  618   1HZ   LYS  78          3HZ       LYS  78  11.859   4.102   4.102
  619   2HZ   LYS  78          2HZ       LYS  78  12.590   2.605   2.605
  620   3HZ   LYS  78          1HZ       LYS  78  12.330   3.116   3.116
  621    H    LYS  79           H        LYS  79   7.681   4.557   4.557
  622    HA   LYS  79           HA       LYS  79  10.218   5.761   5.761
  623   1HB   LYS  79          2HB       LYS  79   9.597   3.419   3.419
  624   2HB   LYS  79          1HB       LYS  79   8.327   4.120   4.120
  625   1HG   LYS  79          2HG       LYS  79  10.442   5.543   5.543
  626   2HG   LYS  79          1HG       LYS  79  11.236   4.029   4.029
  627   1HD   LYS  79          2HD       LYS  79   8.944   3.235   3.235
  628   2HD   LYS  79          1HD       LYS  79   9.519   4.638   4.638
  629   1HE   LYS  79          2HE       LYS  79  10.515   2.652   2.652
  630   2HE   LYS  79          1HE       LYS  79  11.761   3.597   3.597
  631   1HZ   LYS  79          3HZ       LYS  79  11.218   2.076   2.076
  632   2HZ   LYS  79          2HZ       LYS  79  10.537   1.050   1.050
  633   3HZ   LYS  79          1HZ       LYS  79  12.174   1.467   1.467
  634    H    PHE  80           H        PHE  80   6.752   6.074   6.074
  635    HA   PHE  80           HA       PHE  80   7.270   8.445   8.445
  636   1HB   PHE  80          2HB       PHE  80   4.704   6.862   6.862
  637   2HB   PHE  80          1HB       PHE  80   5.199   8.080   8.080
  638    HD1  PHE  80           HD1      PHE  80   6.800   7.558   7.558
  639    HD2  PHE  80           HD2      PHE  80   5.573   4.614   4.614
  640    HE1  PHE  80           HE1      PHE  80   7.743   5.797   5.797
  641    HE2  PHE  80           HE2      PHE  80   6.512   2.847   2.847
  642    HZ   PHE  80           HZ       PHE  80   7.599   3.439   3.439
  643    H    ALA  81           H        ALA  81   5.947   7.340   7.340
  644    HA   ALA  81           HA       ALA  81   5.055   8.489   8.489
  645   1HB   ALA  81          3HB       ALA  81   6.588  10.353  10.353
  646   2HB   ALA  81          2HB       ALA  81   5.049  11.067  11.067
  647   3HB   ALA  81          1HB       ALA  81   5.384  10.755  10.755
  648    H    CYS  82           H        CYS  82   3.492   7.306   7.306
  649    HA   CYS  82           HA       CYS  82   1.099   9.011   9.011
  650   1HB   CYS  82          2HB       CYS  82   1.675   6.581   6.581
  651   2HB   CYS  82          1HB       CYS  82   0.299   7.666   7.666
  652    HG   CYS  82           HG       CYS  82   2.991   8.078   8.078
  653    H    ASN  83           H        ASN  83  -0.980   7.486   7.486
  654    HA   ASN  83           HA       ASN  83  -0.804   5.700   5.700
  655   1HB   ASN  83          2HB       ASN  83  -2.338   7.271   7.271
  656   2HB   ASN  83          1HB       ASN  83  -2.860   7.631   7.631
  657   1HD2  ASN  83          2HD2      ASN  83  -5.302   5.088   5.088
  658   2HD2  ASN  83          1HD2      ASN  83  -4.187   5.988   5.988
  659    H    GLY  84           H        GLY  84  -0.881   3.604   3.604
  660   1HA   GLY  84          2HA       GLY  84  -2.317   2.796   2.796
  661   2HA   GLY  84          1HA       GLY  84  -0.901   1.968   1.968
  662    H    THR  85           H        THR  85  -3.910   1.368   1.368
  663    HA   THR  85           HA       THR  85  -4.338  -0.034  -0.034
  664    HB   THR  85           HB       THR  85  -6.731   0.183   0.183
  665    HG1  THR  85           HG1      THR  85  -6.832   0.147   0.147
  666   1HG2  THR  85          3HG2      THR  85  -5.221   2.224   2.224
  667   2HG2  THR  85          2HG2      THR  85  -5.955   2.957   2.957
  668   3HG2  THR  85          1HG2      THR  85  -6.976   2.326   2.326
  669    H    VAL  86           H        VAL  86  -5.852  -1.969  -1.969
  670    HA   VAL  86           HA       VAL  86  -5.129  -3.393  -3.393
  671    HB   VAL  86           HB       VAL  86  -3.947  -4.286  -4.286
  672   1HG1  VAL  86          1HG1      VAL  86  -6.217  -3.714  -3.714
  673   2HG1  VAL  86          3HG1      VAL  86  -6.292  -5.471  -5.471
  674   3HG1  VAL  86          2HG1      VAL  86  -4.876  -4.701  -4.701
  675   1HG2  VAL  86          2HG2      VAL  86  -4.955  -5.721  -5.721
  676   2HG2  VAL  86          1HG2      VAL  86  -4.280  -6.520  -6.520
  677   3HG2  VAL  86          3HG2      VAL  86  -6.026  -6.331  -6.331
  678    H    ILE  87           H        ILE  87  -7.162  -2.557  -2.557
  679    HA   ILE  87           HA       ILE  87  -9.638  -3.493  -3.493
  680    HB   ILE  87           HB       ILE  87 -10.729  -2.435  -2.435
  681   1HG1  ILE  87          2HG1      ILE  87  -8.377  -1.044  -1.044
  682   2HG1  ILE  87          1HG1      ILE  87  -8.251  -2.784  -2.784
  683   1HG2  ILE  87          2HG2      ILE  87  -8.684  -0.693  -0.693
  684   2HG2  ILE  87          1HG2      ILE  87 -10.126  -0.121  -0.121
  685   3HG2  ILE  87          3HG2      ILE  87 -10.285  -1.106  -1.106
  686   1HD1  ILE  87          2HD1      ILE  87 -10.863  -1.835  -1.835
  687   2HD1  ILE  87          1HD1      ILE  87  -9.594  -0.962  -0.962
  688   3HD1  ILE  87          3HD1      ILE  87  -9.670  -2.722  -2.722
  689    H    GLU  88           H        GLU  88 -11.140  -4.871  -4.871
  690    HA   GLU  88           HA       GLU  88  -9.857  -6.820  -6.820
  691   1HB   GLU  88          2HB       GLU  88 -10.959  -7.407  -7.407
  692   2HB   GLU  88          1HB       GLU  88 -12.440  -7.398  -7.398
  693   1HG   GLU  88          2HG       GLU  88 -11.690  -9.150  -9.150
  694   2HG   GLU  88          1HG       GLU  88 -10.032  -8.995  -8.995
  695    H    HIS  89           H        HIS  89 -10.300  -5.174  -5.174
  696    HA   HIS  89           HA       HIS  89 -12.722  -4.244  -4.244
  697   1HB   HIS  89          2HB       HIS  89 -10.256  -4.078  -4.078
  698   2HB   HIS  89          1HB       HIS  89 -10.887  -5.287  -5.287
  699    HD1  HIS  89           HD1      HIS  89 -12.038  -4.384  -4.384
  700    HD2  HIS  89           HD2      HIS  89 -11.971  -1.646  -1.646
  701    HE1  HIS  89           HE1      HIS  89 -13.077  -2.291  -2.291
  702    HE2  HIS  89           HE2      HIS  89 -13.102  -0.671  -0.671
  703    HA   PRO  90           HA       PRO  90 -14.998  -7.868  -7.868
  704   1HB   PRO  90          2HB       PRO  90 -17.053  -6.694  -6.694
  705   2HB   PRO  90          1HB       PRO  90 -16.846  -6.559  -6.559
  706   1HG   PRO  90          2HG       PRO  90 -16.164  -4.589  -4.589
  707   2HG   PRO  90          1HG       PRO  90 -16.915  -4.307  -4.307
  708   1HD   PRO  90          2HD       PRO  90 -14.254  -3.892  -3.892
  709   2HD   PRO  90          1HD       PRO  90 -14.899  -4.260  -4.260
  710    H    GLU  91           H        GLU  91 -13.840  -5.512  -5.512
  711    HA   GLU  91           HA       GLU  91 -14.514  -7.018  -7.018
  712   1HB   GLU  91          2HB       GLU  91 -13.577  -4.395  -4.395
  713   2HB   GLU  91          1HB       GLU  91 -12.476  -5.122  -5.122
  714   1HG   GLU  91          2HG       GLU  91 -14.294  -3.825  -3.825
  715   2HG   GLU  91          1HG       GLU  91 -14.262  -5.516  -5.516
  716    H    TYR  92           H        TYR  92 -11.882  -6.889  -6.889
  717    HA   TYR  92           HA       TYR  92 -10.300  -8.640  -8.640
  718   1HB   TYR  92          2HB       TYR  92  -9.063  -7.123  -7.123
  719   2HB   TYR  92          1HB       TYR  92  -8.323  -7.697  -7.697
  720    HD1  TYR  92           HD2      TYR  92 -10.183  -6.617  -6.617
  721    HD2  TYR  92           HD1      TYR  92  -8.624  -4.826  -4.826
  722    HE1  TYR  92           HE2      TYR  92 -10.487  -4.393  -4.393
  723    HE2  TYR  92           HE1      TYR  92  -8.921  -2.596  -2.596
  724    HH   TYR  92           HH       TYR  92  -9.060  -1.817  -1.817
  725    H    GLY  93           H        GLY  93 -11.047  -7.959  -7.959
  726   1HA   GLY  93          2HA       GLY  93 -11.876  -9.812  -9.812
  727   2HA   GLY  93          1HA       GLY  93 -10.745 -10.854 -10.854
  728    H    GLU  94           H        GLU  94  -8.758  -8.495  -8.495
  729    HA   GLU  94           HA       GLU  94  -8.221  -8.089  -8.089
  730   1HB   GLU  94          2HB       GLU  94  -7.405 -10.660 -10.660
  731   2HB   GLU  94          1HB       GLU  94  -6.006  -9.732  -9.732
  732   1HG   GLU  94          2HG       GLU  94  -6.830  -9.538  -9.538
  733   2HG   GLU  94          1HG       GLU  94  -8.426 -10.123 -10.123
  734    H    VAL  95           H        VAL  95  -7.347  -6.133  -6.133
  735    HA   VAL  95           HA       VAL  95  -4.867  -5.856  -5.856
  736    HB   VAL  95           HB       VAL  95  -5.684  -3.838  -3.838
  737   1HG1  VAL  95          1HG1      VAL  95  -5.537  -6.305  -6.305
  738   2HG1  VAL  95          3HG1      VAL  95  -7.294  -6.165  -6.165
  739   3HG1  VAL  95          2HG1      VAL  95  -6.280  -5.051  -5.051
  740   1HG2  VAL  95          3HG2      VAL  95  -7.759  -3.679  -3.679
  741   2HG2  VAL  95          2HG2      VAL  95  -7.951  -3.330  -3.330
  742   3HG2  VAL  95          1HG2      VAL  95  -8.457  -4.892  -4.892
  743    H    ILE  96           H        ILE  96  -3.642  -4.075  -4.075
  744    HA   ILE  96           HA       ILE  96  -4.328  -2.992  -2.992
  745    HB   ILE  96           HB       ILE  96  -1.933  -2.918  -2.918
  746   1HG1  ILE  96          2HG1      ILE  96  -2.662  -4.346  -4.346
  747   2HG1  ILE  96          1HG1      ILE  96  -1.003  -4.126  -4.126
  748   1HG2  ILE  96          1HG2      ILE  96  -2.458  -0.846  -0.846
  749   2HG2  ILE  96          3HG2      ILE  96  -0.865  -1.198  -1.198
  750   3HG2  ILE  96          2HG2      ILE  96  -2.141  -0.571  -0.571
  751   1HD1  ILE  96          3HD1      ILE  96  -2.415  -2.465  -2.465
  752   2HD1  ILE  96          2HD1      ILE  96  -1.224  -3.727  -3.727
  753   3HD1  ILE  96          1HD1      ILE  96  -0.748  -2.253  -2.253
  754    H    GLN  97           H        GLN  97  -4.434  -0.687  -0.687
  755    HA   GLN  97           HA       GLN  97  -5.277   0.910   0.910
  756   1HB   GLN  97          2HB       GLN  97  -6.922  -0.002  -0.002
  757   2HB   GLN  97          1HB       GLN  97  -6.684   1.717   1.717
  758   1HG   GLN  97          2HG       GLN  97  -7.370   2.090   2.090
  759   2HG   GLN  97          1HG       GLN  97  -7.826   0.387   0.387
  760   1HE2  GLN  97          2HE2      GLN  97 -10.992   1.703   1.703
  761   2HE2  GLN  97          1HE2      GLN  97  -9.957   1.200   1.200
  762    H    LEU  98           H        LEU  98  -3.456   2.162   2.162
  763    HA   LEU  98           HA       LEU  98  -2.353   3.436   3.436
  764   1HB   LEU  98          2HB       LEU  98  -1.671   4.028   4.028
  765   2HB   LEU  98          1HB       LEU  98  -0.699   4.341   4.341
  766    HG   LEU  98           HG       LEU  98  -1.424   1.527   1.527
  767   1HD1  LEU  98          1HD1      LEU  98  -0.316   3.000   3.000
  768   2HD1  LEU  98          3HD1      LEU  98   1.142   2.615   2.615
  769   3HD1  LEU  98          2HD1      LEU  98   0.130   1.317   1.317
  770   1HD2  LEU  98          2HD2      LEU  98   0.576   2.938   2.938
  771   2HD2  LEU  98          1HD2      LEU  98  -0.364   1.483   1.483
  772   3HD2  LEU  98          3HD2      LEU  98   1.040   1.400   1.400
  773    H    GLN  99           H        GLN  99  -2.148   5.776   5.776
  774    HA   GLN  99           HA       GLN  99  -4.608   7.091   7.091
  775   1HB   GLN  99          2HB       GLN  99  -3.038   7.185   7.185
  776   2HB   GLN  99          1HB       GLN  99  -3.005   8.788   8.788
  777   1HG   GLN  99          2HG       GLN  99  -5.662   7.596   7.596
  778   2HG   GLN  99          1HG       GLN  99  -4.959   7.807   7.807
  779   1HE2  GLN  99          1HE2      GLN  99  -6.125   9.391   9.391
  780   2HE2  GLN  99          2HE2      GLN  99  -6.165  10.990  10.990
  781    H    GLY 100           H        GLY 100  -4.674   8.966   8.966
  782   1HA   GLY 100          2HA       GLY 100  -3.905  10.693  10.693
  783   2HA   GLY 100          1HA       GLY 100  -2.277  10.366  10.366
  784    H    ASP 101           H        ASP 101  -2.449  11.003  11.003
  785    HA   ASP 101           HA       ASP 101  -2.848   8.712   8.712
  786   1HB   ASP 101          2HB       ASP 101  -1.832  10.208  10.208
  787   2HB   ASP 101          1HB       ASP 101  -3.284  10.834  10.834
  788    H    GLN 102           H        GLN 102  -1.423   7.246   7.246
  789    HA   GLN 102           HA       GLN 102   1.432   7.732   7.732
  790   1HB   GLN 102          2HB       GLN 102  -0.330   5.837   5.837
  791   2HB   GLN 102          1HB       GLN 102   1.207   5.170   5.170
  792   1HG   GLN 102          2HG       GLN 102   1.059   6.164   6.164
  793   2HG   GLN 102          1HG       GLN 102   2.439   6.601   6.601
  794   1HE2  GLN 102          2HE2      GLN 102  -0.477   9.455   9.455
  795   2HE2  GLN 102          1HE2      GLN 102  -0.873   7.811   7.811
  796    H    ARG 103           H        ARG 103  -0.648   7.055   7.055
  797    HA   ARG 103           HA       ARG 103  -0.173   4.664   4.664
  798   1HB   ARG 103          2HB       ARG 103  -1.746   6.175   6.175
  799   2HB   ARG 103          1HB       ARG 103  -0.526   7.415   7.415
  800   1HG   ARG 103          2HG       ARG 103   0.557   5.647   5.647
  801   2HG   ARG 103          1HG       ARG 103  -1.070   4.966   4.966
  802   1HD   ARG 103          2HD       ARG 103  -1.645   7.561   7.561
  803   2HD   ARG 103          1HD       ARG 103  -0.047   7.488   7.488
  804    HE   ARG 103           HE       ARG 103  -2.448   6.468   6.468
  805   1HH1  ARG 103          2HH1      ARG 103   0.944   5.710   5.710
  806   2HH1  ARG 103          1HH1      ARG 103   0.989   4.767   4.767
  807   1HH2  ARG 103          1HH2      ARG 103  -2.392   5.230   5.230
  808   2HH2  ARG 103          2HH2      ARG 103  -0.904   4.494   4.494
  809    H    LYS 104           H        LYS 104   1.995   7.386   7.386
  810    HA   LYS 104           HA       LYS 104   3.946   6.069   6.069
  811   1HB   LYS 104          2HB       LYS 104   3.251   8.616   8.616
  812   2HB   LYS 104          1HB       LYS 104   4.436   8.737   8.737
  813   1HG   LYS 104          2HG       LYS 104   6.054   7.581   7.581
  814   2HG   LYS 104          1HG       LYS 104   4.867   7.890   7.890
  815   1HD   LYS 104          2HD       LYS 104   5.617  10.180  10.180
  816   2HD   LYS 104          1HD       LYS 104   6.842   9.596   9.596
  817   1HE   LYS 104          2HE       LYS 104   4.391   9.710   9.710
  818   2HE   LYS 104          1HE       LYS 104   4.551  11.223  11.223
  819   1HZ   LYS 104          3HZ       LYS 104   6.939  10.325  10.325
  820   2HZ   LYS 104          2HZ       LYS 104   5.656  10.781  10.781
  821   3HZ   LYS 104          1HZ       LYS 104   6.278  11.878  11.878
  822    H    ASN 105           H        ASN 105   3.270   6.726   6.726
  823    HA   ASN 105           HA       ASN 105   6.004   6.311   6.311
  824   1HB   ASN 105          2HB       ASN 105   3.418   6.975   6.975
  825   2HB   ASN 105          1HB       ASN 105   4.694   6.252   6.252
  826   1HD2  ASN 105          2HD2      ASN 105   4.767  10.129  10.129
  827   2HD2  ASN 105          1HD2      ASN 105   3.409   9.092   9.092
  828    H    ILE 106           H        ILE 106   2.988   4.489   4.489
  829    HA   ILE 106           HA       ILE 106   3.837   2.322   2.322
  830    HB   ILE 106           HB       ILE 106   1.471   2.761   2.761
  831   1HG1  ILE 106          2HG1      ILE 106   0.825   0.415   0.415
  832   2HG1  ILE 106          1HG1      ILE 106   2.445   0.024   0.024
  833   1HG2  ILE 106          2HG2      ILE 106   1.882   3.309   3.309
  834   2HG2  ILE 106          1HG2      ILE 106   2.076   1.584   1.584
  835   3HG2  ILE 106          3HG2      ILE 106   0.534   2.208   2.208
  836   1HD1  ILE 106          2HD1      ILE 106   2.442   1.342   1.342
  837   2HD1  ILE 106          1HD1      ILE 106   1.545  -0.175  -0.175
  838   3HD1  ILE 106          3HD1      ILE 106   3.233  -0.146  -0.146
  839    H    CYS 107           H        CYS 107   3.809   2.737   2.737
  840    HA   CYS 107           HA       CYS 107   4.862   0.256   0.256
  841   1HB   CYS 107          2HB       CYS 107   5.647   1.342   1.342
  842   2HB   CYS 107          1HB       CYS 107   4.024   1.888   1.888
  843    HG   CYS 107           HG       CYS 107   5.133   4.134   4.134
  844    H    GLN 108           H        GLN 108   6.358   3.106   3.106
  845    HA   GLN 108           HA       GLN 108   9.072   2.348   2.348
  846   1HB   GLN 108          2HB       GLN 108   7.646   4.412   4.412
  847   2HB   GLN 108          1HB       GLN 108   9.305   4.035   4.035
  848   1HG   GLN 108          2HG       GLN 108   8.815   4.524   4.524
  849   2HG   GLN 108          1HG       GLN 108   8.595   5.907   5.907
  850   1HE2  GLN 108          2HE2      GLN 108  12.289   4.207   4.207
  851   2HE2  GLN 108          1HE2      GLN 108  10.855   3.258   3.258
  852    H    PHE 109           H        PHE 109   6.814   2.114   2.114
  853    HA   PHE 109           HA       PHE 109   8.553   1.010   1.010
  854   1HB   PHE 109          2HB       PHE 109   6.287   1.970   1.970
  855   2HB   PHE 109          1HB       PHE 109   5.578   0.529   0.529
  856    HD1  PHE 109           HD2      PHE 109   8.190   1.320   1.320
  857    HD2  PHE 109           HD1      PHE 109   4.796  -1.013  -1.013
  858    HE1  PHE 109           HE2      PHE 109   8.274   0.201   0.201
  859    HE2  PHE 109           HE1      PHE 109   4.872  -2.134  -2.134
  860    HZ   PHE 109           HZ       PHE 109   6.613  -1.526  -1.526
  861    H    LEU 110           H        LEU 110   6.323  -0.547  -0.547
  862    HA   LEU 110           HA       LEU 110   6.783  -3.193  -3.193
  863   1HB   LEU 110          2HB       LEU 110   5.861  -1.864  -1.864
  864   2HB   LEU 110          1HB       LEU 110   6.204  -3.582  -3.582
  865    HG   LEU 110           HG       LEU 110   4.467  -4.059  -4.059
  866   1HD1  LEU 110          1HD1      LEU 110   4.946  -2.184  -2.184
  867   2HD1  LEU 110          3HD1      LEU 110   4.104  -1.100  -1.100
  868   3HD1  LEU 110          2HD1      LEU 110   3.225  -2.407  -2.407
  869   1HD2  LEU 110          3HD2      LEU 110   3.761  -3.505  -3.505
  870   2HD2  LEU 110          2HD2      LEU 110   2.507  -3.229  -3.229
  871   3HD2  LEU 110          1HD2      LEU 110   3.407  -1.866  -1.866
  872    H    VAL 111           H        VAL 111   8.668  -1.009  -1.009
  873    HA   VAL 111           HA       VAL 111  10.441  -3.159  -3.159
  874    HB   VAL 111           HB       VAL 111  10.545  -0.208  -0.208
  875   1HG1  VAL 111          3HG1      VAL 111  12.091  -2.577  -2.577
  876   2HG1  VAL 111          2HG1      VAL 111  11.961  -1.074  -1.074
  877   3HG1  VAL 111          1HG1      VAL 111  12.708  -1.074  -1.074
  878   1HG2  VAL 111          3HG2      VAL 111   8.512  -1.535  -1.535
  879   2HG2  VAL 111          2HG2      VAL 111   9.426  -0.653  -0.653
  880   3HG2  VAL 111          1HG2      VAL 111   9.632  -2.396  -2.396
  881    H    GLU 112           H        GLU 112  10.270  -0.592  -0.592
  882    HA   GLU 112           HA       GLU 112  13.089  -0.455  -0.455
  883   1HB   GLU 112          2HB       GLU 112  10.678   0.612   0.612
  884   2HB   GLU 112          1HB       GLU 112  12.317   0.829   0.829
  885   1HG   GLU 112          2HG       GLU 112  12.163   1.606   1.606
  886   2HG   GLU 112          1HG       GLU 112  10.926   2.437   2.437
  887    H    ILE 113           H        ILE 113  10.325  -2.069  -2.069
  888    HA   ILE 113           HA       ILE 113  12.091  -3.305  -3.305
  889    HB   ILE 113           HB       ILE 113  10.185  -3.945  -3.945
  890   1HG1  ILE 113          2HG1      ILE 113   8.567  -3.337  -3.337
  891   2HG1  ILE 113          1HG1      ILE 113   8.844  -4.919  -4.919
  892   1HG2  ILE 113          2HG2      ILE 113  10.718  -1.391  -1.391
  893   2HG2  ILE 113          1HG2      ILE 113   9.102  -1.395  -1.395
  894   3HG2  ILE 113          3HG2      ILE 113   9.335  -1.909  -1.909
  895   1HD1  ILE 113          3HD1      ILE 113   7.676  -3.154  -3.154
  896   2HD1  ILE 113          2HD1      ILE 113   6.708  -3.187  -3.187
  897   3HD1  ILE 113          1HD1      ILE 113   7.077  -4.689  -4.689
  898    H    GLY 114           H        GLY 114  11.170  -3.960  -3.960
  899   1HA   GLY 114          2HA       GLY 114  11.424  -5.865  -5.865
  900   2HA   GLY 114          1HA       GLY 114  11.995  -6.691  -6.691
  901    H    LEU 115           H        LEU 115   8.912  -5.053  -5.053
  902    HA   LEU 115           HA       LEU 115   7.530  -7.435  -7.435
  903   1HB   LEU 115          2HB       LEU 115   7.071  -4.784  -4.784
  904   2HB   LEU 115          1HB       LEU 115   5.955  -5.128  -5.128
  905    HG   LEU 115           HG       LEU 115   4.790  -6.754  -6.754
  906   1HD1  LEU 115          1HD1      LEU 115   7.114  -6.437  -6.437
  907   2HD1  LEU 115          3HD1      LEU 115   5.542  -6.932  -6.932
  908   3HD1  LEU 115          2HD1      LEU 115   6.346  -7.908  -7.908
  909   1HD2  LEU 115          2HD2      LEU 115   4.583  -4.160  -4.160
  910   2HD2  LEU 115          1HD2      LEU 115   3.694  -5.310  -5.310
  911   3HD2  LEU 115          3HD2      LEU 115   5.183  -4.583  -4.583
  912    H    ALA 116           H        ALA 116   6.745  -5.239  -5.239
  913    HA   ALA 116           HA       ALA 116   5.736  -7.526  -7.526
  914   1HB   ALA 116          3HB       ALA 116   4.522  -5.251  -5.251
  915   2HB   ALA 116          2HB       ALA 116   5.596  -4.701  -4.701
  916   3HB   ALA 116          1HB       ALA 116   4.489  -6.041  -6.041
  917    H    LYS 117           H        LYS 117   6.220  -7.519  -7.519
  918    HA   LYS 117           HA       LYS 117   9.096  -7.079  -7.079
  919   1HB   LYS 117          2HB       LYS 117   7.291  -9.160  -9.160
  920   2HB   LYS 117          1HB       LYS 117   8.002  -8.454  -8.454
  921   1HG   LYS 117          2HG       LYS 117   9.301 -10.350 -10.350
  922   2HG   LYS 117          1HG       LYS 117  10.233  -8.855  -8.855
  923   1HD   LYS 117          2HD       LYS 117   8.714  -9.509  -9.509
  924   2HD   LYS 117          1HD       LYS 117   9.996 -10.653 -10.653
  925   1HE   LYS 117          2HE       LYS 117  10.996  -8.011  -8.011
  926   2HE   LYS 117          1HE       LYS 117  10.219  -8.102  -8.102
  927   1HZ   LYS 117          1HZ       LYS 117  11.612 -10.370 -10.370
  928   2HZ   LYS 117          3HZ       LYS 117  12.626  -9.409  -9.409
  929   3HZ   LYS 117          2HZ       LYS 117  12.212  -8.911  -8.911
  930    H    ASP 118           H        ASP 118   9.909  -6.047  -6.047
  931    HA   ASP 118           HA       ASP 118   8.590  -3.725  -3.725
  932   1HB   ASP 118          2HB       ASP 118  10.282  -3.475  -3.475
  933   2HB   ASP 118          1HB       ASP 118  11.021  -4.060  -4.060
  934    H    ASP 119           H        ASP 119   8.381  -6.938  -6.938
  935    HA   ASP 119           HA       ASP 119   7.051  -6.146  -6.146
  936   1HB   ASP 119          2HB       ASP 119   8.046  -8.632  -8.632
  937   2HB   ASP 119          1HB       ASP 119   6.508  -8.834  -8.834
  938    H    GLN 120           H        GLN 120   6.168  -6.786  -6.786
  939    HA   GLN 120           HA       GLN 120   3.367  -7.234  -7.234
  940   1HB   GLN 120          2HB       GLN 120   4.607  -7.057  -7.057
  941   2HB   GLN 120          1HB       GLN 120   3.043  -7.736  -7.736
  942   1HG   GLN 120          2HG       GLN 120   4.313  -9.449  -9.449
  943   2HG   GLN 120          1HG       GLN 120   5.766  -8.860  -8.860
  944   1HE2  GLN 120          2HE2      GLN 120   4.077  -9.828  -9.828
  945   2HE2  GLN 120          1HE2      GLN 120   4.400  -8.306  -8.306
  946    H    LEU 121           H        LEU 121   5.351  -4.627  -4.627
  947    HA   LEU 121           HA       LEU 121   3.974  -2.898  -2.898
  948   1HB   LEU 121          2HB       LEU 121   5.788  -2.484  -2.484
  949   2HB   LEU 121          1HB       LEU 121   4.994  -1.108  -1.108
  950    HG   LEU 121           HG       LEU 121   6.704  -3.040  -3.040
  951   1HD1  LEU 121          1HD1      LEU 121   7.498  -0.425  -0.425
  952   2HD1  LEU 121          3HD1      LEU 121   8.481  -1.353  -1.353
  953   3HD1  LEU 121          2HD1      LEU 121   8.084  -2.028  -2.028
  954   1HD2  LEU 121          2HD2      LEU 121   5.290  -0.487  -0.487
  955   2HD2  LEU 121          1HD2      LEU 121   5.501  -1.916  -1.916
  956   3HD2  LEU 121          3HD2      LEU 121   6.835  -0.783  -0.783
  957    H    LYS 122           H        LYS 122   1.747  -3.424  -3.424
  958    HA   LYS 122           HA       LYS 122   0.696  -2.237  -2.237
  959   1HB   LYS 122          2HB       LYS 122  -0.183  -4.398  -4.398
  960   2HB   LYS 122          1HB       LYS 122  -1.468  -3.362  -3.362
  961   1HG   LYS 122          2HG       LYS 122   0.545  -4.737  -4.737
  962   2HG   LYS 122          1HG       LYS 122  -1.042  -5.400  -5.400
  963   1HD   LYS 122          2HD       LYS 122  -2.141  -3.919  -3.919
  964   2HD   LYS 122          1HD       LYS 122  -0.974  -2.627  -2.627
  965   1HE   LYS 122          2HE       LYS 122   0.374  -3.268  -3.268
  966   2HE   LYS 122          1HE       LYS 122  -0.018  -4.977  -4.977
  967   1HZ   LYS 122          3HZ       LYS 122  -1.936  -3.002  -3.002
  968   2HZ   LYS 122          2HZ       LYS 122  -0.874  -3.885  -3.885
  969   3HZ   LYS 122          1HZ       LYS 122  -2.041  -4.690  -4.690
  970    H    VAL 123           H        VAL 123   1.246  -0.122  -0.122
  971    HA   VAL 123           HA       VAL 123  -0.437   0.733   0.733
  972    HB   VAL 123           HB       VAL 123   1.852   1.489   1.489
  973   1HG1  VAL 123          3HG1      VAL 123   1.310   2.068   2.068
  974   2HG1  VAL 123          2HG1      VAL 123   2.169   3.362   3.362
  975   3HG1  VAL 123          1HG1      VAL 123   2.835   1.730   1.730
  976   1HG2  VAL 123          1HG2      VAL 123  -0.123   3.688   3.688
  977   2HG2  VAL 123          3HG2      VAL 123   0.320   3.022   3.022
  978   3HG2  VAL 123          2HG2      VAL 123   1.492   3.964   3.964
  979    H    HIS 124           H        HIS 124  -2.299   1.801   1.801
  980    HA   HIS 124           HA       HIS 124  -2.890   3.229   3.229
  981   1HB   HIS 124          2HB       HIS 124  -4.960   1.487   1.487
  982   2HB   HIS 124          1HB       HIS 124  -5.027   2.242   2.242
  983    HD1  HIS 124           HD1      HIS 124  -4.251   0.861   0.861
  984    HD2  HIS 124           HD2      HIS 124  -3.058  -0.712  -0.712
  985    HE1  HIS 124           HE1      HIS 124  -3.221  -1.369  -1.369
  986    HE2  HIS 124           HE2      HIS 124  -2.636  -2.360  -2.360
  987    H    GLY 125           H        GLY 125  -4.062   5.078   5.078
  988   1HA   GLY 125          2HA       GLY 125  -4.779   5.798   5.798
  989   2HA   GLY 125          1HA       GLY 125  -4.223   6.946   6.946
  990    H    PHE 126           HN       PHE 126  -6.822   6.252   6.252
  991    HA   PHE 126           HA       PHE 126  -8.989   5.714   5.714
  992   1HB   PHE 126          2HB       PHE 126 -10.312   6.962   6.962
  993   2HB   PHE 126          1HB       PHE 126  -8.934   6.361   6.361
  994    HD1  PHE 126           HD2      PHE 126  -6.814   8.164   8.164
  995    HD2  PHE 126           HD1      PHE 126 -10.976   9.020   9.020
  996    HE1  PHE 126           HE2      PHE 126  -6.299  10.458  10.458
  997    HE2  PHE 126           HE1      PHE 126 -10.469  11.318  11.318
  998    HZ   PHE 126           HZ       PHE 126  -8.127  12.038  12.038

  Start of MODEL   15
    1   1H    MET   1          2H        MET   1 -44.882 -19.692 -19.692
    2   2H    MET   1          1H        MET   1 -43.344 -20.388 -20.388
    3   3H    MET   1          3H        MET   1 -43.472 -18.713 -18.713
    4    HA   MET   1           HA       MET   1 -43.156 -18.920 -18.920
    5   1HB   MET   1          2HB       MET   1 -43.851 -21.344 -21.344
    6   2HB   MET   1          1HB       MET   1 -45.523 -20.801 -20.801
    7   1HG   MET   1          2HG       MET   1 -45.421 -20.137 -20.137
    8   2HG   MET   1          1HG       MET   1 -43.706 -19.740 -19.740
    9   1HE   MET   1          3HE       MET   1 -43.672 -20.822 -20.822
   10   2HE   MET   1          2HE       MET   1 -42.201 -20.980 -20.980
   11   3HE   MET   1          1HE       MET   1 -42.790 -22.349 -22.349
   12    H    ARG   2           H        ARG   2 -43.726 -16.840 -16.840
   13    HA   ARG   2           HA       ARG   2 -44.989 -14.993 -14.993
   14   1HB   ARG   2          2HB       ARG   2 -47.272 -16.855 -16.855
   15   2HB   ARG   2          1HB       ARG   2 -46.972 -15.249 -15.249
   16   1HG   ARG   2          2HG       ARG   2 -45.346 -17.723 -17.723
   17   2HG   ARG   2          1HG       ARG   2 -46.484 -16.949 -16.949
   18   1HD   ARG   2          2HD       ARG   2 -45.085 -14.902 -14.902
   19   2HD   ARG   2          1HD       ARG   2 -43.919 -15.777 -15.777
   20    HE   ARG   2           HE       ARG   2 -44.502 -17.116 -17.116
   21   1HH1  ARG   2          2HH1      ARG   2 -42.589 -14.584 -14.584
   22   2HH1  ARG   2          1HH1      ARG   2 -41.343 -14.665 -14.665
   23   1HH2  ARG   2          1HH2      ARG   2 -42.866 -17.223 -17.223
   24   2HH2  ARG   2          2HH2      ARG   2 -41.500 -16.163 -16.163
   25    H    GLY   3           H        GLY   3 -44.957 -16.157 -16.157
   26   1HA   GLY   3          2HA       GLY   3 -47.596 -15.883 -15.883
   27   2HA   GLY   3          1HA       GLY   3 -46.101 -16.080 -16.080
   28    H    SER   4           H        SER   4 -44.625 -13.927 -13.927
   29    HA   SER   4           HA       SER   4 -46.004 -11.471 -11.471
   30   1HB   SER   4          2HB       SER   4 -45.968 -10.729 -10.729
   31   2HB   SER   4          1HB       SER   4 -46.564 -12.385 -12.385
   32    HG   SER   4           HG       SER   4 -44.995 -12.325 -12.325
   33    H    HIS   5           H        HIS   5 -44.594 -10.122 -10.122
   34    HA   HIS   5           HA       HIS   5 -41.892  -9.915  -9.915
   35   1HB   HIS   5          2HB       HIS   5 -42.313 -11.690 -11.690
   36   2HB   HIS   5          1HB       HIS   5 -41.804 -10.221 -10.221
   37    HD1  HIS   5           HD1      HIS   5 -40.541 -13.037 -13.037
   38    HD2  HIS   5           HD2      HIS   5 -39.180  -9.307  -9.307
   39    HE1  HIS   5           HE1      HIS   5 -38.055 -13.072 -13.072
   40    HE2  HIS   5           HE2      HIS   5 -37.265 -10.775 -10.775
   41    H    HIS   6           H        HIS   6 -44.243  -8.217  -8.217
   42    HA   HIS   6           HA       HIS   6 -42.997  -5.841  -5.841
   43   1HB   HIS   6          2HB       HIS   6 -44.604  -7.291  -7.291
   44   2HB   HIS   6          1HB       HIS   6 -45.104  -5.618  -5.618
   45    HD1  HIS   6           HD1      HIS   6 -42.502  -4.157  -4.157
   46    HD2  HIS   6           HD2      HIS   6 -43.043  -7.270  -7.270
   47    HE1  HIS   6           HE1      HIS   6 -40.750  -3.822  -3.822
   48    HE2  HIS   6           HE2      HIS   6 -41.044  -5.765  -5.765
   49    H    HIS   7           H        HIS   7 -43.779  -5.698  -5.698
   50    HA   HIS   7           HA       HIS   7 -46.643  -5.129  -5.129
   51   1HB   HIS   7          2HB       HIS   7 -44.832  -6.407  -6.407
   52   2HB   HIS   7          1HB       HIS   7 -45.127  -4.846  -4.846
   53    HD1  HIS   7           HD1      HIS   7 -47.033  -7.872  -7.872
   54    HD2  HIS   7           HD2      HIS   7 -47.495  -4.663  -4.663
   55    HE1  HIS   7           HE1      HIS   7 -49.192  -8.299  -8.299
   56    HE2  HIS   7           HE2      HIS   7 -49.406  -6.389  -6.389
   57    H    HIS   8           H        HIS   8 -43.478  -3.635  -3.635
   58    HA   HIS   8           HA       HIS   8 -44.373  -1.063  -1.063
   59   1HB   HIS   8          2HB       HIS   8 -45.310  -1.516  -1.516
   60   2HB   HIS   8          1HB       HIS   8 -43.664  -1.119  -1.119
   61    HD1  HIS   8           HD1      HIS   8 -43.340   1.271   1.271
   62    HD2  HIS   8           HD2      HIS   8 -46.386   0.687   0.687
   63    HE1  HIS   8           HE1      HIS   8 -44.262   3.561   3.561
   64    HE2  HIS   8           HE2      HIS   8 -46.041   3.193   3.193
   65    H    HIS   9           H        HIS   9 -42.436  -1.696  -1.696
   66    HA   HIS   9           HA       HIS   9 -39.892  -1.964  -1.964
   67   1HB   HIS   9          2HB       HIS   9 -40.994  -1.803  -1.803
   68   2HB   HIS   9          1HB       HIS   9 -39.605  -0.727  -0.727
   69    HD1  HIS   9           HD1      HIS   9 -40.556  -4.310  -4.310
   70    HD2  HIS   9           HD2      HIS   9 -37.129  -2.027  -2.027
   71    HE1  HIS   9           HE1      HIS   9 -38.636  -5.921  -5.921
   72    HE2  HIS   9           HE2      HIS   9 -36.570  -4.502  -4.502
   73    H    HIS  10           H        HIS  10 -39.481  -0.423  -0.423
   74    HA   HIS  10           HA       HIS  10 -38.579   2.130   2.130
   75   1HB   HIS  10          2HB       HIS  10 -40.932   1.944   1.944
   76   2HB   HIS  10          1HB       HIS  10 -39.957   3.399   3.399
   77    HD1  HIS  10           HD1      HIS  10 -42.746   1.568   1.568
   78    HD2  HIS  10           HD2      HIS  10 -40.121   4.588   4.588
   79    HE1  HIS  10           HE1      HIS  10 -43.774   2.633   2.633
   80    HE2  HIS  10           HE2      HIS  10 -42.126   4.401   4.401
   81    H    THR  11           H        THR  11 -36.862   0.461   0.461
   82    HA   THR  11           HA       THR  11 -36.495   0.137   0.137
   83    HB   THR  11           HB       THR  11 -34.142  -0.332  -0.332
   84    HG1  THR  11           HG1      THR  11 -34.847   0.586   0.586
   85   1HG2  THR  11          2HG2      THR  11 -36.349  -1.557  -1.557
   86   2HG2  THR  11          1HG2      THR  11 -34.736  -1.840  -1.840
   87   3HG2  THR  11          3HG2      THR  11 -35.105  -2.294  -2.294
   88    H    ASP  12           H        ASP  12 -36.585   1.834   1.834
   89    HA   ASP  12           HA       ASP  12 -35.235   4.321   4.321
   90   1HB   ASP  12          2HB       ASP  12 -37.297   3.523   3.523
   91   2HB   ASP  12          1HB       ASP  12 -36.282   4.912   4.912
   92    HA   PRO  13           HA       PRO  13 -31.523   3.282   3.282
   93   1HB   PRO  13          2HB       PRO  13 -31.440   6.213   6.213
   94   2HB   PRO  13          1HB       PRO  13 -30.203   5.154   5.154
   95   1HG   PRO  13          2HG       PRO  13 -31.590   6.810   6.810
   96   2HG   PRO  13          1HG       PRO  13 -31.161   5.181   5.181
   97   1HD   PRO  13          2HD       PRO  13 -33.784   6.225   6.225
   98   2HD   PRO  13          1HD       PRO  13 -33.444   5.046   5.046
   99    H    MET  14           H        MET  14 -34.001   5.386   5.386
  100    HA   MET  14           HA       MET  14 -33.105   5.512   5.512
  101   1HB   MET  14          2HB       MET  14 -35.844   5.677   5.677
  102   2HB   MET  14          1HB       MET  14 -35.612   5.808   5.808
  103   1HG   MET  14          2HG       MET  14 -34.266   7.581   7.581
  104   2HG   MET  14          1HG       MET  14 -35.765   7.982   7.982
  105   1HE   MET  14          2HE       MET  14 -33.019   9.383   9.383
  106   2HE   MET  14          1HE       MET  14 -33.822  10.396  10.396
  107   3HE   MET  14          3HE       MET  14 -32.209   9.759   9.759
  108    H    SER  15           H        SER  15 -34.684   2.960   2.960
  109    HA   SER  15           HA       SER  15 -35.789   1.461   1.461
  110   1HB   SER  15          2HB       SER  15 -35.985   1.025   1.025
  111   2HB   SER  15          1HB       SER  15 -34.387   0.285   0.285
  112    HG   SER  15           HG       SER  15 -36.825  -0.615  -0.615
  113    H    ALA  16           H        ALA  16 -32.453   1.702   1.702
  114    HA   ALA  16           HA       ALA  16 -31.651   0.157   0.157
  115   1HB   ALA  16          3HB       ALA  16 -30.664  -0.178  -0.178
  116   2HB   ALA  16          2HB       ALA  16 -29.723  -0.707  -0.707
  117   3HB   ALA  16          1HB       ALA  16 -31.315  -1.400  -1.400
  118    H    ILE  17           H        ILE  17 -31.117   2.004   2.004
  119    HA   ILE  17           HA       ILE  17 -29.076   3.765   3.765
  120    HB   ILE  17           HB       ILE  17 -30.621   4.206   4.206
  121   1HG1  ILE  17          2HG1      ILE  17 -31.221   5.573   5.573
  122   2HG1  ILE  17          1HG1      ILE  17 -31.973   4.032   4.032
  123   1HG2  ILE  17          3HG2      ILE  17 -28.364   5.403   5.403
  124   2HG2  ILE  17          2HG2      ILE  17 -29.460   6.391   6.391
  125   3HG2  ILE  17          1HG2      ILE  17 -29.680   6.281   6.281
  126   1HD1  ILE  17          1HD1      ILE  17 -32.393   5.531   5.531
  127   2HD1  ILE  17          3HD1      ILE  17 -32.574   6.702   6.702
  128   3HD1  ILE  17          2HD1      ILE  17 -33.560   5.240   5.240
  129    H    GLN  18           H        GLN  18 -27.358   2.242   2.242
  130    HA   GLN  18           HA       GLN  18 -26.672   1.104   1.104
  131   1HB   GLN  18          2HB       GLN  18 -25.762   0.825   0.825
  132   2HB   GLN  18          1HB       GLN  18 -24.457   1.771   1.771
  133   1HG   GLN  18          2HG       GLN  18 -24.008  -0.616  -0.616
  134   2HG   GLN  18          1HG       GLN  18 -24.148   0.103   0.103
  135   1HE2  GLN  18          1HE2      GLN  18 -24.603  -1.905  -1.905
  136   2HE2  GLN  18          2HE2      GLN  18 -26.142  -2.669  -2.669
  137    H    ASN  19           H        ASN  19 -24.591   1.618   1.618
  138    HA   ASN  19           HA       ASN  19 -24.130   4.518   4.518
  139   1HB   ASN  19          2HB       ASN  19 -24.512   2.634   2.634
  140   2HB   ASN  19          1HB       ASN  19 -24.004   4.315   4.315
  141   1HD2  ASN  19          2HD2      ASN  19 -27.858   3.413   3.413
  142   2HD2  ASN  19          1HD2      ASN  19 -26.579   2.281   2.281
  143    H    LEU  20           H        LEU  20 -22.178   4.352   4.352
  144    HA   LEU  20           HA       LEU  20 -19.931   4.087   4.087
  145   1HB   LEU  20          2HB       LEU  20 -20.404   4.095   4.095
  146   2HB   LEU  20          1HB       LEU  20 -18.929   3.265   3.265
  147    HG   LEU  20           HG       LEU  20 -18.133   5.267   5.267
  148   1HD1  LEU  20          1HD1      LEU  20 -20.870   6.242   6.242
  149   2HD1  LEU  20          3HD1      LEU  20 -19.539   7.398   7.398
  150   3HD1  LEU  20          2HD1      LEU  20 -19.919   6.439   6.439
  151   1HD2  LEU  20          2HD2      LEU  20 -18.964   5.448   5.448
  152   2HD2  LEU  20          1HD2      LEU  20 -17.356   5.226   5.226
  153   3HD2  LEU  20          3HD2      LEU  20 -18.141   6.803   6.803
  154    H    HIS  21           H        HIS  21 -18.230   2.482   2.482
  155    HA   HIS  21           HA       HIS  21 -17.434   0.395   0.395
  156   1HB   HIS  21          2HB       HIS  21 -19.500  -0.522  -0.522
  157   2HB   HIS  21          1HB       HIS  21 -18.096  -1.434  -1.434
  158    HD1  HIS  21           HD1      HIS  21 -16.597   1.637   1.637
  159    HD2  HIS  21           HD2      HIS  21 -18.173  -0.926  -0.926
  160    HE1  HIS  21           HE1      HIS  21 -15.478   2.274   2.274
  161    HE2  HIS  21           HE2      HIS  21 -16.514   0.770   0.770
  162    H    SER  22           H        SER  22 -19.303   1.404   1.404
  163    HA   SER  22           HA       SER  22 -21.115  -0.804  -0.804
  164   1HB   SER  22          2HB       SER  22 -21.862   0.820   0.820
  165   2HB   SER  22          1HB       SER  22 -22.223   1.273   1.273
  166    HG   SER  22           HG       SER  22 -20.672   2.532   2.532
  167    H    PHE  23           H        PHE  23 -18.263   0.829   0.829
  168    HA   PHE  23           HA       PHE  23 -18.130  -1.109  -1.109
  169   1HB   PHE  23          2HB       PHE  23 -17.999   1.637   1.637
  170   2HB   PHE  23          1HB       PHE  23 -16.301   1.175   1.175
  171    HD1  PHE  23           HD1      PHE  23 -15.427  -0.280  -0.280
  172    HD2  PHE  23           HD2      PHE  23 -19.411   1.213   1.213
  173    HE1  PHE  23           HE1      PHE  23 -15.588  -0.823  -0.823
  174    HE2  PHE  23           HE2      PHE  23 -19.581   0.672   0.672
  175    HZ   PHE  23           HZ       PHE  23 -17.668  -0.348  -0.348
  176    H    ASP  24           H        ASP  24 -16.821  -2.746  -2.746
  177    HA   ASP  24           HA       ASP  24 -15.031  -3.954  -3.954
  178   1HB   ASP  24          2HB       ASP  24 -13.532  -1.328  -1.328
  179   2HB   ASP  24          1HB       ASP  24 -12.849  -2.944  -2.944
  180    HA   PRO  25           HA       PRO  25 -15.910  -2.374  -2.374
  181   1HB   PRO  25          2HB       PRO  25 -16.793  -5.178  -5.178
  182   2HB   PRO  25          1HB       PRO  25 -17.596  -3.684  -3.684
  183   1HG   PRO  25          2HG       PRO  25 -18.487  -5.125  -5.125
  184   2HG   PRO  25          1HG       PRO  25 -18.549  -3.353  -3.353
  185   1HD   PRO  25          2HD       PRO  25 -16.625  -5.191  -5.191
  186   2HD   PRO  25          1HD       PRO  25 -17.365  -3.689  -3.689
  187    H    PHE  26           H        PHE  26 -14.526  -5.382  -5.382
  188    HA   PHE  26           HA       PHE  26 -12.592  -5.328  -5.328
  189   1HB   PHE  26          2HB       PHE  26 -12.350  -7.860  -7.860
  190   2HB   PHE  26          1HB       PHE  26 -13.557  -7.365  -7.365
  191    HD1  PHE  26           HD2      PHE  26 -15.909  -6.943  -6.943
  192    HD2  PHE  26           HD1      PHE  26 -12.972  -8.821  -8.821
  193    HE1  PHE  26           HE2      PHE  26 -17.690  -7.850  -7.850
  194    HE2  PHE  26           HE1      PHE  26 -14.747  -9.731  -9.731
  195    HZ   PHE  26           HZ       PHE  26 -17.109  -9.246  -9.246
  196    H    ALA  27           H        ALA  27 -12.910  -6.499  -6.499
  197    HA   ALA  27           HA       ALA  27 -10.702  -5.079  -5.079
  198   1HB   ALA  27          2HB       ALA  27 -10.101  -7.737  -7.737
  199   2HB   ALA  27          1HB       ALA  27  -9.306  -7.311  -7.311
  200   3HB   ALA  27          3HB       ALA  27  -9.102  -6.286  -6.286
  201    H    ASP  28           H        ASP  28 -10.881  -5.013  -5.013
  202    HA   ASP  28           HA       ASP  28 -12.552  -7.051  -7.051
  203   1HB   ASP  28          2HB       ASP  28 -13.282  -4.639  -4.639
  204   2HB   ASP  28          1HB       ASP  28 -11.851  -4.305  -4.305
  205    H    ALA  29           H        ALA  29 -11.472  -8.547  -8.547
  206    HA   ALA  29           HA       ALA  29  -8.813  -7.927  -7.927
  207   1HB   ALA  29          2HB       ALA  29  -9.550 -10.037 -10.037
  208   2HB   ALA  29          1HB       ALA  29  -9.924 -10.671 -10.671
  209   3HB   ALA  29          3HB       ALA  29  -8.288 -10.130 -10.130
  210    H    SER  30           H        SER  30  -8.455  -9.536  -9.536
  211    HA   SER  30           HA       SER  30 -10.558  -8.797  -8.797
  212   1HB   SER  30          2HB       SER  30  -7.599  -8.509  -8.509
  213   2HB   SER  30          1HB       SER  30  -8.428  -8.958  -8.958
  214    HG   SER  30           HG       SER  30  -8.629  -6.840  -6.840
  215    H    LYS  31           H        LYS  31  -7.669 -10.885 -10.885
  216    HA   LYS  31           HA       LYS  31  -9.229 -13.279 -13.279
  217   1HB   LYS  31          2HB       LYS  31  -8.854 -11.917 -11.917
  218   2HB   LYS  31          1HB       LYS  31  -7.522 -13.064 -13.064
  219   1HG   LYS  31          2HG       LYS  31 -10.056 -14.273 -14.273
  220   2HG   LYS  31          1HG       LYS  31 -10.089 -13.552 -13.552
  221   1HD   LYS  31          2HD       LYS  31  -9.210 -15.517 -15.517
  222   2HD   LYS  31          1HD       LYS  31  -7.696 -14.840 -14.840
  223   1HE   LYS  31          2HE       LYS  31  -7.599 -16.306 -16.306
  224   2HE   LYS  31          1HE       LYS  31  -9.295 -16.067 -16.067
  225   1HZ   LYS  31          1HZ       LYS  31  -9.596 -17.474 -17.474
  226   2HZ   LYS  31          3HZ       LYS  31  -8.070 -18.056 -18.056
  227   3HZ   LYS  31          2HZ       LYS  31  -9.376 -18.210 -18.210
  228    H    GLY  32           H        GLY  32  -8.108 -14.624 -14.624
  229   1HA   GLY  32          2HA       GLY  32  -5.807 -15.871 -15.871
  230   2HA   GLY  32          1HA       GLY  32  -5.209 -14.337 -14.337
  231    H    ASP  33           H        ASP  33  -4.365 -16.207 -16.207
  232    HA   ASP  33           HA       ASP  33  -6.018 -16.063 -16.063
  233   1HB   ASP  33          2HB       ASP  33  -5.558 -18.511 -18.511
  234   2HB   ASP  33          1HB       ASP  33  -6.708 -18.185 -18.185
  235    H    ASP  34           H        ASP  34  -4.149 -14.472 -14.472
  236    HA   ASP  34           HA       ASP  34  -1.718 -15.818 -15.818
  237   1HB   ASP  34          2HB       ASP  34  -2.181 -13.392 -13.392
  238   2HB   ASP  34          1HB       ASP  34  -1.203 -13.074 -13.074
  239    H    LEU  35           H        LEU  35  -2.675 -16.350 -16.350
  240    HA   LEU  35           HA       LEU  35  -3.099 -14.040 -14.040
  241   1HB   LEU  35          2HB       LEU  35  -4.119 -16.870 -16.870
  242   2HB   LEU  35          1HB       LEU  35  -4.374 -15.598 -15.598
  243    HG   LEU  35           HG       LEU  35  -5.409 -15.574 -15.574
  244   1HD1  LEU  35          2HD1      LEU  35  -6.590 -16.403 -16.403
  245   2HD1  LEU  35          1HD1      LEU  35  -7.621 -15.627 -15.627
  246   3HD1  LEU  35          3HD1      LEU  35  -6.771 -17.120 -17.120
  247   1HD2  LEU  35          1HD2      LEU  35  -5.654 -13.635 -13.635
  248   2HD2  LEU  35          3HD2      LEU  35  -5.070 -13.332 -13.332
  249   3HD2  LEU  35          2HD2      LEU  35  -6.782 -13.655 -13.655
  250    H    LEU  36           H        LEU  36  -1.039 -13.685 -13.685
  251    HA   LEU  36           HA       LEU  36   0.758 -15.742 -15.742
  252   1HB   LEU  36          2HB       LEU  36   0.768 -12.886 -12.886
  253   2HB   LEU  36          1HB       LEU  36   1.417 -13.363 -13.363
  254    HG   LEU  36           HG       LEU  36   3.096 -14.754 -14.754
  255   1HD1  LEU  36          1HD1      LEU  36   1.424 -14.940 -14.940
  256   2HD1  LEU  36          3HD1      LEU  36   2.491 -13.670 -13.670
  257   3HD1  LEU  36          2HD1      LEU  36   3.158 -15.234 -15.234
  258   1HD2  LEU  36          3HD2      LEU  36   3.224 -12.137 -12.137
  259   2HD2  LEU  36          2HD2      LEU  36   4.506 -13.033 -13.033
  260   3HD2  LEU  36          1HD2      LEU  36   3.293 -12.171 -12.171
  261    HA   PRO  37           HA       PRO  37  -0.740 -16.723 -16.723
  262   1HB   PRO  37          2HB       PRO  37   1.514 -17.704 -17.704
  263   2HB   PRO  37          1HB       PRO  37   0.614 -18.580 -18.580
  264   1HG   PRO  37          2HG       PRO  37   3.085 -16.910 -16.910
  265   2HG   PRO  37          1HG       PRO  37   2.710 -18.482 -18.482
  266   1HD   PRO  37          2HD       PRO  37   2.478 -16.138 -16.138
  267   2HD   PRO  37          1HD       PRO  37   1.440 -17.540 -17.540
  268    H    ALA  38           H        ALA  38  -0.610 -16.098 -16.098
  269    HA   ALA  38           HA       ALA  38   1.351 -14.401 -14.401
  270   1HB   ALA  38          3HB       ALA  38  -0.878 -13.071 -13.071
  271   2HB   ALA  38          2HB       ALA  38  -0.365 -12.378 -12.378
  272   3HB   ALA  38          1HB       ALA  38   0.795 -12.558 -12.558
  273    H    GLY  39           H        GLY  39   1.006 -13.986 -13.986
  274   1HA   GLY  39          2HA       GLY  39  -1.500 -15.104 -15.104
  275   2HA   GLY  39          1HA       GLY  39   0.069 -15.339 -15.339
  276    H    THR  40           H        THR  40  -0.283 -14.362 -14.362
  277    HA   THR  40           HA       THR  40  -1.035 -11.513 -11.513
  278    HB   THR  40           HB       THR  40  -1.315 -12.680 -12.680
  279    HG1  THR  40           HG1      THR  40  -2.706 -13.946 -13.946
  280   1HG2  THR  40          2HG2      THR  40  -2.453 -10.630 -10.630
  281   2HG2  THR  40          1HG2      THR  40  -3.575 -11.790 -11.790
  282   3HG2  THR  40          3HG2      THR  40  -3.404 -11.686 -11.686
  283    H    GLU  41           H        GLU  41   1.230 -13.884 -13.884
  284    HA   GLU  41           HA       GLU  41   3.300 -13.690 -13.690
  285   1HB   GLU  41          2HB       GLU  41   2.896 -11.172 -11.172
  286   2HB   GLU  41          1HB       GLU  41   3.987 -11.011 -11.011
  287   1HG   GLU  41          2HG       GLU  41   5.309 -12.905 -12.905
  288   2HG   GLU  41          1HG       GLU  41   4.267 -12.894 -12.894
  289    H    ASP  42           H        ASP  42   0.673 -12.930 -12.930
  290    HA   ASP  42           HA       ASP  42   0.032 -12.342 -12.342
  291   1HB   ASP  42          2HB       ASP  42   2.622 -13.623 -13.623
  292   2HB   ASP  42          1HB       ASP  42   2.385 -12.452 -12.452
  293    H    TYR  43           H        TYR  43   0.010 -10.150 -10.150
  294    HA   TYR  43           HA       TYR  43   1.957  -8.215  -8.215
  295   1HB   TYR  43          2HB       TYR  43  -0.810  -7.877  -7.877
  296   2HB   TYR  43          1HB       TYR  43   0.353  -6.574  -6.574
  297    HD1  TYR  43           HD2      TYR  43   2.651  -8.772  -8.772
  298    HD2  TYR  43           HD1      TYR  43  -0.855  -7.185  -7.185
  299    HE1  TYR  43           HE2      TYR  43   3.586  -9.259  -9.259
  300    HE2  TYR  43           HE1      TYR  43   0.078  -7.671  -7.671
  301    HH   TYR  43           HH       TYR  43   1.800  -9.314  -9.314
  302    H    ILE  44           H        ILE  44   1.448  -6.249  -6.249
  303    HA   ILE  44           HA       ILE  44  -0.321  -6.873  -6.873
  304    HB   ILE  44           HB       ILE  44   2.138  -5.118  -5.118
  305   1HG1  ILE  44          2HG1      ILE  44   2.849  -7.389  -7.389
  306   2HG1  ILE  44          1HG1      ILE  44   3.021  -6.922  -6.922
  307   1HG2  ILE  44          3HG2      ILE  44   0.374  -4.397  -4.397
  308   2HG2  ILE  44          2HG2      ILE  44   0.395  -6.003  -6.003
  309   3HG2  ILE  44          1HG2      ILE  44   1.822  -4.971  -4.971
  310   1HD1  ILE  44          1HD1      ILE  44   0.663  -7.970  -7.970
  311   2HD1  ILE  44          3HD1      ILE  44   1.065  -8.783  -8.783
  312   3HD1  ILE  44          2HD1      ILE  44   2.084  -9.011  -9.011
  313    H    HIS  45           H        HIS  45  -2.158  -5.946  -5.946
  314    HA   HIS  45           HA       HIS  45  -2.338  -3.439  -3.439
  315   1HB   HIS  45          2HB       HIS  45  -4.074  -5.559  -5.559
  316   2HB   HIS  45          1HB       HIS  45  -4.774  -4.091  -4.091
  317    HD1  HIS  45           HD1      HIS  45  -3.956  -5.767  -5.767
  318    HD2  HIS  45           HD2      HIS  45  -5.705  -2.249  -2.249
  319    HE1  HIS  45           HE1      HIS  45  -5.083  -4.767  -4.767
  320    HE2  HIS  45           HE2      HIS  45  -6.058  -2.592  -2.592
  321    H    ILE  46           H        ILE  46  -1.976  -1.523  -1.523
  322    HA   ILE  46           HA       ILE  46  -2.063  -1.046  -1.046
  323    HB   ILE  46           HB       ILE  46  -1.552   0.863   0.863
  324   1HG1  ILE  46          2HG1      ILE  46   0.117  -0.977  -0.977
  325   2HG1  ILE  46          1HG1      ILE  46   0.773   0.644   0.644
  326   1HG2  ILE  46          1HG2      ILE  46  -1.711   1.265   1.265
  327   2HG2  ILE  46          3HG2      ILE  46  -0.445   2.122   2.122
  328   3HG2  ILE  46          2HG2      ILE  46  -2.139   2.355   2.355
  329   1HD1  ILE  46          3HD1      ILE  46   0.178   0.150   0.150
  330   2HD1  ILE  46          2HD1      ILE  46   0.415  -1.507  -1.507
  331   3HD1  ILE  46          1HD1      ILE  46   1.711  -0.322  -0.322
  332    H    ARG  47           H        ARG  47  -3.302   1.473   1.473
  333    HA   ARG  47           HA       ARG  47  -5.429   2.222   2.222
  334   1HB   ARG  47          2HB       ARG  47  -6.097  -0.262  -0.262
  335   2HB   ARG  47          1HB       ARG  47  -6.681   0.496   0.496
  336   1HG   ARG  47          2HG       ARG  47  -7.471   1.473   1.473
  337   2HG   ARG  47          1HG       ARG  47  -8.351   0.198   0.198
  338   1HD   ARG  47          2HD       ARG  47  -8.064   2.205   2.205
  339   2HD   ARG  47          1HD       ARG  47  -8.406   3.069   3.069
  340    HE   ARG  47           HE       ARG  47 -10.228   1.489   1.489
  341   1HH1  ARG  47          2HH1      ARG  47  -9.433   2.495   2.495
  342   2HH1  ARG  47          1HH1      ARG  47 -11.049   2.296   2.296
  343   1HH2  ARG  47          1HH2      ARG  47 -12.353   1.227   1.227
  344   2HH2  ARG  47          2HH2      ARG  47 -12.706   1.578   1.578
  345    H    ILE  48           H        ILE  48  -6.308   3.998   3.998
  346    HA   ILE  48           HA       ILE  48  -5.922   4.683   4.683
  347    HB   ILE  48           HB       ILE  48  -5.536   6.296   6.296
  348   1HG1  ILE  48          2HG1      ILE  48  -4.175   6.161   6.161
  349   2HG1  ILE  48          1HG1      ILE  48  -3.574   5.527   5.527
  350   1HG2  ILE  48          2HG2      ILE  48  -6.573   7.432   7.432
  351   2HG2  ILE  48          1HG2      ILE  48  -5.758   8.401   8.401
  352   3HG2  ILE  48          3HG2      ILE  48  -7.275   7.589   7.589
  353   1HD1  ILE  48          3HD1      ILE  48  -3.444   7.838   7.838
  354   2HD1  ILE  48          2HD1      ILE  48  -3.941   8.422   8.422
  355   3HD1  ILE  48          1HD1      ILE  48  -2.414   7.555   7.555
  356    H    GLN  49           H        GLN  49  -7.592   6.000   6.000
  357    HA   GLN  49           HA       GLN  49 -10.095   6.219   6.219
  358   1HB   GLN  49          2HB       GLN  49 -11.397   5.174   5.174
  359   2HB   GLN  49          1HB       GLN  49 -10.243   4.044   4.044
  360   1HG   GLN  49          2HG       GLN  49  -8.831   5.130   5.130
  361   2HG   GLN  49          1HG       GLN  49 -10.472   5.067   5.067
  362   1HE2  GLN  49          2HE2      GLN  49 -10.352   1.688   1.688
  363   2HE2  GLN  49          1HE2      GLN  49 -11.080   3.236   3.236
  364    H    GLN  50           H        GLN  50 -10.172   8.398   8.398
  365    HA   GLN  50           HA       GLN  50  -9.872   9.732   9.732
  366   1HB   GLN  50          2HB       GLN  50  -8.960  10.402  10.402
  367   2HB   GLN  50          1HB       GLN  50 -10.331  11.475  11.475
  368   1HG   GLN  50          2HG       GLN  50  -9.357  12.451  12.451
  369   2HG   GLN  50          1HG       GLN  50  -8.147  11.177  11.177
  370   1HE2  GLN  50          2HE2      GLN  50  -6.131  13.742  13.742
  371   2HE2  GLN  50          1HE2      GLN  50  -6.724  13.071  13.071
  372    H    ARG  51           H        ARG  51 -11.782   9.515   9.515
  373    HA   ARG  51           HA       ARG  51 -14.328   9.506   9.506
  374   1HB   ARG  51          2HB       ARG  51 -13.270   9.300   9.300
  375   2HB   ARG  51          1HB       ARG  51 -14.322  10.705  10.705
  376   1HG   ARG  51          2HG       ARG  51 -15.823   9.087   9.087
  377   2HG   ARG  51          1HG       ARG  51 -15.995   9.073   9.073
  378   1HD   ARG  51          2HD       ARG  51 -15.355   6.949   6.949
  379   2HD   ARG  51          1HD       ARG  51 -13.846   7.344   7.344
  380    HE   ARG  51           HE       ARG  51 -16.027   7.153   7.153
  381   1HH1  ARG  51          2HH1      ARG  51 -13.756   5.251   5.251
  382   2HH1  ARG  51          1HH1      ARG  51 -13.814   3.902   3.902
  383   1HH2  ARG  51          1HH2      ARG  51 -16.104   5.380   5.380
  384   2HH2  ARG  51          2HH2      ARG  51 -15.148   3.975   3.975
  385    H    ASN  52           H        ASN  52 -12.635  12.178  12.178
  386    HA   ASN  52           HA       ASN  52 -14.464  14.067  14.067
  387   1HB   ASN  52          2HB       ASN  52 -12.558  14.843  14.843
  388   2HB   ASN  52          1HB       ASN  52 -14.099  15.572  15.572
  389   1HD2  ASN  52          2HD2      ASN  52 -14.035  13.184  13.184
  390   2HD2  ASN  52          1HD2      ASN  52 -12.744  14.149  14.149
  391    H    GLY  53           H        GLY  53 -12.540  16.285  16.285
  392   1HA   GLY  53          2HA       GLY  53 -10.936  15.859  15.859
  393   2HA   GLY  53          1HA       GLY  53 -11.219  17.397  17.397
  394    H    ARG  54           H        ARG  54 -10.151  14.457  14.457
  395    HA   ARG  54           HA       ARG  54  -7.409  14.824  14.824
  396   1HB   ARG  54          2HB       ARG  54  -7.030  15.813  15.813
  397   2HB   ARG  54          1HB       ARG  54  -7.641  16.939  16.939
  398   1HG   ARG  54          2HG       ARG  54  -9.761  17.009  17.009
  399   2HG   ARG  54          1HG       ARG  54  -9.496  15.522  15.522
  400   1HD   ARG  54          2HD       ARG  54  -7.507  17.452  17.452
  401   2HD   ARG  54          1HD       ARG  54  -9.106  18.183  18.183
  402    HE   ARG  54           HE       ARG  54  -9.004  15.597  15.597
  403   1HH1  ARG  54          2HH1      ARG  54  -8.216  18.959  18.959
  404   2HH1  ARG  54          1HH1      ARG  54  -8.305  18.847  18.847
  405   1HH2  ARG  54          1HH2      ARG  54  -9.123  15.450  15.450
  406   2HH2  ARG  54          2HH2      ARG  54  -8.819  16.856  16.856
  407    H    LYS  55           H        LYS  55 -10.224  13.729  13.729
  408    HA   LYS  55           HA       LYS  55  -8.927  12.014  12.014
  409   1HB   LYS  55          2HB       LYS  55 -11.579  12.734  12.734
  410   2HB   LYS  55          1HB       LYS  55 -11.504  10.987  10.987
  411   1HG   LYS  55          2HG       LYS  55 -10.677  12.547  12.547
  412   2HG   LYS  55          1HG       LYS  55 -12.179  11.640  11.640
  413   1HD   LYS  55          2HD       LYS  55  -9.508  10.318  10.318
  414   2HD   LYS  55          1HD       LYS  55 -10.228  10.525  10.525
  415   1HE   LYS  55          2HE       LYS  55 -11.997   9.402   9.402
  416   2HE   LYS  55          1HE       LYS  55 -10.650   8.378   8.378
  417   1HZ   LYS  55          3HZ       LYS  55 -12.155   9.628   9.628
  418   2HZ   LYS  55          2HZ       LYS  55 -12.981   8.444   8.444
  419   3HZ   LYS  55          1HZ       LYS  55 -11.523   8.062   8.062
  420    H    THR  56           H        THR  56  -7.316  11.314  11.314
  421    HA   THR  56           HA       THR  56  -8.219   9.241   9.241
  422    HB   THR  56           HB       THR  56  -5.329   9.564   9.564
  423    HG1  THR  56           HG1      THR  56  -5.170  11.628  11.628
  424   1HG2  THR  56          3HG2      THR  56  -7.168   9.044   9.044
  425   2HG2  THR  56          2HG2      THR  56  -6.073  10.359  10.359
  426   3HG2  THR  56          1HG2      THR  56  -5.423   8.795   8.795
  427    H    LEU  57           H        LEU  57  -7.505   7.078   7.078
  428    HA   LEU  57           HA       LEU  57  -6.210   6.137   6.137
  429   1HB   LEU  57          2HB       LEU  57  -9.044   5.730   5.730
  430   2HB   LEU  57          1HB       LEU  57  -8.184   4.271   4.271
  431    HG   LEU  57           HG       LEU  57  -8.240   6.763   6.763
  432   1HD1  LEU  57          3HD1      LEU  57 -10.164   4.525   4.525
  433   2HD1  LEU  57          2HD1      LEU  57  -9.773   5.084   5.084
  434   3HD1  LEU  57          1HD1      LEU  57 -10.433   6.211   6.211
  435   1HD2  LEU  57          3HD2      LEU  57  -6.626   4.491   4.491
  436   2HD2  LEU  57          2HD2      LEU  57  -6.841   5.694   5.694
  437   3HD2  LEU  57          1HD2      LEU  57  -7.839   4.240   4.240
  438    H    THR  58           H        THR  58  -4.509   5.698   5.698
  439    HA   THR  58           HA       THR  58  -4.788   4.061   4.061
  440    HB   THR  58           HB       THR  58  -2.381   4.396   4.396
  441    HG1  THR  58           HG1      THR  58  -3.355   6.316   6.316
  442   1HG2  THR  58          3HG2      THR  58  -2.694   3.193   3.193
  443   2HG2  THR  58          2HG2      THR  58  -1.205   4.035   4.035
  444   3HG2  THR  58          1HG2      THR  58  -1.735   2.642   2.642
  445    H    THR  59           H        THR  59  -4.768   1.875   1.875
  446    HA   THR  59           HA       THR  59  -4.593   0.211   0.211
  447    HB   THR  59           HB       THR  59  -6.111  -1.283  -1.283
  448    HG1  THR  59           HG1      THR  59  -7.222  -0.021  -0.021
  449   1HG2  THR  59          1HG2      THR  59  -6.562   0.172   0.172
  450   2HG2  THR  59          3HG2      THR  59  -8.008   0.106   0.106
  451   3HG2  THR  59          2HG2      THR  59  -7.196  -1.386  -1.386
  452    H    VAL  60           H        VAL  60  -3.872  -1.972  -1.972
  453    HA   VAL  60           HA       VAL  60  -2.191  -2.338  -2.338
  454    HB   VAL  60           HB       VAL  60  -1.493  -3.110  -3.110
  455   1HG1  VAL  60          2HG1      VAL  60  -0.033  -3.598  -3.598
  456   2HG1  VAL  60          1HG1      VAL  60   0.690  -3.796  -3.796
  457   3HG1  VAL  60          3HG1      VAL  60  -0.669  -4.810  -4.810
  458   1HG2  VAL  60          2HG2      VAL  60  -0.666  -0.903  -0.903
  459   2HG2  VAL  60          1HG2      VAL  60  -1.005  -0.870  -0.870
  460   3HG2  VAL  60          3HG2      VAL  60   0.508  -1.559  -1.559
  461    H    GLN  61           H        GLN  61  -2.742  -4.051  -4.051
  462    HA   GLN  61           HA       GLN  61  -3.994  -6.338  -6.338
  463   1HB   GLN  61          2HB       GLN  61  -5.227  -4.774  -4.774
  464   2HB   GLN  61          1HB       GLN  61  -4.520  -6.002  -6.002
  465   1HG   GLN  61          2HG       GLN  61  -5.661  -7.424  -7.424
  466   2HG   GLN  61          1HG       GLN  61  -6.821  -6.148  -6.148
  467   1HE2  GLN  61          2HE2      GLN  61  -6.858  -7.346  -7.346
  468   2HE2  GLN  61          1HE2      GLN  61  -6.279  -5.919  -5.919
  469    H    GLY  62           H        GLY  62  -3.390  -8.409  -8.409
  470   1HA   GLY  62          2HA       GLY  62  -2.230  -9.915  -9.915
  471   2HA   GLY  62          1HA       GLY  62  -1.174  -8.584  -8.584
  472    H    ILE  63           H        ILE  63  -1.030  -7.804  -7.804
  473    HA   ILE  63           HA       ILE  63   1.336  -9.273  -9.273
  474    HB   ILE  63           HB       ILE  63  -0.230  -7.205  -7.205
  475   1HG1  ILE  63          2HG1      ILE  63   0.875  -6.025  -6.025
  476   2HG1  ILE  63          1HG1      ILE  63   2.118  -6.043  -6.043
  477   1HG2  ILE  63          3HG2      ILE  63   1.900  -8.972  -8.972
  478   2HG2  ILE  63          2HG2      ILE  63   2.171  -7.260  -7.260
  479   3HG2  ILE  63          1HG2      ILE  63   0.706  -8.044  -8.044
  480   1HD1  ILE  63          2HD1      ILE  63   2.973  -8.150  -8.150
  481   2HD1  ILE  63          1HD1      ILE  63   1.968  -7.598  -7.598
  482   3HD1  ILE  63          3HD1      ILE  63   3.267  -6.571  -6.571
  483    H    ALA  64           H        ALA  64   1.732 -10.704 -10.704
  484    HA   ALA  64           HA       ALA  64  -0.503 -12.372 -12.372
  485   1HB   ALA  64          3HB       ALA  64   1.886 -13.117 -13.117
  486   2HB   ALA  64          2HB       ALA  64   2.281 -12.733 -12.733
  487   3HB   ALA  64          1HB       ALA  64   1.058 -13.952 -13.952
  488    H    ASP  65           H        ASP  65  -1.414 -12.623 -12.623
  489    HA   ASP  65           HA       ASP  65  -1.278 -10.478 -10.478
  490   1HB   ASP  65          2HB       ASP  65  -2.718 -11.931 -11.931
  491   2HB   ASP  65          1HB       ASP  65  -3.317 -11.742 -11.742
  492    H    ASP  66           H        ASP  66   0.724 -13.191 -13.191
  493    HA   ASP  66           HA       ASP  66   1.578 -13.210 -13.210
  494   1HB   ASP  66          2HB       ASP  66   1.209 -15.305 -15.305
  495   2HB   ASP  66          1HB       ASP  66   2.814 -14.913 -14.913
  496    H    TYR  67           H        TYR  67   2.106 -10.894 -10.894
  497    HA   TYR  67           HA       TYR  67   4.966 -11.001 -11.001
  498   1HB   TYR  67          2HB       TYR  67   2.746  -9.118  -9.118
  499   2HB   TYR  67          1HB       TYR  67   4.367  -8.448  -8.448
  500    HD1  TYR  67           HD1      TYR  67   4.147 -11.863 -11.863
  501    HD2  TYR  67           HD2      TYR  67   4.043  -7.779  -7.779
  502    HE1  TYR  67           HE1      TYR  67   4.574 -12.525 -12.525
  503    HE2  TYR  67           HE2      TYR  67   4.466  -8.418  -8.418
  504    HH   TYR  67           HH       TYR  67   4.269 -11.658 -11.658
  505    H    ASP  68           H        ASP  68   3.818 -11.129 -11.129
  506    HA   ASP  68           HA       ASP  68   4.653 -10.518 -10.518
  507   1HB   ASP  68          2HB       ASP  68   6.662  -9.680  -9.680
  508   2HB   ASP  68          1HB       ASP  68   6.018  -8.093  -8.093
  509    H    LYS  69           H        LYS  69   2.930  -8.466  -8.466
  510    HA   LYS  69           HA       LYS  69   1.306  -6.921  -6.921
  511   1HB   LYS  69          2HB       LYS  69   0.401  -8.538  -8.538
  512   2HB   LYS  69          1HB       LYS  69   1.441  -7.904  -7.904
  513   1HG   LYS  69          2HG       LYS  69   0.262  -5.828  -5.828
  514   2HG   LYS  69          1HG       LYS  69  -0.666  -6.281  -6.281
  515   1HD   LYS  69          2HD       LYS  69  -2.159  -6.700  -6.700
  516   2HD   LYS  69          1HD       LYS  69  -1.446  -8.289  -8.289
  517   1HE   LYS  69          2HE       LYS  69  -0.229  -8.248  -8.248
  518   2HE   LYS  69          1HE       LYS  69  -0.177  -6.486  -6.486
  519   1HZ   LYS  69          2HZ       LYS  69  -2.761  -6.844  -6.844
  520   2HZ   LYS  69          1HZ       LYS  69  -2.240  -8.319  -8.319
  521   3HZ   LYS  69          3HZ       LYS  69  -1.691  -6.865  -6.865
  522    H    LYS  70           H        LYS  70   2.877  -6.629  -6.629
  523    HA   LYS  70           HA       LYS  70   2.845  -3.885  -3.885
  524   1HB   LYS  70          2HB       LYS  70   4.586  -4.067  -4.067
  525   2HB   LYS  70          1HB       LYS  70   3.417  -5.366  -5.366
  526   1HG   LYS  70          2HG       LYS  70   4.975  -6.875  -6.875
  527   2HG   LYS  70          1HG       LYS  70   6.159  -5.566  -5.566
  528   1HD   LYS  70          2HD       LYS  70   6.619  -5.770  -5.770
  529   2HD   LYS  70          1HD       LYS  70   4.968  -6.240  -6.240
  530   1HE   LYS  70          2HE       LYS  70   6.843  -8.055  -8.055
  531   2HE   LYS  70          1HE       LYS  70   6.769  -8.014  -8.014
  532   1HZ   LYS  70          1HZ       LYS  70   4.201  -8.296  -8.296
  533   2HZ   LYS  70          3HZ       LYS  70   4.849  -9.073  -9.073
  534   3HZ   LYS  70          2HZ       LYS  70   5.241  -9.616  -9.616
  535    H    LYS  71           H        LYS  71   5.448  -5.926  -5.926
  536    HA   LYS  71           HA       LYS  71   7.259  -3.885  -3.885
  537   1HB   LYS  71          2HB       LYS  71   7.569  -6.445  -6.445
  538   2HB   LYS  71          1HB       LYS  71   6.968  -6.341  -6.341
  539   1HG   LYS  71          2HG       LYS  71   9.130  -4.466  -4.466
  540   2HG   LYS  71          1HG       LYS  71   9.570  -6.175  -6.175
  541   1HD   LYS  71          2HD       LYS  71   8.075  -5.945  -5.945
  542   2HD   LYS  71          1HD       LYS  71   8.981  -4.432  -4.432
  543   1HE   LYS  71          2HE       LYS  71  10.087  -7.233  -7.233
  544   2HE   LYS  71          1HE       LYS  71  10.270  -6.048  -6.048
  545   1HZ   LYS  71          2HZ       LYS  71  11.331  -4.658  -4.658
  546   2HZ   LYS  71          1HZ       LYS  71  11.611  -6.186  -6.186
  547   3HZ   LYS  71          3HZ       LYS  71  12.244  -5.798  -5.798
  548    H    LEU  72           H        LEU  72   4.231  -4.490  -4.490
  549    HA   LEU  72           HA       LEU  72   4.974  -3.230  -3.230
  550   1HB   LEU  72          2HB       LEU  72   2.428  -4.568  -4.568
  551   2HB   LEU  72          1HB       LEU  72   2.622  -3.795  -3.795
  552    HG   LEU  72           HG       LEU  72   3.672  -5.573  -5.573
  553   1HD1  LEU  72          3HD1      LEU  72   5.719  -5.050  -5.050
  554   2HD1  LEU  72          2HD1      LEU  72   5.118  -6.096  -6.096
  555   3HD1  LEU  72          1HD1      LEU  72   5.490  -6.775  -6.775
  556   1HD2  LEU  72          3HD2      LEU  72   1.981  -6.440  -6.440
  557   2HD2  LEU  72          2HD2      LEU  72   2.318  -7.224  -7.224
  558   3HD2  LEU  72          1HD2      LEU  72   3.338  -7.556  -7.556
  559    H    VAL  73           H        VAL  73   2.154  -2.947  -2.947
  560    HA   VAL  73           HA       VAL  73   1.747  -0.223  -0.223
  561    HB   VAL  73           HB       VAL  73  -0.076  -1.911  -1.911
  562   1HG1  VAL  73          2HG1      VAL  73   0.913  -2.605  -2.605
  563   2HG1  VAL  73          1HG1      VAL  73   0.588  -0.996  -0.996
  564   3HG1  VAL  73          3HG1      VAL  73  -0.750  -2.039  -2.039
  565   1HG2  VAL  73          3HG2      VAL  73  -0.077   0.883   0.883
  566   2HG2  VAL  73          2HG2      VAL  73  -0.622   0.363   0.363
  567   3HG2  VAL  73          1HG2      VAL  73  -1.517  -0.122  -0.122
  568    H    LYS  74           H        LYS  74   2.762  -1.837  -1.837
  569    HA   LYS  74           HA       LYS  74   3.035   0.511   0.511
  570   1HB   LYS  74          2HB       LYS  74   3.198  -2.093  -2.093
  571   2HB   LYS  74          1HB       LYS  74   4.917  -1.743  -1.743
  572   1HG   LYS  74          2HG       LYS  74   4.071   0.323   0.323
  573   2HG   LYS  74          1HG       LYS  74   2.980  -0.966  -0.966
  574   1HD   LYS  74          2HD       LYS  74   5.741  -1.860  -1.860
  575   2HD   LYS  74          1HD       LYS  74   5.552  -0.548  -0.548
  576   1HE   LYS  74          2HE       LYS  74   3.587  -1.925  -1.925
  577   2HE   LYS  74          1HE       LYS  74   4.272  -3.261  -3.261
  578   1HZ   LYS  74          1HZ       LYS  74   6.171  -1.829  -1.829
  579   2HZ   LYS  74          3HZ       LYS  74   4.967  -2.640  -2.640
  580   3HZ   LYS  74          2HZ       LYS  74   5.955  -3.494  -3.494
  581    H    ALA  75           H        ALA  75   5.296  -1.277  -1.277
  582    HA   ALA  75           HA       ALA  75   7.548   0.362   0.362
  583   1HB   ALA  75          2HB       ALA  75   7.332  -1.996  -1.996
  584   2HB   ALA  75          1HB       ALA  75   7.232  -1.022  -1.022
  585   3HB   ALA  75          3HB       ALA  75   8.645  -0.896  -0.896
  586    H    PHE  76           H        PHE  76   5.017   0.400   0.400
  587    HA   PHE  76           HA       PHE  76   5.926   2.324   2.324
  588   1HB   PHE  76          2HB       PHE  76   3.653   1.053   1.053
  589   2HB   PHE  76          1HB       PHE  76   3.083   2.455   2.455
  590    HD1  PHE  76           HD1      PHE  76   4.696   1.452   1.452
  591    HD2  PHE  76           HD2      PHE  76   2.384   4.369   4.369
  592    HE1  PHE  76           HE1      PHE  76   4.310   2.638   2.638
  593    HE2  PHE  76           HE2      PHE  76   1.993   5.560   5.560
  594    HZ   PHE  76           HZ       PHE  76   2.956   4.693   4.693
  595    H    LYS  77           H        LYS  77   4.117   2.946   2.946
  596    HA   LYS  77           HA       LYS  77   4.217   5.751   5.751
  597   1HB   LYS  77          2HB       LYS  77   3.894   3.836   3.836
  598   2HB   LYS  77          1HB       LYS  77   3.876   5.579   5.579
  599   1HG   LYS  77          2HG       LYS  77   1.929   5.813   5.813
  600   2HG   LYS  77          1HG       LYS  77   2.012   4.123   4.123
  601   1HD   LYS  77          2HD       LYS  77   1.639   5.003   5.003
  602   2HD   LYS  77          1HD       LYS  77   0.302   4.626   4.626
  603   1HE   LYS  77          2HE       LYS  77   0.619   2.417   2.417
  604   2HE   LYS  77          1HE       LYS  77   2.371   2.565   2.565
  605   1HZ   LYS  77          1HZ       LYS  77   0.821   3.183   3.183
  606   2HZ   LYS  77          3HZ       LYS  77   1.570   1.695   1.695
  607   3HZ   LYS  77          2HZ       LYS  77   2.503   3.099   3.099
  608    H    LYS  78           H        LYS  78   6.611   3.431   3.431
  609    HA   LYS  78           HA       LYS  78   8.249   5.252   5.252
  610   1HB   LYS  78          2HB       LYS  78   8.159   2.706   2.706
  611   2HB   LYS  78          1HB       LYS  78   9.129   2.643   2.643
  612   1HG   LYS  78          2HG       LYS  78  10.675   2.482   2.482
  613   2HG   LYS  78          1HG       LYS  78  10.768   4.167   4.167
  614   1HD   LYS  78          2HD       LYS  78   8.755   3.835   3.835
  615   2HD   LYS  78          1HD       LYS  78  10.308   3.202   3.202
  616   1HE   LYS  78          2HE       LYS  78  11.376   5.269   5.269
  617   2HE   LYS  78          1HE       LYS  78  10.083   5.897   5.897
  618   1HZ   LYS  78          1HZ       LYS  78   8.706   5.486   5.486
  619   2HZ   LYS  78          3HZ       LYS  78  10.222   5.694   5.694
  620   3HZ   LYS  78          2HZ       LYS  78   9.570   6.918   6.918
  621    H    LYS  79           H        LYS  79   7.734   4.552   4.552
  622    HA   LYS  79           HA       LYS  79  10.316   5.720   5.720
  623   1HB   LYS  79          2HB       LYS  79   9.747   3.546   3.546
  624   2HB   LYS  79          1HB       LYS  79   8.300   4.257   4.257
  625   1HG   LYS  79          2HG       LYS  79   9.546   5.596   5.596
  626   2HG   LYS  79          1HG       LYS  79  11.048   5.310   5.310
  627   1HD   LYS  79          2HD       LYS  79  10.665   2.830   2.830
  628   2HD   LYS  79          1HD       LYS  79   9.536   3.455   3.455
  629   1HE   LYS  79          2HE       LYS  79  11.723   3.113   3.113
  630   2HE   LYS  79          1HE       LYS  79  11.331   4.832   4.832
  631   1HZ   LYS  79          3HZ       LYS  79  12.837   3.720   3.720
  632   2HZ   LYS  79          2HZ       LYS  79  13.656   3.929   3.929
  633   3HZ   LYS  79          1HZ       LYS  79  12.928   5.254   5.254
  634    H    PHE  80           H        PHE  80   6.835   6.018   6.018
  635    HA   PHE  80           HA       PHE  80   7.368   8.714   8.714
  636   1HB   PHE  80          2HB       PHE  80   4.805   7.287   7.287
  637   2HB   PHE  80          1HB       PHE  80   5.658   8.482   8.482
  638    HD1  PHE  80           HD1      PHE  80   5.577   4.942   4.942
  639    HD2  PHE  80           HD2      PHE  80   7.278   7.836   7.836
  640    HE1  PHE  80           HE1      PHE  80   6.536   3.138   3.138
  641    HE2  PHE  80           HE2      PHE  80   8.240   6.035   6.035
  642    HZ   PHE  80           HZ       PHE  80   7.869   3.683   3.683
  643    H    ALA  81           H        ALA  81   5.834   6.959   6.959
  644    HA   ALA  81           HA       ALA  81   4.627   7.634   7.634
  645   1HB   ALA  81          3HB       ALA  81   6.257   9.644   9.644
  646   2HB   ALA  81          2HB       ALA  81   4.822  10.495  10.495
  647   3HB   ALA  81          1HB       ALA  81   4.848   9.799   9.799
  648    H    CYS  82           H        CYS  82   3.317   6.891   6.891
  649    HA   CYS  82           HA       CYS  82   1.006   8.695   8.695
  650   1HB   CYS  82          2HB       CYS  82   2.270   6.826   6.826
  651   2HB   CYS  82          1HB       CYS  82   0.511   6.796   6.796
  652    HG   CYS  82           HG       CYS  82   0.557   9.350   9.350
  653    H    ASN  83           H        ASN  83  -0.976   8.099   8.099
  654    HA   ASN  83           HA       ASN  83  -1.236   5.972   5.972
  655   1HB   ASN  83          2HB       ASN  83  -2.807   8.188   8.188
  656   2HB   ASN  83          1HB       ASN  83  -3.815   6.747   6.747
  657   1HD2  ASN  83          2HD2      ASN  83  -2.111   7.496   7.496
  658   2HD2  ASN  83          1HD2      ASN  83  -1.165   7.540   7.540
  659    H    GLY  84           H        GLY  84  -1.151   3.901   3.901
  660   1HA   GLY  84          2HA       GLY  84  -2.563   3.078   3.078
  661   2HA   GLY  84          1HA       GLY  84  -1.159   2.253   2.253
  662    H    THR  85           H        THR  85  -4.109   1.560   1.560
  663    HA   THR  85           HA       THR  85  -4.512   0.109   0.109
  664    HB   THR  85           HB       THR  85  -6.969   0.446   0.446
  665    HG1  THR  85           HG1      THR  85  -7.403   1.070   1.070
  666   1HG2  THR  85          2HG2      THR  85  -5.343   2.962   2.962
  667   2HG2  THR  85          1HG2      THR  85  -7.052   2.814   2.814
  668   3HG2  THR  85          3HG2      THR  85  -5.845   1.879   1.879
  669    H    VAL  86           H        VAL  86  -4.592  -2.002  -2.002
  670    HA   VAL  86           HA       VAL  86  -4.791  -3.097  -3.097
  671    HB   VAL  86           HB       VAL  86  -3.288  -4.110  -4.110
  672   1HG1  VAL  86          1HG1      VAL  86  -5.234  -3.699  -3.699
  673   2HG1  VAL  86          3HG1      VAL  86  -5.425  -5.426  -5.426
  674   3HG1  VAL  86          2HG1      VAL  86  -3.868  -4.791  -4.791
  675   1HG2  VAL  86          1HG2      VAL  86  -5.038  -5.456  -5.456
  676   2HG2  VAL  86          3HG2      VAL  86  -3.528  -6.070  -6.070
  677   3HG2  VAL  86          2HG2      VAL  86  -5.053  -6.388  -6.388
  678    H    ILE  87           H        ILE  87  -6.827  -2.770  -2.770
  679    HA   ILE  87           HA       ILE  87  -9.137  -3.682  -3.682
  680    HB   ILE  87           HB       ILE  87 -10.507  -2.670  -2.670
  681   1HG1  ILE  87          2HG1      ILE  87  -8.343  -1.245  -1.245
  682   2HG1  ILE  87          1HG1      ILE  87  -8.256  -2.985  -2.985
  683   1HG2  ILE  87          1HG2      ILE  87  -8.341  -0.887  -0.887
  684   2HG2  ILE  87          3HG2      ILE  87  -9.836  -0.309  -0.309
  685   3HG2  ILE  87          2HG2      ILE  87  -9.894  -1.261  -1.261
  686   1HD1  ILE  87          3HD1      ILE  87 -10.591  -2.950  -2.950
  687   2HD1  ILE  87          2HD1      ILE  87 -10.594  -1.195  -1.195
  688   3HD1  ILE  87          1HD1      ILE  87  -9.514  -1.965  -1.965
  689    H    GLU  88           H        GLU  88 -10.636  -5.198  -5.198
  690    HA   GLU  88           HA       GLU  88  -9.436  -7.086  -7.086
  691   1HB   GLU  88          2HB       GLU  88 -10.388  -7.666  -7.666
  692   2HB   GLU  88          1HB       GLU  88 -11.907  -7.755  -7.755
  693   1HG   GLU  88          2HG       GLU  88 -11.140  -9.501  -9.501
  694   2HG   GLU  88          1HG       GLU  88  -9.461  -9.235  -9.235
  695    H    HIS  89           H        HIS  89 -10.043  -5.469  -5.469
  696    HA   HIS  89           HA       HIS  89 -12.539  -4.650  -4.650
  697   1HB   HIS  89          2HB       HIS  89 -10.144  -4.418  -4.418
  698   2HB   HIS  89          1HB       HIS  89 -10.797  -5.671  -5.671
  699    HD1  HIS  89           HD1      HIS  89 -12.145  -4.870  -4.870
  700    HD2  HIS  89           HD2      HIS  89 -11.898  -2.032  -2.032
  701    HE1  HIS  89           HE1      HIS  89 -13.306  -2.831  -2.831
  702    HE2  HIS  89           HE2      HIS  89 -13.055  -1.091  -1.091
  703    HA   PRO  90           HA       PRO  90 -14.743  -8.389  -8.389
  704   1HB   PRO  90          2HB       PRO  90 -16.936  -7.317  -7.317
  705   2HB   PRO  90          1HB       PRO  90 -16.606  -7.158  -7.158
  706   1HG   PRO  90          2HG       PRO  90 -16.166  -5.180  -5.180
  707   2HG   PRO  90          1HG       PRO  90 -16.816  -4.916  -4.916
  708   1HD   PRO  90          2HD       PRO  90 -14.223  -4.388  -4.388
  709   2HD   PRO  90          1HD       PRO  90 -14.731  -4.782  -4.782
  710    H    GLU  91           H        GLU  91 -13.795  -6.048  -6.048
  711    HA   GLU  91           HA       GLU  91 -14.599  -7.627  -7.627
  712   1HB   GLU  91          2HB       GLU  91 -13.751  -4.944  -4.944
  713   2HB   GLU  91          1HB       GLU  91 -12.722  -5.643  -5.643
  714   1HG   GLU  91          2HG       GLU  91 -14.690  -4.457  -4.457
  715   2HG   GLU  91          1HG       GLU  91 -14.615  -6.153  -6.153
  716    H    TYR  92           H        TYR  92 -11.815  -7.300  -7.300
  717    HA   TYR  92           HA       TYR  92 -10.271  -8.997  -8.997
  718   1HB   TYR  92          2HB       TYR  92  -8.986  -7.355  -7.355
  719   2HB   TYR  92          1HB       TYR  92  -8.288  -7.954  -7.954
  720    HD1  TYR  92           HD2      TYR  92 -10.403  -7.043  -7.043
  721    HD2  TYR  92           HD1      TYR  92  -8.556  -5.044  -5.044
  722    HE1  TYR  92           HE2      TYR  92 -10.865  -4.881  -4.881
  723    HE2  TYR  92           HE1      TYR  92  -9.012  -2.874  -2.874
  724    HH   TYR  92           HH       TYR  92 -11.104  -2.543  -2.543
  725    H    GLY  93           H        GLY  93 -10.774  -8.301  -8.301
  726   1HA   GLY  93          2HA       GLY  93 -11.429 -10.195 -10.195
  727   2HA   GLY  93          1HA       GLY  93 -10.286 -11.171 -11.171
  728    H    GLU  94           H        GLU  94  -8.418  -8.713  -8.713
  729    HA   GLU  94           HA       GLU  94  -7.764  -8.244  -8.244
  730   1HB   GLU  94          2HB       GLU  94  -6.884 -10.785 -10.785
  731   2HB   GLU  94          1HB       GLU  94  -5.499  -9.785  -9.785
  732   1HG   GLU  94          2HG       GLU  94  -5.829 -10.041 -10.041
  733   2HG   GLU  94          1HG       GLU  94  -7.560  -9.737  -9.737
  734    H    VAL  95           H        VAL  95  -7.084  -6.222  -6.222
  735    HA   VAL  95           HA       VAL  95  -4.655  -5.842  -5.842
  736    HB   VAL  95           HB       VAL  95  -5.654  -3.886  -3.886
  737   1HG1  VAL  95          1HG1      VAL  95  -5.378  -6.428  -6.428
  738   2HG1  VAL  95          3HG1      VAL  95  -7.122  -6.261  -6.261
  739   3HG1  VAL  95          2HG1      VAL  95  -6.026  -5.172  -5.172
  740   1HG2  VAL  95          1HG2      VAL  95  -7.682  -3.777  -3.777
  741   2HG2  VAL  95          3HG2      VAL  95  -8.009  -3.691  -3.691
  742   3HG2  VAL  95          2HG2      VAL  95  -8.291  -5.195  -5.195
  743    H    ILE  96           H        ILE  96  -3.494  -4.019  -4.019
  744    HA   ILE  96           HA       ILE  96  -4.195  -2.912  -2.912
  745    HB   ILE  96           HB       ILE  96  -1.817  -2.860  -2.860
  746   1HG1  ILE  96          2HG1      ILE  96  -2.291  -4.236  -4.236
  747   2HG1  ILE  96          1HG1      ILE  96  -0.698  -3.511  -3.511
  748   1HG2  ILE  96          2HG2      ILE  96  -2.383  -0.583  -0.583
  749   2HG2  ILE  96          1HG2      ILE  96  -0.802  -0.947  -0.947
  750   3HG2  ILE  96          3HG2      ILE  96  -2.137  -0.479  -0.479
  751   1HD1  ILE  96          1HD1      ILE  96  -2.942  -2.357  -2.357
  752   2HD1  ILE  96          3HD1      ILE  96  -1.579  -3.280  -3.280
  753   3HD1  ILE  96          2HD1      ILE  96  -1.305  -1.717  -1.717
  754    H    GLN  97           H        GLN  97  -4.344  -0.586  -0.586
  755    HA   GLN  97           HA       GLN  97  -5.266   0.947   0.947
  756   1HB   GLN  97          2HB       GLN  97  -6.929  -0.068  -0.068
  757   2HB   GLN  97          1HB       GLN  97  -6.788   1.656   1.656
  758   1HG   GLN  97          2HG       GLN  97  -7.344   1.925   1.925
  759   2HG   GLN  97          1HG       GLN  97  -7.903   0.256   0.256
  760   1HE2  GLN  97          2HE2      GLN  97 -11.020   1.479   1.479
  761   2HE2  GLN  97          1HE2      GLN  97 -10.046   0.572   0.572
  762    H    LEU  98           H        LEU  98  -3.549   2.329   2.329
  763    HA   LEU  98           HA       LEU  98  -2.591   3.647   3.647
  764   1HB   LEU  98          2HB       LEU  98  -1.821   4.084   4.084
  765   2HB   LEU  98          1HB       LEU  98  -0.988   4.730   4.730
  766    HG   LEU  98           HG       LEU  98  -1.275   1.767   1.767
  767   1HD1  LEU  98          3HD1      LEU  98   0.783   3.604   3.604
  768   2HD1  LEU  98          2HD1      LEU  98   1.027   1.869   1.869
  769   3HD1  LEU  98          1HD1      LEU  98  -0.272   2.462   2.462
  770   1HD2  LEU  98          2HD2      LEU  98   0.147   3.592   3.592
  771   2HD2  LEU  98          1HD2      LEU  98  -0.370   1.922   1.922
  772   3HD2  LEU  98          3HD2      LEU  98   1.124   2.264   2.264
  773    H    GLN  99           H        GLN  99  -2.503   5.997   5.997
  774    HA   GLN  99           HA       GLN  99  -4.970   7.186   7.186
  775   1HB   GLN  99          2HB       GLN  99  -3.194   7.684   7.684
  776   2HB   GLN  99          1HB       GLN  99  -4.010   9.083   9.083
  777   1HG   GLN  99          2HG       GLN  99  -5.527   6.602   6.602
  778   2HG   GLN  99          1HG       GLN  99  -5.136   7.810   7.810
  779   1HE2  GLN  99          2HE2      GLN  99  -7.136  10.341  10.341
  780   2HE2  GLN  99          1HE2      GLN  99  -5.524  10.150  10.150
  781    H    GLY 100           H        GLY 100  -5.033   8.849   8.849
  782   1HA   GLY 100          2HA       GLY 100  -4.275  10.618  10.618
  783   2HA   GLY 100          1HA       GLY 100  -2.699  10.464  10.464
  784    H    ASP 101           H        ASP 101  -2.875  10.944  10.944
  785    HA   ASP 101           HA       ASP 101  -2.872   8.607   8.607
  786   1HB   ASP 101          2HB       ASP 101  -1.803  10.028  10.028
  787   2HB   ASP 101          1HB       ASP 101  -3.209  10.804  10.804
  788    H    GLN 102           H        GLN 102  -1.562   7.011   7.011
  789    HA   GLN 102           HA       GLN 102   1.305   7.613   7.613
  790   1HB   GLN 102          2HB       GLN 102  -0.530   5.875   5.875
  791   2HB   GLN 102          1HB       GLN 102   0.963   5.075   5.075
  792   1HG   GLN 102          2HG       GLN 102   0.913   6.196   6.196
  793   2HG   GLN 102          1HG       GLN 102   2.281   6.572   6.572
  794   1HE2  GLN 102          2HE2      GLN 102  -0.585   9.477   9.477
  795   2HE2  GLN 102          1HE2      GLN 102  -0.996   7.829   7.829
  796    H    ARG 103           H        ARG 103  -0.737   6.587   6.587
  797    HA   ARG 103           HA       ARG 103   0.046   4.142   4.142
  798   1HB   ARG 103          2HB       ARG 103  -0.543   4.941   4.941
  799   2HB   ARG 103          1HB       ARG 103  -1.710   5.486   5.486
  800   1HG   ARG 103          2HG       ARG 103  -0.433   7.666   7.666
  801   2HG   ARG 103          1HG       ARG 103   0.430   7.090   7.090
  802   1HD   ARG 103          2HD       ARG 103  -2.482   6.838   6.838
  803   2HD   ARG 103          1HD       ARG 103  -1.912   8.500   8.500
  804    HE   ARG 103           HE       ARG 103  -1.708   6.836   6.836
  805   1HH1  ARG 103          2HH1      ARG 103   0.001   9.311   9.311
  806   2HH1  ARG 103          1HH1      ARG 103   0.864   9.882   9.882
  807   1HH2  ARG 103          1HH2      ARG 103  -0.575   7.588   7.588
  808   2HH2  ARG 103          2HH2      ARG 103   0.536   8.906   8.906
  809    H    LYS 104           H        LYS 104   1.879   7.096   7.096
  810    HA   LYS 104           HA       LYS 104   3.929   5.973   5.973
  811   1HB   LYS 104          2HB       LYS 104   3.670   8.695   8.695
  812   2HB   LYS 104          1HB       LYS 104   4.997   8.212   8.212
  813   1HG   LYS 104          2HG       LYS 104   2.093   8.407   8.407
  814   2HG   LYS 104          1HG       LYS 104   3.385   9.515   9.515
  815   1HD   LYS 104          2HD       LYS 104   3.196   6.594   6.594
  816   2HD   LYS 104          1HD       LYS 104   2.862   7.958   7.958
  817   1HE   LYS 104          2HE       LYS 104   5.234   8.718   8.718
  818   2HE   LYS 104          1HE       LYS 104   5.496   7.148   7.148
  819   1HZ   LYS 104          2HZ       LYS 104   4.425   7.332   7.332
  820   2HZ   LYS 104          1HZ       LYS 104   6.089   7.432   7.432
  821   3HZ   LYS 104          3HZ       LYS 104   5.236   6.044   6.044
  822    H    ASN 105           H        ASN 105   3.296   6.589   6.589
  823    HA   ASN 105           HA       ASN 105   6.077   6.217   6.217
  824   1HB   ASN 105          2HB       ASN 105   3.546   6.948   6.948
  825   2HB   ASN 105          1HB       ASN 105   4.807   6.177   6.177
  826   1HD2  ASN 105          2HD2      ASN 105   5.017  10.048  10.048
  827   2HD2  ASN 105          1HD2      ASN 105   3.613   9.064   9.064
  828    H    ILE 106           H        ILE 106   3.015   4.442   4.442
  829    HA   ILE 106           HA       ILE 106   3.934   2.286   2.286
  830    HB   ILE 106           HB       ILE 106   1.545   2.747   2.747
  831   1HG1  ILE 106          2HG1      ILE 106   0.874   0.412   0.412
  832   2HG1  ILE 106          1HG1      ILE 106   2.444  -0.044  -0.044
  833   1HG2  ILE 106          1HG2      ILE 106   1.874   3.157   3.157
  834   2HG2  ILE 106          3HG2      ILE 106   2.058   1.416   1.416
  835   3HG2  ILE 106          2HG2      ILE 106   0.534   2.076   2.076
  836   1HD1  ILE 106          2HD1      ILE 106   2.677   1.399   1.399
  837   2HD1  ILE 106          1HD1      ILE 106   1.698  -0.061  -0.061
  838   3HD1  ILE 106          3HD1      ILE 106   3.344  -0.163  -0.163
  839    H    CYS 107           H        CYS 107   3.761   2.645   2.645
  840    HA   CYS 107           HA       CYS 107   4.872   0.149   0.149
  841   1HB   CYS 107          2HB       CYS 107   4.967   2.812   2.812
  842   2HB   CYS 107          1HB       CYS 107   5.614   1.328   1.328
  843    HG   CYS 107           HG       CYS 107   3.166   0.373   0.373
  844    H    GLN 108           H        GLN 108   6.232   3.186   3.186
  845    HA   GLN 108           HA       GLN 108   8.968   2.542   2.542
  846   1HB   GLN 108          2HB       GLN 108   8.600   4.827   4.827
  847   2HB   GLN 108          1HB       GLN 108   7.457   4.714   4.714
  848   1HG   GLN 108          2HG       GLN 108   9.150   5.664   5.664
  849   2HG   GLN 108          1HG       GLN 108   9.669   3.992   3.992
  850   1HE2  GLN 108          2HE2      GLN 108  12.463   4.282   4.282
  851   2HE2  GLN 108          1HE2      GLN 108  11.328   3.200   3.200
  852    H    PHE 109           H        PHE 109   6.718   2.155   2.155
  853    HA   PHE 109           HA       PHE 109   8.655   1.442   1.442
  854   1HB   PHE 109          2HB       PHE 109   6.472   2.348   2.348
  855   2HB   PHE 109          1HB       PHE 109   5.664   0.984   0.984
  856    HD1  PHE 109           HD2      PHE 109   8.191   1.732   1.732
  857    HD2  PHE 109           HD1      PHE 109   5.057  -0.819  -0.819
  858    HE1  PHE 109           HE2      PHE 109   8.295   0.501   0.501
  859    HE2  PHE 109           HE1      PHE 109   5.156  -2.058  -2.058
  860    HZ   PHE 109           HZ       PHE 109   6.778  -1.399  -1.399
  861    H    LEU 110           H        LEU 110   6.414  -0.331  -0.331
  862    HA   LEU 110           HA       LEU 110   6.916  -2.912  -2.912
  863   1HB   LEU 110          2HB       LEU 110   5.885  -1.726  -1.726
  864   2HB   LEU 110          1HB       LEU 110   6.363  -3.411  -3.411
  865    HG   LEU 110           HG       LEU 110   4.695  -4.047  -4.047
  866   1HD1  LEU 110          2HD1      LEU 110   4.302  -1.122  -1.122
  867   2HD1  LEU 110          1HD1      LEU 110   3.328  -2.443  -2.443
  868   3HD1  LEU 110          3HD1      LEU 110   5.039  -2.328  -2.328
  869   1HD2  LEU 110          2HD2      LEU 110   3.951  -3.261  -3.261
  870   2HD2  LEU 110          1HD2      LEU 110   2.710  -3.461  -3.461
  871   3HD2  LEU 110          3HD2      LEU 110   3.298  -1.849  -1.849
  872    H    VAL 111           H        VAL 111   8.757  -0.850  -0.850
  873    HA   VAL 111           HA       VAL 111  10.537  -3.028  -3.028
  874    HB   VAL 111           HB       VAL 111  10.647  -0.100  -0.100
  875   1HG1  VAL 111          1HG1      VAL 111  12.160  -2.503  -2.503
  876   2HG1  VAL 111          3HG1      VAL 111  12.105  -0.958  -0.958
  877   3HG1  VAL 111          2HG1      VAL 111  12.816  -1.056  -1.056
  878   1HG2  VAL 111          2HG2      VAL 111   8.888  -2.157  -2.157
  879   2HG2  VAL 111          1HG2      VAL 111   9.016  -0.497  -0.497
  880   3HG2  VAL 111          3HG2      VAL 111   9.983  -1.768  -1.768
  881    H    GLU 112           H        GLU 112  10.406  -0.291  -0.291
  882    HA   GLU 112           HA       GLU 112  13.202  -0.142  -0.142
  883   1HB   GLU 112          2HB       GLU 112  10.747   0.935   0.935
  884   2HB   GLU 112          1HB       GLU 112  12.328   1.092   1.092
  885   1HG   GLU 112          2HG       GLU 112  12.246   1.932   1.932
  886   2HG   GLU 112          1HG       GLU 112  11.217   2.878   2.878
  887    H    ILE 113           H        ILE 113  10.461  -1.703  -1.703
  888    HA   ILE 113           HA       ILE 113  12.188  -2.845  -2.845
  889    HB   ILE 113           HB       ILE 113  10.225  -3.679  -3.679
  890   1HG1  ILE 113          2HG1      ILE 113   8.795  -3.054  -3.054
  891   2HG1  ILE 113          1HG1      ILE 113   9.089  -4.649  -4.649
  892   1HG2  ILE 113          2HG2      ILE 113  10.665  -1.099  -1.099
  893   2HG2  ILE 113          1HG2      ILE 113   9.133  -1.138  -1.138
  894   3HG2  ILE 113          3HG2      ILE 113   9.213  -1.705  -1.705
  895   1HD1  ILE 113          2HD1      ILE 113   7.677  -3.017  -3.017
  896   2HD1  ILE 113          1HD1      ILE 113   6.840  -3.034  -3.034
  897   3HD1  ILE 113          3HD1      ILE 113   7.208  -4.551  -4.551
  898    H    GLY 114           H        GLY 114  10.761  -3.761  -3.761
  899   1HA   GLY 114          2HA       GLY 114  11.535  -5.607  -5.607
  900   2HA   GLY 114          1HA       GLY 114  12.057  -6.382  -6.382
  901    H    LEU 115           H        LEU 115   8.924  -4.898  -4.898
  902    HA   LEU 115           HA       LEU 115   7.617  -7.363  -7.363
  903   1HB   LEU 115          2HB       LEU 115   7.059  -4.697  -4.697
  904   2HB   LEU 115          1HB       LEU 115   5.922  -5.143  -5.143
  905    HG   LEU 115           HG       LEU 115   4.887  -6.778  -6.778
  906   1HD1  LEU 115          1HD1      LEU 115   7.318  -6.418  -6.418
  907   2HD1  LEU 115          3HD1      LEU 115   5.804  -6.901  -6.901
  908   3HD1  LEU 115          2HD1      LEU 115   6.507  -7.899  -7.899
  909   1HD2  LEU 115          1HD2      LEU 115   4.761  -4.125  -4.125
  910   2HD2  LEU 115          3HD2      LEU 115   3.763  -5.332  -5.332
  911   3HD2  LEU 115          2HD2      LEU 115   5.227  -4.730  -4.730
  912    H    ALA 116           H        ALA 116   6.823  -5.074  -5.074
  913    HA   ALA 116           HA       ALA 116   5.919  -7.310  -7.310
  914   1HB   ALA 116          1HB       ALA 116   4.671  -5.057  -5.057
  915   2HB   ALA 116          3HB       ALA 116   5.752  -4.458  -4.458
  916   3HB   ALA 116          2HB       ALA 116   4.663  -5.802  -5.802
  917    H    LYS 117           H        LYS 117   6.316  -6.240  -6.240
  918    HA   LYS 117           HA       LYS 117   9.177  -5.769  -5.769
  919   1HB   LYS 117          2HB       LYS 117   7.761  -8.251  -8.251
  920   2HB   LYS 117          1HB       LYS 117   9.016  -7.613  -7.613
  921   1HG   LYS 117          2HG       LYS 117  10.031  -7.613  -7.613
  922   2HG   LYS 117          1HG       LYS 117   9.291  -9.186  -9.186
  923   1HD   LYS 117          2HD       LYS 117  11.618  -9.255  -9.255
  924   2HD   LYS 117          1HD       LYS 117  10.605  -9.369  -9.369
  925   1HE   LYS 117          2HE       LYS 117  11.301  -7.379  -7.379
  926   2HE   LYS 117          1HE       LYS 117  11.386  -6.642  -6.642
  927   1HZ   LYS 117          3HZ       LYS 117  13.445  -7.981  -7.981
  928   2HZ   LYS 117          2HZ       LYS 117  13.394  -8.412  -8.412
  929   3HZ   LYS 117          1HZ       LYS 117  13.581  -6.790  -6.790
  930    H    ASP 118           H        ASP 118   9.775  -4.974  -4.974
  931    HA   ASP 118           HA       ASP 118   7.976  -3.170  -3.170
  932   1HB   ASP 118          2HB       ASP 118  10.334  -2.850  -2.850
  933   2HB   ASP 118          1HB       ASP 118  10.485  -4.380  -4.380
  934    H    ASP 119           H        ASP 119   8.377  -6.541  -6.541
  935    HA   ASP 119           HA       ASP 119   7.031  -6.557  -6.557
  936   1HB   ASP 119          2HB       ASP 119   7.553  -8.848  -8.848
  937   2HB   ASP 119          1HB       ASP 119   7.079  -8.989  -8.989
  938    H    GLN 120           H        GLN 120   6.144  -6.511  -6.511
  939    HA   GLN 120           HA       GLN 120   3.390  -7.283  -7.283
  940   1HB   GLN 120          2HB       GLN 120   4.540  -6.922  -6.922
  941   2HB   GLN 120          1HB       GLN 120   3.066  -7.761  -7.761
  942   1HG   GLN 120          2HG       GLN 120   4.487  -9.422  -9.422
  943   2HG   GLN 120          1HG       GLN 120   5.895  -8.639  -8.639
  944   1HE2  GLN 120          2HE2      GLN 120   4.488  -9.530  -9.530
  945   2HE2  GLN 120          1HE2      GLN 120   4.692  -8.046  -8.046
  946    H    LEU 121           H        LEU 121   5.341  -4.607  -4.607
  947    HA   LEU 121           HA       LEU 121   3.862  -2.860  -2.860
  948   1HB   LEU 121          2HB       LEU 121   5.736  -2.509  -2.509
  949   2HB   LEU 121          1HB       LEU 121   4.826  -1.115  -1.115
  950    HG   LEU 121           HG       LEU 121   6.690  -2.780  -2.780
  951   1HD1  LEU 121          2HD1      LEU 121   7.187  -0.633  -0.633
  952   2HD1  LEU 121          1HD1      LEU 121   7.457  -0.058  -0.058
  953   3HD1  LEU 121          3HD1      LEU 121   8.324  -1.477  -1.477
  954   1HD2  LEU 121          3HD2      LEU 121   4.924  -0.433  -0.433
  955   2HD2  LEU 121          2HD2      LEU 121   5.031  -1.986  -1.986
  956   3HD2  LEU 121          1HD2      LEU 121   6.346  -0.819  -0.819
  957    H    LYS 122           H        LYS 122   1.665  -3.030  -3.030
  958    HA   LYS 122           HA       LYS 122   0.597  -2.191  -2.191
  959   1HB   LYS 122          2HB       LYS 122  -0.271  -4.191  -4.191
  960   2HB   LYS 122          1HB       LYS 122  -1.561  -3.200  -3.200
  961   1HG   LYS 122          2HG       LYS 122   0.431  -4.725  -4.725
  962   2HG   LYS 122          1HG       LYS 122  -1.171  -5.324  -5.324
  963   1HD   LYS 122          2HD       LYS 122  -2.233  -3.934  -3.934
  964   2HD   LYS 122          1HD       LYS 122  -1.057  -2.636  -2.636
  965   1HE   LYS 122          2HE       LYS 122   0.324  -3.425  -3.425
  966   2HE   LYS 122          1HE       LYS 122  -0.139  -5.105  -5.105
  967   1HZ   LYS 122          1HZ       LYS 122  -2.301  -4.571  -4.571
  968   2HZ   LYS 122          3HZ       LYS 122  -1.711  -3.030  -3.030
  969   3HZ   LYS 122          2HZ       LYS 122  -0.988  -4.403  -4.403
  970    H    VAL 123           H        VAL 123   0.974   0.034   0.034
  971    HA   VAL 123           HA       VAL 123  -0.636   1.097   1.097
  972    HB   VAL 123           HB       VAL 123   1.668   1.925   1.925
  973   1HG1  VAL 123          2HG1      VAL 123   1.171   1.879   1.879
  974   2HG1  VAL 123          1HG1      VAL 123   0.993   3.599   3.599
  975   3HG1  VAL 123          3HG1      VAL 123   2.495   2.769   2.769
  976   1HG2  VAL 123          1HG2      VAL 123  -0.698   3.711   3.711
  977   2HG2  VAL 123          3HG2      VAL 123   0.510   3.498   3.498
  978   3HG2  VAL 123          2HG2      VAL 123   0.894   4.451   4.451
  979    H    HIS 124           H        HIS 124  -2.709   1.555   1.555
  980    HA   HIS 124           HA       HIS 124  -3.420   2.553   2.553
  981   1HB   HIS 124          2HB       HIS 124  -5.232   1.156   1.156
  982   2HB   HIS 124          1HB       HIS 124  -5.622   1.604   1.604
  983    HD1  HIS 124           HD1      HIS 124  -5.085  -0.068  -0.068
  984    HD2  HIS 124           HD2      HIS 124  -3.232  -0.946  -0.946
  985    HE1  HIS 124           HE1      HIS 124  -4.019  -2.322  -2.322
  986    HE2  HIS 124           HE2      HIS 124  -3.044  -2.897  -2.897
  987    H    GLY 125           H        GLY 125  -3.562   3.161   3.161
  988   1HA   GLY 125          2HA       GLY 125  -4.369   4.935   4.935
  989   2HA   GLY 125          1HA       GLY 125  -3.977   5.883   5.883
  990    H    PHE 126           HN       PHE 126  -5.596   6.837   6.837
  991    HA   PHE 126           HA       PHE 126  -8.161   5.763   5.763
  992   1HB   PHE 126          2HB       PHE 126  -9.523   6.933   6.933
  993   2HB   PHE 126          1HB       PHE 126  -8.200   6.288   6.288
  994    HD1  PHE 126           HD2      PHE 126  -6.084   8.298   8.298
  995    HD2  PHE 126           HD1      PHE 126 -10.190   8.762   8.762
  996    HE1  PHE 126           HE2      PHE 126  -5.613  10.558  10.558
  997    HE2  PHE 126           HE1      PHE 126  -9.726  11.026  11.026
  998    HZ   PHE 126           HZ       PHE 126  -7.435  11.925  11.925

  Start of MODEL   16
    1   1H    MET   1          2H        MET   1  27.228  -6.909  -6.909
    2   2H    MET   1          1H        MET   1  26.313  -7.871  -7.871
    3   3H    MET   1          3H        MET   1  27.543  -8.591  -8.591
    4    HA   MET   1           HA       MET   1  25.489  -9.141  -9.141
    5   1HB   MET   1          2HB       MET   1  24.476  -7.020  -7.020
    6   2HB   MET   1          1HB       MET   1  24.869  -6.230  -6.230
    7   1HG   MET   1          2HG       MET   1  23.584  -8.258  -8.258
    8   2HG   MET   1          1HG       MET   1  22.870  -8.358  -8.358
    9   1HE   MET   1          2HE       MET   1  21.469  -6.725  -6.725
   10   2HE   MET   1          1HE       MET   1  20.369  -5.672  -5.672
   11   3HE   MET   1          3HE       MET   1  20.338  -7.414  -7.414
   12    H    ARG   2           H        ARG   2  27.439  -9.654  -9.654
   13    HA   ARG   2           HA       ARG   2  27.541  -7.961  -7.961
   14   1HB   ARG   2          2HB       ARG   2  29.911  -8.733  -8.733
   15   2HB   ARG   2          1HB       ARG   2  29.636  -7.684  -7.684
   16   1HG   ARG   2          2HG       ARG   2  29.737  -9.516  -9.516
   17   2HG   ARG   2          1HG       ARG   2  29.721 -10.683 -10.683
   18   1HD   ARG   2          2HD       ARG   2  31.968 -10.418 -10.418
   19   2HD   ARG   2          1HD       ARG   2  31.893  -9.871  -9.871
   20    HE   ARG   2           HE       ARG   2  31.455  -7.646  -7.646
   21   1HH1  ARG   2          2HH1      ARG   2  34.015  -9.948  -9.948
   22   2HH1  ARG   2          1HH1      ARG   2  35.278  -8.827  -8.827
   23   1HH2  ARG   2          1HH2      ARG   2  33.114  -6.170  -6.170
   24   2HH2  ARG   2          2HH2      ARG   2  34.766  -6.682  -6.682
   25    H    GLY   3           H        GLY   3  25.856 -10.288 -10.288
   26   1HA   GLY   3          2HA       GLY   3  26.389 -11.755 -11.755
   27   2HA   GLY   3          1HA       GLY   3  26.599 -12.710 -12.710
   28    H    SER   4           H        SER   4  24.222 -10.168 -10.168
   29    HA   SER   4           HA       SER   4  21.954 -10.186 -10.186
   30   1HB   SER   4          2HB       SER   4  22.392 -12.584 -12.584
   31   2HB   SER   4          1HB       SER   4  20.782 -12.000 -12.000
   32    HG   SER   4           HG       SER   4  21.541 -11.105 -11.105
   33    H    HIS   5           H        HIS   5  22.273 -10.609 -10.609
   34    HA   HIS   5           HA       HIS   5  21.681 -11.628 -11.628
   35   1HB   HIS   5          2HB       HIS   5  20.024 -13.312 -13.312
   36   2HB   HIS   5          1HB       HIS   5  19.935 -13.437 -13.437
   37    HD1  HIS   5           HD1      HIS   5  17.745 -12.359 -12.359
   38    HD2  HIS   5           HD2      HIS   5  19.846 -10.190 -10.190
   39    HE1  HIS   5           HE1      HIS   5  16.383 -10.285 -10.285
   40    HE2  HIS   5           HE2      HIS   5  17.631  -9.028  -9.028
   41    H    HIS   6           H        HIS   6  21.564 -14.544 -14.544
   42    HA   HIS   6           HA       HIS   6  24.148 -15.439 -15.439
   43   1HB   HIS   6          2HB       HIS   6  21.650 -16.348 -16.348
   44   2HB   HIS   6          1HB       HIS   6  22.714 -17.650 -17.650
   45    HD1  HIS   6           HD1      HIS   6  22.346 -15.001 -15.001
   46    HD2  HIS   6           HD2      HIS   6  25.241 -17.712 -17.712
   47    HE1  HIS   6           HE1      HIS   6  24.060 -15.042 -15.042
   48    HE2  HIS   6           HE2      HIS   6  25.759 -16.753 -16.753
   49    H    HIS   7           H        HIS   7  25.070 -16.701 -16.701
   50    HA   HIS   7           HA       HIS   7  23.413 -18.298 -18.298
   51   1HB   HIS   7          2HB       HIS   7  24.982 -15.910 -15.910
   52   2HB   HIS   7          1HB       HIS   7  25.108 -17.317 -17.317
   53    HD1  HIS   7           HD1      HIS   7  22.194 -18.304 -18.304
   54    HD2  HIS   7           HD2      HIS   7  23.297 -14.329 -14.329
   55    HE1  HIS   7           HE1      HIS   7  20.232 -17.198 -17.198
   56    HE2  HIS   7           HE2      HIS   7  20.954 -14.812 -14.812
   57    H    HIS   8           H        HIS   8  24.247 -20.226 -20.226
   58    HA   HIS   8           HA       HIS   8  27.056 -20.703 -20.703
   59   1HB   HIS   8          2HB       HIS   8  26.980 -20.251 -20.251
   60   2HB   HIS   8          1HB       HIS   8  25.810 -21.552 -21.552
   61    HD1  HIS   8           HD1      HIS   8  29.384 -21.079 -21.079
   62    HD2  HIS   8           HD2      HIS   8  26.931 -23.975 -23.975
   63    HE1  HIS   8           HE1      HIS   8  30.889 -23.033 -23.033
   64    HE2  HIS   8           HE2      HIS   8  29.368 -24.804 -24.804
   65    H    HIS   9           H        HIS   9  24.443 -22.546 -22.546
   66    HA   HIS   9           HA       HIS   9  23.971 -24.165 -24.165
   67   1HB   HIS   9          2HB       HIS   9  26.186 -24.978 -24.978
   68   2HB   HIS   9          1HB       HIS   9  25.040 -25.760 -25.760
   69    HD1  HIS   9           HD1      HIS   9  24.564 -28.084 -28.084
   70    HD2  HIS   9           HD2      HIS   9  25.423 -25.698 -25.698
   71    HE1  HIS   9           HE1      HIS   9  24.446 -29.617 -29.617
   72    HE2  HIS   9           HE2      HIS   9  24.883 -28.133 -28.133
   73    H    HIS  10           H        HIS  10  22.160 -22.727 -22.727
   74    HA   HIS  10           HA       HIS  10  20.496 -24.754 -24.754
   75   1HB   HIS  10          2HB       HIS  10  21.735 -23.003 -23.003
   76   2HB   HIS  10          1HB       HIS  10  20.360 -22.005 -22.005
   77    HD1  HIS  10           HD1      HIS  10  20.156 -25.724 -25.724
   78    HD2  HIS  10           HD2      HIS  10  19.009 -22.159 -22.159
   79    HE1  HIS  10           HE1      HIS  10  18.646 -26.385 -26.385
   80    HE2  HIS  10           HE2      HIS  10  17.899 -24.208 -24.208
   81    H    THR  11           H        THR  11  19.071 -24.925 -24.925
   82    HA   THR  11           HA       THR  11  18.106 -22.728 -22.728
   83    HB   THR  11           HB       THR  11  16.364 -24.388 -24.388
   84    HG1  THR  11           HG1      THR  11  16.452 -26.437 -26.437
   85   1HG2  THR  11          2HG2      THR  11  19.210 -25.356 -25.356
   86   2HG2  THR  11          1HG2      THR  11  17.897 -25.875 -25.875
   87   3HG2  THR  11          3HG2      THR  11  18.464 -24.206 -24.206
   88    H    ASP  12           H        ASP  12  16.649 -21.253 -21.253
   89    HA   ASP  12           HA       ASP  12  14.905 -21.767 -21.767
   90   1HB   ASP  12          2HB       ASP  12  15.512 -19.118 -19.118
   91   2HB   ASP  12          1HB       ASP  12  14.680 -19.373 -19.373
   92    HA   PRO  13           HA       PRO  13  11.796 -22.136 -22.136
   93   1HB   PRO  13          2HB       PRO  13  10.046 -23.571 -23.571
   94   2HB   PRO  13          1HB       PRO  13  11.449 -24.307 -24.307
   95   1HG   PRO  13          2HG       PRO  13  11.095 -23.475 -23.475
   96   2HG   PRO  13          1HG       PRO  13  11.818 -24.958 -24.958
   97   1HD   PRO  13          2HD       PRO  13  13.302 -22.858 -22.858
   98   2HD   PRO  13          1HD       PRO  13  13.828 -23.930 -23.930
   99    H    MET  14           H        MET  14  11.947 -20.400 -20.400
  100    HA   MET  14           HA       MET  14  10.620 -18.787 -18.787
  101   1HB   MET  14          2HB       MET  14  10.647 -18.298 -18.298
  102   2HB   MET  14          1HB       MET  14   8.921 -18.464 -18.464
  103   1HG   MET  14          2HG       MET  14   8.793 -16.491 -16.491
  104   2HG   MET  14          1HG       MET  14  10.249 -16.786 -16.786
  105   1HE   MET  14          1HE       MET  14  10.321 -14.425 -14.425
  106   2HE   MET  14          3HE       MET  14  11.965 -14.180 -14.180
  107   3HE   MET  14          2HE       MET  14  10.615 -13.360 -13.360
  108    H    SER  15           H        SER  15   9.911 -21.490 -21.490
  109    HA   SER  15           HA       SER  15   8.187 -22.852 -22.852
  110   1HB   SER  15          2HB       SER  15   7.835 -20.472 -20.472
  111   2HB   SER  15          1HB       SER  15   6.285 -20.644 -20.644
  112    HG   SER  15           HG       SER  15   7.418 -22.194 -22.194
  113    H    ALA  16           H        ALA  16   8.434 -21.958 -21.958
  114    HA   ALA  16           HA       ALA  16   7.385 -22.158 -22.158
  115   1HB   ALA  16          1HB       ALA  16   5.458 -23.631 -23.631
  116   2HB   ALA  16          3HB       ALA  16   5.167 -23.425 -23.425
  117   3HB   ALA  16          2HB       ALA  16   6.611 -24.273 -24.273
  118    H    ILE  17           H        ILE  17   7.145 -19.812 -19.812
  119    HA   ILE  17           HA       ILE  17   4.503 -18.747 -18.747
  120    HB   ILE  17           HB       ILE  17   7.230 -17.615 -17.615
  121   1HG1  ILE  17          2HG1      ILE  17   4.815 -17.241 -17.241
  122   2HG1  ILE  17          1HG1      ILE  17   5.598 -18.817 -18.817
  123   1HG2  ILE  17          3HG2      ILE  17   4.827 -16.108 -16.108
  124   2HG2  ILE  17          2HG2      ILE  17   5.765 -15.464 -15.464
  125   3HG2  ILE  17          1HG2      ILE  17   6.536 -15.729 -15.729
  126   1HD1  ILE  17          1HD1      ILE  17   7.759 -17.436 -17.436
  127   2HD1  ILE  17          3HD1      ILE  17   6.614 -16.223 -16.223
  128   3HD1  ILE  17          2HD1      ILE  17   6.642 -17.826 -17.826
  129    H    GLN  18           H        GLN  18   3.459 -18.224 -18.224
  130    HA   GLN  18           HA       GLN  18   5.011 -17.209 -17.209
  131   1HB   GLN  18          2HB       GLN  18   2.346 -18.614 -18.614
  132   2HB   GLN  18          1HB       GLN  18   3.440 -18.219 -18.219
  133   1HG   GLN  18          2HG       GLN  18   5.039 -19.763 -19.763
  134   2HG   GLN  18          1HG       GLN  18   3.463 -20.481 -20.481
  135   1HE2  GLN  18          2HE2      GLN  18   3.007 -21.100 -21.100
  136   2HE2  GLN  18          1HE2      GLN  18   2.211 -20.149 -20.149
  137    H    ASN  19           H        ASN  19   2.931 -16.306 -16.306
  138    HA   ASN  19           HA       ASN  19   2.022 -13.999 -13.999
  139   1HB   ASN  19          2HB       ASN  19   2.180 -14.360 -14.360
  140   2HB   ASN  19          1HB       ASN  19   1.719 -12.879 -12.879
  141   1HD2  ASN  19          2HD2      ASN  19   5.583 -13.830 -13.830
  142   2HD2  ASN  19          1HD2      ASN  19   4.280 -14.814 -14.814
  143    H    LEU  20           H        LEU  20   0.657 -16.514 -16.514
  144    HA   LEU  20           HA       LEU  20  -1.933 -15.786 -15.786
  145   1HB   LEU  20          2HB       LEU  20  -0.500 -18.347 -18.347
  146   2HB   LEU  20          1HB       LEU  20  -2.185 -18.450 -18.450
  147    HG   LEU  20           HG       LEU  20  -1.786 -18.921 -18.921
  148   1HD1  LEU  20          3HD1      LEU  20  -3.650 -16.947 -16.947
  149   2HD1  LEU  20          2HD1      LEU  20  -3.433 -16.853 -16.853
  150   3HD1  LEU  20          1HD1      LEU  20  -3.951 -18.365 -18.365
  151   1HD2  LEU  20          2HD2      LEU  20  -0.024 -16.895 -16.895
  152   2HD2  LEU  20          1HD2      LEU  20  -0.801 -17.471 -17.471
  153   3HD2  LEU  20          3HD2      LEU  20  -1.435 -16.052 -16.052
  154    H    HIS  21           H        HIS  21  -1.254 -18.294 -18.294
  155    HA   HIS  21           HA       HIS  21  -2.136 -18.682 -18.682
  156   1HB   HIS  21          2HB       HIS  21  -0.832 -16.159 -16.159
  157   2HB   HIS  21          1HB       HIS  21  -2.276 -16.017 -16.017
  158    HD1  HIS  21           HD1      HIS  21  -1.823 -16.548 -16.548
  159    HD2  HIS  21           HD2      HIS  21   0.611 -18.740 -18.740
  160    HE1  HIS  21           HE1      HIS  21  -0.361 -17.943 -17.943
  161    HE2  HIS  21           HE2      HIS  21   1.159 -19.201 -19.201
  162    H    SER  22           H        SER  22  -4.207 -19.343 -19.343
  163    HA   SER  22           HA       SER  22  -6.468 -19.279 -19.279
  164   1HB   SER  22          2HB       SER  22  -6.457 -16.293 -16.293
  165   2HB   SER  22          1HB       SER  22  -7.488 -17.491 -17.491
  166    HG   SER  22           HG       SER  22  -5.731 -18.109 -18.109
  167    H    PHE  23           H        PHE  23  -5.514 -16.279 -16.279
  168    HA   PHE  23           HA       PHE  23  -7.635 -15.968 -15.968
  169   1HB   PHE  23          2HB       PHE  23  -5.752 -14.399 -14.399
  170   2HB   PHE  23          1HB       PHE  23  -4.723 -15.561 -15.561
  171    HD1  PHE  23           HD1      PHE  23  -8.194 -14.351 -14.351
  172    HD2  PHE  23           HD2      PHE  23  -4.219 -14.775 -14.775
  173    HE1  PHE  23           HE1      PHE  23  -8.894 -13.416 -13.416
  174    HE2  PHE  23           HE2      PHE  23  -4.910 -13.841 -13.841
  175    HZ   PHE  23           HZ       PHE  23  -7.251 -13.159 -13.159
  176    H    ASP  24           H        ASP  24  -8.457 -16.920 -16.920
  177    HA   ASP  24           HA       ASP  24  -7.243 -19.427 -19.427
  178   1HB   ASP  24          2HB       ASP  24  -9.963 -18.212 -18.212
  179   2HB   ASP  24          1HB       ASP  24  -9.430 -19.734 -19.734
  180    HA   PRO  25           HA       PRO  25  -5.438 -17.422 -17.422
  181   1HB   PRO  25          2HB       PRO  25  -5.416 -20.181 -20.181
  182   2HB   PRO  25          1HB       PRO  25  -4.084 -19.038 -19.038
  183   1HG   PRO  25          2HG       PRO  25  -4.338 -21.153 -21.153
  184   2HG   PRO  25          1HG       PRO  25  -3.754 -19.593 -19.593
  185   1HD   PRO  25          2HD       PRO  25  -6.444 -20.861 -20.861
  186   2HD   PRO  25          1HD       PRO  25  -5.514 -19.893 -19.893
  187    H    PHE  26           H        PHE  26  -7.868 -19.986 -19.986
  188    HA   PHE  26           HA       PHE  26  -9.043 -18.408 -18.408
  189   1HB   PHE  26          2HB       PHE  26  -9.723 -20.542 -20.542
  190   2HB   PHE  26          1HB       PHE  26  -7.975 -20.370 -20.370
  191    HD1  PHE  26           HD2      PHE  26  -6.836 -21.489 -21.489
  192    HD2  PHE  26           HD1      PHE  26 -10.738 -22.472 -22.472
  193    HE1  PHE  26           HE2      PHE  26  -6.691 -23.659 -23.659
  194    HE2  PHE  26           HE1      PHE  26 -10.602 -24.645 -24.645
  195    HZ   PHE  26           HZ       PHE  26  -8.576 -25.242 -25.242
  196    H    ALA  27           H        ALA  27  -9.662 -18.452 -18.452
  197    HA   ALA  27           HA       ALA  27 -11.490 -18.410 -18.410
  198   1HB   ALA  27          2HB       ALA  27 -12.687 -18.327 -18.327
  199   2HB   ALA  27          1HB       ALA  27 -13.754 -18.602 -18.602
  200   3HB   ALA  27          3HB       ALA  27 -12.763 -17.145 -17.145
  201    H    ASP  28           H        ASP  28 -11.866 -20.037 -20.037
  202    HA   ASP  28           HA       ASP  28 -13.352 -22.346 -22.346
  203   1HB   ASP  28          2HB       ASP  28 -10.707 -22.629 -22.629
  204   2HB   ASP  28          1HB       ASP  28 -10.774 -23.157 -23.157
  205    H    ALA  29           H        ALA  29 -14.296 -23.406 -23.406
  206    HA   ALA  29           HA       ALA  29 -14.552 -21.985 -21.985
  207   1HB   ALA  29          3HB       ALA  29 -15.397 -24.750 -24.750
  208   2HB   ALA  29          2HB       ALA  29 -15.753 -24.079 -24.079
  209   3HB   ALA  29          1HB       ALA  29 -16.389 -23.299 -23.299
  210    H    SER  30           H        SER  30 -13.084 -21.824 -21.824
  211    HA   SER  30           HA       SER  30 -11.501 -24.211 -24.211
  212   1HB   SER  30          2HB       SER  30 -10.374 -22.076 -22.076
  213   2HB   SER  30          1HB       SER  30 -10.302 -21.538 -21.538
  214    HG   SER  30           HG       SER  30  -8.601 -23.082 -23.082
  215    H    LYS  31           H        LYS  31 -13.665 -24.128 -24.128
  216    HA   LYS  31           HA       LYS  31 -12.953 -22.889 -22.889
  217   1HB   LYS  31          2HB       LYS  31 -15.811 -23.300 -23.300
  218   2HB   LYS  31          1HB       LYS  31 -15.168 -22.249 -22.249
  219   1HG   LYS  31          2HG       LYS  31 -14.867 -21.841 -21.841
  220   2HG   LYS  31          1HG       LYS  31 -15.974 -20.971 -20.971
  221   1HD   LYS  31          2HD       LYS  31 -13.631 -20.573 -20.573
  222   2HD   LYS  31          1HD       LYS  31 -13.070 -20.659 -20.659
  223   1HE   LYS  31          2HE       LYS  31 -15.214 -18.828 -18.828
  224   2HE   LYS  31          1HE       LYS  31 -13.573 -18.361 -18.361
  225   1HZ   LYS  31          3HZ       LYS  31 -15.042 -19.720 -19.720
  226   2HZ   LYS  31          2HZ       LYS  31 -15.688 -18.221 -18.221
  227   3HZ   LYS  31          1HZ       LYS  31 -14.084 -18.328 -18.328
  228    H    GLY  32           H        GLY  32 -12.109 -24.719 -24.719
  229   1HA   GLY  32          2HA       GLY  32 -14.052 -26.878 -26.878
  230   2HA   GLY  32          1HA       GLY  32 -12.415 -27.264 -27.264
  231    H    ASP  33           H        ASP  33 -13.434 -24.742 -24.742
  232    HA   ASP  33           HA       ASP  33 -12.898 -24.345 -24.345
  233   1HB   ASP  33          2HB       ASP  33 -14.198 -26.538 -26.538
  234   2HB   ASP  33          1HB       ASP  33 -12.632 -27.331 -27.331
  235    H    ASP  34           H        ASP  34 -10.815 -23.828 -23.828
  236    HA   ASP  34           HA       ASP  34  -8.566 -24.749 -24.749
  237   1HB   ASP  34          2HB       ASP  34  -8.978 -25.962 -25.962
  238   2HB   ASP  34          1HB       ASP  34  -7.968 -24.607 -24.607
  239    H    LEU  35           H        LEU  35  -9.945 -22.282 -22.282
  240    HA   LEU  35           HA       LEU  35  -7.982 -20.477 -20.477
  241   1HB   LEU  35          2HB       LEU  35 -10.500 -20.340 -20.340
  242   2HB   LEU  35          1HB       LEU  35 -10.670 -19.630 -19.630
  243    HG   LEU  35           HG       LEU  35  -9.237 -17.778 -17.778
  244   1HD1  LEU  35          1HD1      LEU  35  -8.672 -19.492 -19.492
  245   2HD1  LEU  35          3HD1      LEU  35  -8.741 -17.749 -17.749
  246   3HD1  LEU  35          2HD1      LEU  35  -7.607 -18.417 -18.417
  247   1HD2  LEU  35          1HD2      LEU  35 -11.719 -18.408 -18.408
  248   2HD2  LEU  35          3HD2      LEU  35 -11.136 -16.863 -16.863
  249   3HD2  LEU  35          2HD2      LEU  35 -10.714 -17.373 -17.373
  250    H    LEU  36           H        LEU  36  -6.696 -21.213 -21.213
  251    HA   LEU  36           HA       LEU  36  -7.428 -19.654 -19.654
  252   1HB   LEU  36          2HB       LEU  36  -5.950 -22.180 -22.180
  253   2HB   LEU  36          1HB       LEU  36  -5.335 -21.137 -21.137
  254    HG   LEU  36           HG       LEU  36  -6.874 -22.837 -22.837
  255   1HD1  LEU  36          2HD1      LEU  36  -7.891 -20.004 -20.004
  256   2HD1  LEU  36          1HD1      LEU  36  -8.365 -21.311 -21.311
  257   3HD1  LEU  36          3HD1      LEU  36  -6.691 -20.759 -20.759
  258   1HD2  LEU  36          1HD2      LEU  36  -8.278 -22.599 -22.599
  259   2HD2  LEU  36          3HD2      LEU  36  -8.997 -23.173 -23.173
  260   3HD2  LEU  36          2HD2      LEU  36  -9.212 -21.495 -21.495
  261    HA   PRO  37           HA       PRO  37  -4.318 -16.598 -16.598
  262   1HB   PRO  37          2HB       PRO  37  -3.497 -17.166 -17.166
  263   2HB   PRO  37          1HB       PRO  37  -3.929 -15.629 -15.629
  264   1HG   PRO  37          2HG       PRO  37  -5.630 -16.859 -16.859
  265   2HG   PRO  37          1HG       PRO  37  -6.208 -16.031 -16.031
  266   1HD   PRO  37          2HD       PRO  37  -5.868 -18.952 -18.952
  267   2HD   PRO  37          1HD       PRO  37  -7.116 -18.108 -18.108
  268    H    ALA  38           H        ALA  38  -2.132 -16.402 -16.402
  269    HA   ALA  38           HA       ALA  38  -0.231 -18.367 -18.367
  270   1HB   ALA  38          1HB       ALA  38  -1.345 -19.584 -19.584
  271   2HB   ALA  38          3HB       ALA  38  -0.926 -18.282 -18.282
  272   3HB   ALA  38          2HB       ALA  38   0.347 -19.247 -19.247
  273    H    GLY  39           H        GLY  39   0.701 -16.391 -16.391
  274   1HA   GLY  39          2HA       GLY  39   2.842 -15.301 -15.301
  275   2HA   GLY  39          1HA       GLY  39   2.049 -14.840 -14.840
  276    H    THR  40           H        THR  40   0.989 -14.696 -14.696
  277    HA   THR  40           HA       THR  40   0.350 -11.860 -11.860
  278    HB   THR  40           HB       THR  40  -0.753 -12.696 -12.696
  279    HG1  THR  40           HG1      THR  40  -0.478 -14.846 -14.846
  280   1HG2  THR  40          2HG2      THR  40  -1.754 -11.174 -11.174
  281   2HG2  THR  40          1HG2      THR  40  -2.216 -12.618 -12.618
  282   3HG2  THR  40          3HG2      THR  40  -2.861 -12.346 -12.346
  283    H    GLU  41           H        GLU  41   2.230 -14.058 -14.058
  284    HA   GLU  41           HA       GLU  41   3.919 -13.725 -13.725
  285   1HB   GLU  41          2HB       GLU  41   3.758 -10.828 -10.828
  286   2HB   GLU  41          1HB       GLU  41   5.100 -11.602 -11.602
  287   1HG   GLU  41          2HG       GLU  41   5.954 -12.409 -12.409
  288   2HG   GLU  41          1HG       GLU  41   4.378 -12.916 -12.916
  289    H    ASP  42           H        ASP  42   0.907 -12.883 -12.883
  290    HA   ASP  42           HA       ASP  42  -0.339 -12.209 -12.209
  291   1HB   ASP  42          2HB       ASP  42   2.123 -13.375 -13.375
  292   2HB   ASP  42          1HB       ASP  42   1.094 -12.440 -12.440
  293    H    TYR  43           H        TYR  43   0.200 -10.057 -10.057
  294    HA   TYR  43           HA       TYR  43   1.933  -8.169  -8.169
  295   1HB   TYR  43          2HB       TYR  43  -0.740  -7.780  -7.780
  296   2HB   TYR  43          1HB       TYR  43   0.382  -6.472  -6.472
  297    HD1  TYR  43           HD2      TYR  43   2.679  -8.794  -8.794
  298    HD2  TYR  43           HD1      TYR  43  -0.511  -6.806  -6.806
  299    HE1  TYR  43           HE2      TYR  43   3.794  -9.177  -9.177
  300    HE2  TYR  43           HE1      TYR  43   0.603  -7.186  -7.186
  301    HH   TYR  43           HH       TYR  43   3.517  -7.710  -7.710
  302    H    ILE  44           H        ILE  44   1.367  -6.192  -6.192
  303    HA   ILE  44           HA       ILE  44  -0.531  -6.791  -6.791
  304    HB   ILE  44           HB       ILE  44   2.015  -5.168  -5.168
  305   1HG1  ILE  44          2HG1      ILE  44   2.463  -7.549  -7.549
  306   2HG1  ILE  44          1HG1      ILE  44   2.727  -6.944  -6.944
  307   1HG2  ILE  44          2HG2      ILE  44  -0.058  -5.744  -5.744
  308   2HG2  ILE  44          1HG2      ILE  44   1.530  -5.044  -5.044
  309   3HG2  ILE  44          3HG2      ILE  44   0.364  -4.169  -4.169
  310   1HD1  ILE  44          2HD1      ILE  44   0.252  -7.702  -7.702
  311   2HD1  ILE  44          1HD1      ILE  44   0.599  -8.737  -8.737
  312   3HD1  ILE  44          3HD1      ILE  44   1.576  -8.864  -8.864
  313    H    HIS  45           H        HIS  45  -2.325  -5.727  -5.727
  314    HA   HIS  45           HA       HIS  45  -2.349  -3.222  -3.222
  315   1HB   HIS  45          2HB       HIS  45  -4.221  -5.249  -5.249
  316   2HB   HIS  45          1HB       HIS  45  -4.849  -3.709  -3.709
  317    HD1  HIS  45           HD1      HIS  45  -3.802  -5.453  -5.453
  318    HD2  HIS  45           HD2      HIS  45  -5.814  -2.027  -2.027
  319    HE1  HIS  45           HE1      HIS  45  -4.839  -4.509  -4.509
  320    HE2  HIS  45           HE2      HIS  45  -6.082  -2.454  -2.454
  321    H    ILE  46           H        ILE  46  -2.337  -1.236  -1.236
  322    HA   ILE  46           HA       ILE  46  -2.292  -0.807  -0.807
  323    HB   ILE  46           HB       ILE  46  -1.723   1.145   1.145
  324   1HG1  ILE  46          2HG1      ILE  46  -0.130  -0.788  -0.788
  325   2HG1  ILE  46          1HG1      ILE  46   0.604   0.796   0.796
  326   1HG2  ILE  46          2HG2      ILE  46  -1.416   1.385   1.385
  327   2HG2  ILE  46          1HG2      ILE  46  -0.680   2.493   2.493
  328   3HG2  ILE  46          3HG2      ILE  46  -2.435   2.359   2.359
  329   1HD1  ILE  46          1HD1      ILE  46   0.107   0.265   0.265
  330   2HD1  ILE  46          3HD1      ILE  46   0.165  -1.394  -1.394
  331   3HD1  ILE  46          2HD1      ILE  46   1.556  -0.329  -0.329
  332    H    ARG  47           H        ARG  47  -3.434   1.783   1.783
  333    HA   ARG  47           HA       ARG  47  -5.520   2.621   2.621
  334   1HB   ARG  47          2HB       ARG  47  -6.291   0.163   0.163
  335   2HB   ARG  47          1HB       ARG  47  -6.797   0.683   0.683
  336   1HG   ARG  47          2HG       ARG  47  -8.575   1.789   1.789
  337   2HG   ARG  47          1HG       ARG  47  -7.687   2.440   2.440
  338   1HD   ARG  47          2HD       ARG  47  -7.909   0.318   0.318
  339   2HD   ARG  47          1HD       ARG  47  -8.741  -0.378  -0.378
  340    HE   ARG  47           HE       ARG  47 -10.663   0.604   0.604
  341   1HH1  ARG  47          2HH1      ARG  47  -7.962   2.264   2.264
  342   2HH1  ARG  47          1HH1      ARG  47  -8.958   3.262   3.262
  343   1HH2  ARG  47          1HH2      ARG  47 -11.974   1.916   1.916
  344   2HH2  ARG  47          2HH2      ARG  47 -11.236   3.065   3.065
  345    H    ILE  48           H        ILE  48  -6.401   4.366   4.366
  346    HA   ILE  48           HA       ILE  48  -6.083   4.835   4.835
  347    HB   ILE  48           HB       ILE  48  -5.788   6.685   6.685
  348   1HG1  ILE  48          2HG1      ILE  48  -4.156   6.226   6.226
  349   2HG1  ILE  48          1HG1      ILE  48  -3.779   5.618   5.618
  350   1HG2  ILE  48          2HG2      ILE  48  -6.449   7.500   7.500
  351   2HG2  ILE  48          1HG2      ILE  48  -5.763   8.589   8.589
  352   3HG2  ILE  48          3HG2      ILE  48  -7.351   7.871   7.871
  353   1HD1  ILE  48          2HD1      ILE  48  -4.036   8.549   8.549
  354   2HD1  ILE  48          1HD1      ILE  48  -2.522   7.669   7.669
  355   3HD1  ILE  48          3HD1      ILE  48  -3.270   7.760   7.760
  356    H    GLN  49           H        GLN  49  -7.736   6.118   6.118
  357    HA   GLN  49           HA       GLN  49 -10.261   6.358   6.358
  358   1HB   GLN  49          2HB       GLN  49 -11.265   5.547   5.547
  359   2HB   GLN  49          1HB       GLN  49 -10.922   4.439   4.439
  360   1HG   GLN  49          2HG       GLN  49  -8.713   3.982   3.982
  361   2HG   GLN  49          1HG       GLN  49  -9.197   4.981   4.981
  362   1HE2  GLN  49          2HE2      GLN  49 -11.718   2.633   2.633
  363   2HE2  GLN  49          1HE2      GLN  49 -11.516   4.324   4.324
  364    H    GLN  50           H        GLN  50 -10.151   8.566   8.566
  365    HA   GLN  50           HA       GLN  50  -9.770   9.964   9.964
  366   1HB   GLN  50          2HB       GLN  50  -8.957  10.540  10.540
  367   2HB   GLN  50          1HB       GLN  50 -10.369  11.575  11.575
  368   1HG   GLN  50          2HG       GLN  50  -9.417  12.594  12.594
  369   2HG   GLN  50          1HG       GLN  50  -8.034  11.505  11.505
  370   1HE2  GLN  50          2HE2      GLN  50  -6.297  13.933  13.933
  371   2HE2  GLN  50          1HE2      GLN  50  -6.405  12.861  12.861
  372    H    ARG  51           H        ARG  51 -11.452  10.405  10.405
  373    HA   ARG  51           HA       ARG  51 -14.125  10.525  10.525
  374   1HB   ARG  51          2HB       ARG  51 -13.477  10.660  10.660
  375   2HB   ARG  51          1HB       ARG  51 -14.987  10.178  10.178
  376   1HG   ARG  51          2HG       ARG  51 -12.400   8.637   8.637
  377   2HG   ARG  51          1HG       ARG  51 -13.818   8.260   8.260
  378   1HD   ARG  51          2HD       ARG  51 -14.347   8.559   8.559
  379   2HD   ARG  51          1HD       ARG  51 -13.301   7.205   7.205
  380    HE   ARG  51           HE       ARG  51 -16.111   7.471   7.471
  381   1HH1  ARG  51          2HH1      ARG  51 -13.139   5.889   5.889
  382   2HH1  ARG  51          1HH1      ARG  51 -13.938   4.539   4.539
  383   1HH2  ARG  51          1HH2      ARG  51 -17.164   5.697   5.697
  384   2HH2  ARG  51          2HH2      ARG  51 -16.223   4.430   4.430
  385    H    ASN  52           H        ASN  52 -15.114  12.396  12.396
  386    HA   ASN  52           HA       ASN  52 -15.661  14.602  14.602
  387   1HB   ASN  52          2HB       ASN  52 -14.168  14.779  14.779
  388   2HB   ASN  52          1HB       ASN  52 -15.451  15.838  15.838
  389   1HD2  ASN  52          2HD2      ASN  52 -16.306  12.526  12.526
  390   2HD2  ASN  52          1HD2      ASN  52 -14.699  13.104  13.104
  391    H    GLY  53           H        GLY  53 -13.007  13.538  13.538
  392   1HA   GLY  53          2HA       GLY  53 -11.178  14.405  14.405
  393   2HA   GLY  53          1HA       GLY  53 -11.945  15.978  15.978
  394    H    ARG  54           H        ARG  54 -10.809  13.754  13.754
  395    HA   ARG  54           HA       ARG  54  -8.462  15.253  15.253
  396   1HB   ARG  54          2HB       ARG  54  -9.087  16.292  16.292
  397   2HB   ARG  54          1HB       ARG  54 -10.215  16.819  16.819
  398   1HG   ARG  54          2HG       ARG  54 -11.784  15.032  15.032
  399   2HG   ARG  54          1HG       ARG  54 -10.688  14.827  14.827
  400   1HD   ARG  54          2HD       ARG  54 -12.304  17.244  17.244
  401   2HD   ARG  54          1HD       ARG  54 -12.360  16.315  16.315
  402    HE   ARG  54           HE       ARG  54  -9.832  17.250  17.250
  403   1HH1  ARG  54          2HH1      ARG  54 -12.928  18.807  18.807
  404   2HH1  ARG  54          1HH1      ARG  54 -12.396  20.318  20.318
  405   1HH2  ARG  54          1HH2      ARG  54  -9.132  19.237  19.237
  406   2HH2  ARG  54          2HH2      ARG  54 -10.241  20.563  20.563
  407    H    LYS  55           H        LYS  55 -10.948  13.147  13.147
  408    HA   LYS  55           HA       LYS  55  -9.161  11.868  11.868
  409   1HB   LYS  55          2HB       LYS  55 -11.864  11.962  11.962
  410   2HB   LYS  55          1HB       LYS  55 -11.543  10.363  10.363
  411   1HG   LYS  55          2HG       LYS  55 -11.976  10.112  10.112
  412   2HG   LYS  55          1HG       LYS  55 -10.245   9.866   9.866
  413   1HD   LYS  55          2HD       LYS  55 -10.231  12.493  12.493
  414   2HD   LYS  55          1HD       LYS  55 -11.689  12.060  12.060
  415   1HE   LYS  55          2HE       LYS  55 -10.189  10.170  10.170
  416   2HE   LYS  55          1HE       LYS  55  -8.861  11.195  11.195
  417   1HZ   LYS  55          1HZ       LYS  55 -10.110  13.025  13.025
  418   2HZ   LYS  55          3HZ       LYS  55 -10.913  11.753  11.753
  419   3HZ   LYS  55          2HZ       LYS  55  -9.231  11.887  11.887
  420    H    THR  56           H        THR  56  -7.526  11.656  11.656
  421    HA   THR  56           HA       THR  56  -7.919   9.546   9.546
  422    HB   THR  56           HB       THR  56  -5.145  10.274  10.274
  423    HG1  THR  56           HG1      THR  56  -5.763  12.278  12.278
  424   1HG2  THR  56          1HG2      THR  56  -6.835   9.865   9.865
  425   2HG2  THR  56          3HG2      THR  56  -5.619  11.131  11.131
  426   3HG2  THR  56          2HG2      THR  56  -5.132   9.490   9.490
  427    H    LEU  57           H        LEU  57  -7.381   7.448   7.448
  428    HA   LEU  57           HA       LEU  57  -5.774   6.486   6.486
  429   1HB   LEU  57          2HB       LEU  57  -8.647   6.058   6.058
  430   2HB   LEU  57          1HB       LEU  57  -7.743   4.572   4.572
  431    HG   LEU  57           HG       LEU  57  -7.353   6.846   6.846
  432   1HD1  LEU  57          3HD1      LEU  57  -9.782   5.244   5.244
  433   2HD1  LEU  57          2HD1      LEU  57  -9.151   5.271   5.271
  434   3HD1  LEU  57          1HD1      LEU  57  -9.545   6.783   6.783
  435   1HD2  LEU  57          1HD2      LEU  57  -6.512   4.106   4.106
  436   2HD2  LEU  57          3HD2      LEU  57  -5.980   5.345   5.345
  437   3HD2  LEU  57          2HD2      LEU  57  -7.387   4.352   4.352
  438    H    THR  58           H        THR  58  -4.159   5.461   5.461
  439    HA   THR  58           HA       THR  58  -4.629   4.098   4.098
  440    HB   THR  58           HB       THR  58  -2.018   4.291   4.291
  441    HG1  THR  58           HG1      THR  58  -3.023   6.380   6.380
  442   1HG2  THR  58          3HG2      THR  58  -2.763   3.199   3.199
  443   2HG2  THR  58          2HG2      THR  58  -1.696   4.582   4.582
  444   3HG2  THR  58          1HG2      THR  58  -1.179   3.242   3.242
  445    H    THR  59           H        THR  59  -5.174   2.019   2.019
  446    HA   THR  59           HA       THR  59  -4.547   0.334   0.334
  447    HB   THR  59           HB       THR  59  -6.172  -1.203  -1.203
  448    HG1  THR  59           HG1      THR  59  -6.486   0.524   0.524
  449   1HG2  THR  59          3HG2      THR  59  -6.550   0.475   0.475
  450   2HG2  THR  59          2HG2      THR  59  -8.026   0.198   0.198
  451   3HG2  THR  59          1HG2      THR  59  -7.091  -1.172  -1.172
  452    H    VAL  60           H        VAL  60  -3.949  -1.929  -1.929
  453    HA   VAL  60           HA       VAL  60  -2.387  -2.270  -2.270
  454    HB   VAL  60           HB       VAL  60  -1.482  -3.130  -3.130
  455   1HG1  VAL  60          2HG1      VAL  60  -0.802  -4.505  -4.505
  456   2HG1  VAL  60          1HG1      VAL  60   0.159  -3.102  -3.102
  457   3HG1  VAL  60          3HG1      VAL  60   0.488  -3.930  -3.930
  458   1HG2  VAL  60          3HG2      VAL  60  -0.924  -0.715  -0.715
  459   2HG2  VAL  60          2HG2      VAL  60  -1.103  -0.877  -0.877
  460   3HG2  VAL  60          1HG2      VAL  60   0.386  -1.402  -1.402
  461    H    GLN  61           H        GLN  61  -3.121  -3.953  -3.953
  462    HA   GLN  61           HA       GLN  61  -4.213  -6.243  -6.243
  463   1HB   GLN  61          2HB       GLN  61  -5.041  -6.232  -6.232
  464   2HB   GLN  61          1HB       GLN  61  -6.027  -6.254  -6.254
  465   1HG   GLN  61          2HG       GLN  61  -5.743  -3.771  -3.771
  466   2HG   GLN  61          1HG       GLN  61  -4.973  -3.852  -3.852
  467   1HE2  GLN  61          2HE2      GLN  61  -8.223  -5.248  -5.248
  468   2HE2  GLN  61          1HE2      GLN  61  -6.682  -5.965  -5.965
  469    H    GLY  62           H        GLY  62  -3.581  -8.296  -8.296
  470   1HA   GLY  62          2HA       GLY  62  -2.558  -9.794  -9.794
  471   2HA   GLY  62          1HA       GLY  62  -1.475  -8.473  -8.473
  472    H    ILE  63           H        ILE  63  -1.126  -7.709  -7.709
  473    HA   ILE  63           HA       ILE  63   1.202  -9.128  -9.128
  474    HB   ILE  63           HB       ILE  63  -0.556  -7.458  -7.458
  475   1HG1  ILE  63          2HG1      ILE  63   0.322  -6.033  -6.033
  476   2HG1  ILE  63          1HG1      ILE  63   1.479  -5.881  -5.881
  477   1HG2  ILE  63          3HG2      ILE  63   1.772  -9.075  -9.075
  478   2HG2  ILE  63          2HG2      ILE  63   1.957  -7.382  -7.382
  479   3HG2  ILE  63          1HG2      ILE  63   0.591  -8.315  -8.315
  480   1HD1  ILE  63          3HD1      ILE  63   2.852  -7.634  -7.634
  481   2HD1  ILE  63          2HD1      ILE  63   1.774  -7.387  -7.387
  482   3HD1  ILE  63          1HD1      ILE  63   2.746  -6.048  -6.048
  483    H    ALA  64           H        ALA  64   1.706 -10.749 -10.749
  484    HA   ALA  64           HA       ALA  64  -0.380 -12.675 -12.675
  485   1HB   ALA  64          1HB       ALA  64   2.094 -13.076 -13.076
  486   2HB   ALA  64          3HB       ALA  64   2.401 -12.988 -12.988
  487   3HB   ALA  64          2HB       ALA  64   1.298 -14.206 -14.206
  488    H    ASP  65           H        ASP  65  -1.299 -13.263 -13.263
  489    HA   ASP  65           HA       ASP  65  -1.308 -11.447 -11.447
  490   1HB   ASP  65          2HB       ASP  65  -2.245 -14.319 -14.319
  491   2HB   ASP  65          1HB       ASP  65  -2.803 -12.979 -12.979
  492    H    ASP  66           H        ASP  66   0.793 -14.009 -14.009
  493    HA   ASP  66           HA       ASP  66   1.598 -14.795 -14.795
  494   1HB   ASP  66          2HB       ASP  66   2.023 -15.813 -15.813
  495   2HB   ASP  66          1HB       ASP  66   3.560 -14.990 -14.990
  496    H    TYR  67           H        TYR  67   2.424 -12.145 -12.145
  497    HA   TYR  67           HA       TYR  67   4.924 -11.382 -11.382
  498   1HB   TYR  67          2HB       TYR  67   2.487  -9.707  -9.707
  499   2HB   TYR  67          1HB       TYR  67   4.070  -9.000  -9.000
  500    HD1  TYR  67           HD1      TYR  67   4.133 -12.176 -12.176
  501    HD2  TYR  67           HD2      TYR  67   3.732  -7.977  -7.977
  502    HE1  TYR  67           HE1      TYR  67   4.681 -12.434 -12.434
  503    HE2  TYR  67           HE2      TYR  67   4.275  -8.218  -8.218
  504    HH   TYR  67           HH       TYR  67   5.560  -9.915  -9.915
  505    H    ASP  68           H        ASP  68   5.520  -9.553  -9.553
  506    HA   ASP  68           HA       ASP  68   4.519 -10.124 -10.124
  507   1HB   ASP  68          2HB       ASP  68   6.665  -8.213  -8.213
  508   2HB   ASP  68          1HB       ASP  68   6.295  -8.545  -8.545
  509    H    LYS  69           H        LYS  69   2.341  -9.311  -9.311
  510    HA   LYS  69           HA       LYS  69   1.494  -6.890  -6.890
  511   1HB   LYS  69          2HB       LYS  69   0.088  -8.816  -8.816
  512   2HB   LYS  69          1HB       LYS  69   0.364  -8.227  -8.227
  513   1HG   LYS  69          2HG       LYS  69  -0.863  -6.271  -6.271
  514   2HG   LYS  69          1HG       LYS  69  -0.809  -6.469  -6.469
  515   1HD   LYS  69          2HD       LYS  69  -3.021  -7.018  -7.018
  516   2HD   LYS  69          1HD       LYS  69  -2.252  -8.431  -8.431
  517   1HE   LYS  69          2HE       LYS  69  -1.723  -9.344  -9.344
  518   2HE   LYS  69          1HE       LYS  69  -2.120  -7.838  -7.838
  519   1HZ   LYS  69          3HZ       LYS  69  -4.073  -9.557  -9.557
  520   2HZ   LYS  69          2HZ       LYS  69  -3.855  -9.528  -9.528
  521   3HZ   LYS  69          1HZ       LYS  69  -4.429  -8.154  -8.154
  522    H    LYS  70           H        LYS  70   2.608  -7.615  -7.615
  523    HA   LYS  70           HA       LYS  70   2.122  -5.134  -5.134
  524   1HB   LYS  70          2HB       LYS  70   4.494  -6.896  -6.896
  525   2HB   LYS  70          1HB       LYS  70   3.709  -5.746  -5.746
  526   1HG   LYS  70          2HG       LYS  70   2.581  -8.343  -8.343
  527   2HG   LYS  70          1HG       LYS  70   3.063  -7.959  -7.959
  528   1HD   LYS  70          2HD       LYS  70   1.307  -6.187  -6.187
  529   2HD   LYS  70          1HD       LYS  70   0.774  -6.760  -6.760
  530   1HE   LYS  70          2HE       LYS  70  -0.565  -8.167  -8.167
  531   2HE   LYS  70          1HE       LYS  70   0.890  -9.060  -9.060
  532   1HZ   LYS  70          3HZ       LYS  70  -0.065  -6.778  -6.778
  533   2HZ   LYS  70          2HZ       LYS  70  -0.676  -8.337  -8.337
  534   3HZ   LYS  70          1HZ       LYS  70   0.973  -8.034  -8.034
  535    H    LYS  71           H        LYS  71   5.162  -6.299  -6.299
  536    HA   LYS  71           HA       LYS  71   6.299  -3.646  -3.646
  537   1HB   LYS  71          2HB       LYS  71   7.349  -6.205  -6.205
  538   2HB   LYS  71          1HB       LYS  71   7.716  -5.611  -5.611
  539   1HG   LYS  71          2HG       LYS  71   9.578  -5.044  -5.044
  540   2HG   LYS  71          1HG       LYS  71   8.658  -3.545  -3.545
  541   1HD   LYS  71          2HD       LYS  71   8.944  -3.460  -3.460
  542   2HD   LYS  71          1HD       LYS  71   7.583  -4.582  -4.582
  543   1HE   LYS  71          2HE       LYS  71   9.474  -6.382  -6.382
  544   2HE   LYS  71          1HE       LYS  71  10.488  -5.109  -5.109
  545   1HZ   LYS  71          1HZ       LYS  71   8.496  -5.022  -5.022
  546   2HZ   LYS  71          3HZ       LYS  71   8.350  -6.645  -6.645
  547   3HZ   LYS  71          2HZ       LYS  71   9.803  -6.078  -6.078
  548    H    LEU  72           H        LEU  72   4.136  -5.123  -5.123
  549    HA   LEU  72           HA       LEU  72   5.123  -4.298  -4.298
  550   1HB   LEU  72          2HB       LEU  72   3.342  -6.086  -6.086
  551   2HB   LEU  72          1HB       LEU  72   2.222  -4.740  -4.740
  552    HG   LEU  72           HG       LEU  72   3.840  -5.582  -5.582
  553   1HD1  LEU  72          2HD1      LEU  72   1.151  -6.225  -6.225
  554   2HD1  LEU  72          1HD1      LEU  72   1.228  -5.726  -5.726
  555   3HD1  LEU  72          3HD1      LEU  72   2.190  -7.095  -7.095
  556   1HD2  LEU  72          3HD2      LEU  72   1.986  -3.271  -3.271
  557   2HD2  LEU  72          2HD2      LEU  72   3.617  -3.254  -3.254
  558   3HD2  LEU  72          1HD2      LEU  72   2.280  -3.900  -3.900
  559    H    VAL  73           H        VAL  73   2.310  -3.103  -3.103
  560    HA   VAL  73           HA       VAL  73   2.340  -0.621  -0.621
  561    HB   VAL  73           HB       VAL  73   0.229  -1.775  -1.775
  562   1HG1  VAL  73          2HG1      VAL  73   1.025  -2.388  -2.388
  563   2HG1  VAL  73          1HG1      VAL  73   0.870  -0.693  -0.693
  564   3HG1  VAL  73          3HG1      VAL  73  -0.557  -1.609  -1.609
  565   1HG2  VAL  73          2HG2      VAL  73   0.712   0.844   0.844
  566   2HG2  VAL  73          1HG2      VAL  73  -0.892   0.181   0.181
  567   3HG2  VAL  73          3HG2      VAL  73   0.051   0.876   0.876
  568    H    LYS  74           H        LYS  74   3.191  -1.713  -1.713
  569    HA   LYS  74           HA       LYS  74   3.435   0.710   0.710
  570   1HB   LYS  74          2HB       LYS  74   3.695  -1.481  -1.481
  571   2HB   LYS  74          1HB       LYS  74   5.234  -1.705  -1.705
  572   1HG   LYS  74          2HG       LYS  74   6.263  -0.696  -0.696
  573   2HG   LYS  74          1HG       LYS  74   5.357   0.780   0.780
  574   1HD   LYS  74          2HD       LYS  74   3.521  -0.051  -0.051
  575   2HD   LYS  74          1HD       LYS  74   4.485  -1.482  -1.482
  576   1HE   LYS  74          2HE       LYS  74   5.947  -0.317  -0.317
  577   2HE   LYS  74          1HE       LYS  74   5.690   1.199   1.199
  578   1HZ   LYS  74          1HZ       LYS  74   3.495   0.035   0.035
  579   2HZ   LYS  74          3HZ       LYS  74   4.725   0.886   0.886
  580   3HZ   LYS  74          2HZ       LYS  74   3.790   1.653   1.653
  581    H    ALA  75           H        ALA  75   5.779  -0.923  -0.923
  582    HA   ALA  75           HA       ALA  75   7.882   0.921   0.921
  583   1HB   ALA  75          3HB       ALA  75   7.266  -1.286  -1.286
  584   2HB   ALA  75          2HB       ALA  75   8.359  -0.056  -0.056
  585   3HB   ALA  75          1HB       ALA  75   8.757  -0.906  -0.906
  586    H    PHE  76           H        PHE  76   5.071   0.893   0.893
  587    HA   PHE  76           HA       PHE  76   5.861   2.834   2.834
  588   1HB   PHE  76          2HB       PHE  76   3.722   1.321   1.321
  589   2HB   PHE  76          1HB       PHE  76   3.023   2.692   2.692
  590    HD1  PHE  76           HD1      PHE  76   4.337   1.494   1.494
  591    HD2  PHE  76           HD2      PHE  76   2.602   4.784   4.784
  592    HE1  PHE  76           HE1      PHE  76   3.897   2.605   2.605
  593    HE2  PHE  76           HE2      PHE  76   2.160   5.902   5.902
  594    HZ   PHE  76           HZ       PHE  76   2.807   4.813   4.813
  595    H    LYS  77           H        LYS  77   4.308   3.142   3.142
  596    HA   LYS  77           HA       LYS  77   4.049   5.981   5.981
  597   1HB   LYS  77          2HB       LYS  77   4.033   4.198   4.198
  598   2HB   LYS  77          1HB       LYS  77   3.423   5.844   5.844
  599   1HG   LYS  77          2HG       LYS  77   1.433   5.010   5.010
  600   2HG   LYS  77          1HG       LYS  77   2.097   4.450   4.450
  601   1HD   LYS  77          2HD       LYS  77   1.311   2.471   2.471
  602   2HD   LYS  77          1HD       LYS  77   2.953   2.449   2.449
  603   1HE   LYS  77          2HE       LYS  77   0.960   3.815   3.815
  604   2HE   LYS  77          1HE       LYS  77   0.712   2.080   2.080
  605   1HZ   LYS  77          1HZ       LYS  77   3.424   2.945   2.945
  606   2HZ   LYS  77          3HZ       LYS  77   2.289   3.105   3.105
  607   3HZ   LYS  77          2HZ       LYS  77   2.570   1.591   1.591
  608    H    LYS  78           H        LYS  78   6.722   4.000   4.000
  609    HA   LYS  78           HA       LYS  78   8.162   5.988   5.988
  610   1HB   LYS  78          2HB       LYS  78   8.176   3.517   3.517
  611   2HB   LYS  78          1HB       LYS  78   9.165   3.265   3.265
  612   1HG   LYS  78          2HG       LYS  78  10.821   4.861   4.861
  613   2HG   LYS  78          1HG       LYS  78   9.849   4.957   4.957
  614   1HD   LYS  78          2HD       LYS  78  11.070   3.239   3.239
  615   2HD   LYS  78          1HD       LYS  78  10.148   2.242   2.242
  616   1HE   LYS  78          2HE       LYS  78  12.562   3.706   3.706
  617   2HE   LYS  78          1HE       LYS  78  12.767   2.224   2.224
  618   1HZ   LYS  78          2HZ       LYS  78  10.885   2.191   2.191
  619   2HZ   LYS  78          1HZ       LYS  78  12.539   2.178   2.178
  620   3HZ   LYS  78          3HZ       LYS  78  11.868   0.953   0.953
  621    H    LYS  79           H        LYS  79   7.817   4.774   4.774
  622    HA   LYS  79           HA       LYS  79  10.389   5.863   5.863
  623   1HB   LYS  79          2HB       LYS  79   9.327   3.583   3.583
  624   2HB   LYS  79          1HB       LYS  79   8.424   4.593   4.593
  625   1HG   LYS  79          2HG       LYS  79  11.129   5.377   5.377
  626   2HG   LYS  79          1HG       LYS  79  11.089   3.613   3.613
  627   1HD   LYS  79          2HD       LYS  79   9.495   3.656   3.656
  628   2HD   LYS  79          1HD       LYS  79   9.433   5.418   5.418
  629   1HE   LYS  79          2HE       LYS  79  12.079   4.108   4.108
  630   2HE   LYS  79          1HE       LYS  79  10.972   4.146   4.146
  631   1HZ   LYS  79          3HZ       LYS  79  11.413   6.640   6.640
  632   2HZ   LYS  79          2HZ       LYS  79  12.662   6.088   6.088
  633   3HZ   LYS  79          1HZ       LYS  79  11.131   6.390   6.390
  634    H    PHE  80           H        PHE  80   6.918   6.268   6.268
  635    HA   PHE  80           HA       PHE  80   7.529   8.778   8.778
  636   1HB   PHE  80          2HB       PHE  80   4.881   7.363   7.363
  637   2HB   PHE  80          1HB       PHE  80   5.567   8.528   8.528
  638    HD1  PHE  80           HD1      PHE  80   5.649   5.042   5.042
  639    HD2  PHE  80           HD2      PHE  80   7.075   7.849   7.849
  640    HE1  PHE  80           HE1      PHE  80   6.488   3.193   3.193
  641    HE2  PHE  80           HE2      PHE  80   7.918   6.005   6.005
  642    HZ   PHE  80           HZ       PHE  80   7.625   3.674   3.674
  643    H    ALA  81           H        ALA  81   6.162   7.484   7.484
  644    HA   ALA  81           HA       ALA  81   5.210   8.473   8.473
  645   1HB   ALA  81          3HB       ALA  81   6.839  10.384  10.384
  646   2HB   ALA  81          2HB       ALA  81   5.304  11.201  11.201
  647   3HB   ALA  81          1HB       ALA  81   5.711  10.646  10.646
  648    H    CYS  82           H        CYS  82   3.614   7.483   7.483
  649    HA   CYS  82           HA       CYS  82   1.330   9.340   9.340
  650   1HB   CYS  82          2HB       CYS  82   2.288   7.272   7.272
  651   2HB   CYS  82          1HB       CYS  82   0.555   7.566   7.566
  652    HG   CYS  82           HG       CYS  82   1.632   9.100   9.100
  653    H    ASN  83           H        ASN  83  -0.842   8.176   8.176
  654    HA   ASN  83           HA       ASN  83  -0.878   6.321   6.321
  655   1HB   ASN  83          2HB       ASN  83  -2.884   8.118   8.118
  656   2HB   ASN  83          1HB       ASN  83  -3.466   6.721   6.721
  657   1HD2  ASN  83          2HD2      ASN  83  -1.892   7.960   7.960
  658   2HD2  ASN  83          1HD2      ASN  83  -1.829   6.536   6.536
  659    H    GLY  84           H        GLY  84  -0.709   4.235   4.235
  660   1HA   GLY  84          2HA       GLY  84  -2.130   3.245   3.245
  661   2HA   GLY  84          1HA       GLY  84  -0.631   2.554   2.554
  662    H    THR  85           H        THR  85  -3.465   1.527   1.527
  663    HA   THR  85           HA       THR  85  -3.656   0.141   0.141
  664    HB   THR  85           HB       THR  85  -6.063   0.310   0.310
  665    HG1  THR  85           HG1      THR  85  -6.917   0.467   0.467
  666   1HG2  THR  85          1HG2      THR  85  -4.542   2.379   2.379
  667   2HG2  THR  85          3HG2      THR  85  -5.442   3.119   3.119
  668   3HG2  THR  85          2HG2      THR  85  -6.304   2.444   2.444
  669    H    VAL  86           H        VAL  86  -5.111  -1.837  -1.837
  670    HA   VAL  86           HA       VAL  86  -4.679  -3.107  -3.107
  671    HB   VAL  86           HB       VAL  86  -3.245  -4.053  -4.053
  672   1HG1  VAL  86          1HG1      VAL  86  -5.129  -3.607  -3.607
  673   2HG1  VAL  86          3HG1      VAL  86  -5.630  -5.242  -5.242
  674   3HG1  VAL  86          2HG1      VAL  86  -4.010  -4.954  -4.954
  675   1HG2  VAL  86          2HG2      VAL  86  -4.601  -5.384  -5.384
  676   2HG2  VAL  86          1HG2      VAL  86  -3.438  -6.151  -6.151
  677   3HG2  VAL  86          3HG2      VAL  86  -5.164  -6.245  -6.245
  678    H    ILE  87           H        ILE  87  -6.515  -3.512  -3.512
  679    HA   ILE  87           HA       ILE  87  -8.909  -4.204  -4.204
  680    HB   ILE  87           HB       ILE  87 -10.255  -3.175  -3.175
  681   1HG1  ILE  87          2HG1      ILE  87  -7.569  -2.009  -2.009
  682   2HG1  ILE  87          1HG1      ILE  87  -8.512  -3.148  -3.148
  683   1HG2  ILE  87          1HG2      ILE  87  -9.736  -2.086  -2.086
  684   2HG2  ILE  87          3HG2      ILE  87  -8.467  -1.186  -1.186
  685   3HG2  ILE  87          2HG2      ILE  87 -10.152  -0.984  -0.984
  686   1HD1  ILE  87          3HD1      ILE  87 -10.311  -1.439  -1.439
  687   2HD1  ILE  87          2HD1      ILE  87  -9.222  -0.305  -0.305
  688   3HD1  ILE  87          1HD1      ILE  87  -8.802  -0.969  -0.969
  689    H    GLU  88           H        GLU  88 -10.311  -5.750  -5.750
  690    HA   GLU  88           HA       GLU  88  -9.094  -7.440  -7.440
  691   1HB   GLU  88          2HB       GLU  88  -9.746  -8.299  -8.299
  692   2HB   GLU  88          1HB       GLU  88 -11.391  -8.276  -8.276
  693   1HG   GLU  88          2HG       GLU  88 -10.610  -9.726  -9.726
  694   2HG   GLU  88          1HG       GLU  88  -9.065  -9.866  -9.866
  695    H    HIS  89           H        HIS  89  -9.893  -5.859  -5.859
  696    HA   HIS  89           HA       HIS  89 -12.599  -5.330  -5.330
  697   1HB   HIS  89          2HB       HIS  89 -10.358  -4.413  -4.413
  698   2HB   HIS  89          1HB       HIS  89 -10.772  -5.599  -5.599
  699    HD1  HIS  89           HD1      HIS  89 -12.474  -4.911  -4.911
  700    HD2  HIS  89           HD2      HIS  89 -12.442  -2.412  -2.412
  701    HE1  HIS  89           HE1      HIS  89 -14.034  -3.023  -3.023
  702    HE2  HIS  89           HE2      HIS  89 -14.040  -1.548  -1.548
  703    HA   PRO  90           HA       PRO  90 -13.972  -9.268  -9.268
  704   1HB   PRO  90          2HB       PRO  90 -16.427  -8.570  -8.570
  705   2HB   PRO  90          1HB       PRO  90 -16.003  -8.608  -8.608
  706   1HG   PRO  90          2HG       PRO  90 -16.198  -6.267  -6.267
  707   2HG   PRO  90          1HG       PRO  90 -16.750  -6.415  -6.415
  708   1HD   PRO  90          2HD       PRO  90 -14.400  -5.203  -5.203
  709   2HD   PRO  90          1HD       PRO  90 -14.683  -5.922  -5.922
  710    H    GLU  91           H        GLU  91 -13.741  -6.407  -6.407
  711    HA   GLU  91           HA       GLU  91 -14.395  -7.694  -7.694
  712   1HB   GLU  91          2HB       GLU  91 -14.221  -5.065  -5.065
  713   2HB   GLU  91          1HB       GLU  91 -12.884  -5.226  -5.226
  714   1HG   GLU  91          2HG       GLU  91 -15.596  -6.186  -6.186
  715   2HG   GLU  91          1HG       GLU  91 -15.218  -4.464  -4.464
  716    H    TYR  92           H        TYR  92 -11.559  -7.235  -7.235
  717    HA   TYR  92           HA       TYR  92  -9.934  -8.390  -8.390
  718   1HB   TYR  92          2HB       TYR  92  -8.646  -6.726  -6.726
  719   2HB   TYR  92          1HB       TYR  92  -8.152  -6.993  -6.993
  720    HD1  TYR  92           HD2      TYR  92 -10.382  -6.205  -6.205
  721    HD2  TYR  92           HD1      TYR  92  -8.988  -4.471  -4.471
  722    HE1  TYR  92           HE2      TYR  92 -11.398  -4.061  -4.061
  723    HE2  TYR  92           HE1      TYR  92 -10.000  -2.321  -2.321
  724    HH   TYR  92           HH       TYR  92 -11.020  -1.604  -1.604
  725    H    GLY  93           H        GLY  93 -10.144  -7.994  -7.994
  726   1HA   GLY  93          2HA       GLY  93 -10.175  -9.875  -9.875
  727   2HA   GLY  93          1HA       GLY  93  -9.288 -10.793 -10.793
  728    H    GLU  94           H        GLU  94  -9.074  -8.958  -8.958
  729    HA   GLU  94           HA       GLU  94  -7.351  -8.268  -8.268
  730   1HB   GLU  94          2HB       GLU  94  -6.819 -10.805 -10.805
  731   2HB   GLU  94          1HB       GLU  94  -5.408 -10.037 -10.037
  732   1HG   GLU  94          2HG       GLU  94  -5.936  -9.100  -9.100
  733   2HG   GLU  94          1HG       GLU  94  -5.688 -10.843 -10.843
  734    H    VAL  95           H        VAL  95  -7.298  -6.173  -6.173
  735    HA   VAL  95           HA       VAL  95  -4.839  -5.713  -5.713
  736    HB   VAL  95           HB       VAL  95  -5.931  -3.964  -3.964
  737   1HG1  VAL  95          3HG1      VAL  95  -5.907  -6.365  -6.365
  738   2HG1  VAL  95          2HG1      VAL  95  -7.581  -6.472  -6.472
  739   3HG1  VAL  95          1HG1      VAL  95  -7.143  -5.348  -5.348
  740   1HG2  VAL  95          3HG2      VAL  95  -8.460  -4.816  -4.816
  741   2HG2  VAL  95          2HG2      VAL  95  -7.627  -3.273  -3.273
  742   3HG2  VAL  95          1HG2      VAL  95  -8.371  -3.689  -3.689
  743    H    ILE  96           H        ILE  96  -3.559  -4.151  -4.151
  744    HA   ILE  96           HA       ILE  96  -4.201  -2.908  -2.908
  745    HB   ILE  96           HB       ILE  96  -1.874  -2.771  -2.771
  746   1HG1  ILE  96          2HG1      ILE  96  -2.502  -4.401  -4.401
  747   2HG1  ILE  96          1HG1      ILE  96  -0.863  -4.102  -4.102
  748   1HG2  ILE  96          1HG2      ILE  96  -2.271  -0.924  -0.924
  749   2HG2  ILE  96          3HG2      ILE  96  -0.745  -1.167  -1.167
  750   3HG2  ILE  96          2HG2      ILE  96  -2.121  -0.463  -0.463
  751   1HD1  ILE  96          2HD1      ILE  96  -2.058  -2.333  -2.333
  752   2HD1  ILE  96          1HD1      ILE  96  -1.425  -3.919  -3.919
  753   3HD1  ILE  96          3HD1      ILE  96  -0.366  -2.724  -2.724
  754    H    GLN  97           H        GLN  97  -4.232  -0.578  -0.578
  755    HA   GLN  97           HA       GLN  97  -5.145   0.982   0.982
  756   1HB   GLN  97          2HB       GLN  97  -6.868   0.030   0.030
  757   2HB   GLN  97          1HB       GLN  97  -6.492   1.633   1.633
  758   1HG   GLN  97          2HG       GLN  97  -6.994   2.321   2.321
  759   2HG   GLN  97          1HG       GLN  97  -7.942   0.836   0.836
  760   1HE2  GLN  97          1HE2      GLN  97  -9.513   2.743   2.743
  761   2HE2  GLN  97          2HE2      GLN  97 -10.326   3.354   3.354
  762    H    LEU  98           H        LEU  98  -3.582   2.443   2.443
  763    HA   LEU  98           HA       LEU  98  -2.356   3.680   3.680
  764   1HB   LEU  98          2HB       LEU  98  -1.754   4.055   4.055
  765   2HB   LEU  98          1HB       LEU  98  -0.819   4.699   4.699
  766    HG   LEU  98           HG       LEU  98  -1.218   1.747   1.747
  767   1HD1  LEU  98          3HD1      LEU  98  -0.323   3.044   3.044
  768   2HD1  LEU  98          2HD1      LEU  98   1.184   2.787   2.787
  769   3HD1  LEU  98          1HD1      LEU  98   0.161   1.412   1.412
  770   1HD2  LEU  98          1HD2      LEU  98   0.498   3.656   3.656
  771   2HD2  LEU  98          3HD2      LEU  98   0.027   2.014   2.014
  772   3HD2  LEU  98          2HD2      LEU  98   1.363   2.277   2.277
  773    H    GLN  99           H        GLN  99  -2.195   6.013   6.013
  774    HA   GLN  99           HA       GLN  99  -4.661   7.294   7.294
  775   1HB   GLN  99          2HB       GLN  99  -2.811   7.682   7.682
  776   2HB   GLN  99          1HB       GLN  99  -3.560   9.135   9.135
  777   1HG   GLN  99          2HG       GLN  99  -5.455   6.966   6.966
  778   2HG   GLN  99          1HG       GLN  99  -4.644   7.446   7.446
  779   1HE2  GLN  99          2HE2      GLN  99  -6.966  10.185  10.185
  780   2HE2  GLN  99          1HE2      GLN  99  -6.143   8.943   8.943
  781    H    GLY 100           H        GLY 100  -4.708   9.142   9.142
  782   1HA   GLY 100          2HA       GLY 100  -3.898  10.895  10.895
  783   2HA   GLY 100          1HA       GLY 100  -2.282  10.546  10.546
  784    H    ASP 101           H        ASP 101  -2.328  11.175  11.175
  785    HA   ASP 101           HA       ASP 101  -2.778   8.907   8.907
  786   1HB   ASP 101          2HB       ASP 101  -1.682  10.354  10.354
  787   2HB   ASP 101          1HB       ASP 101  -3.099  11.067  11.067
  788    H    GLN 102           H        GLN 102  -1.481   7.286   7.286
  789    HA   GLN 102           HA       GLN 102   1.418   7.697   7.697
  790   1HB   GLN 102          2HB       GLN 102  -0.398   5.979   5.979
  791   2HB   GLN 102          1HB       GLN 102   1.100   5.213   5.213
  792   1HG   GLN 102          2HG       GLN 102   1.060   6.345   6.345
  793   2HG   GLN 102          1HG       GLN 102   2.416   6.704   6.704
  794   1HE2  GLN 102          2HE2      GLN 102  -0.445   9.616   9.616
  795   2HE2  GLN 102          1HE2      GLN 102  -0.878   7.962   7.962
  796    H    ARG 103           H        ARG 103  -0.684   6.997   6.997
  797    HA   ARG 103           HA       ARG 103  -0.251   4.465   4.465
  798   1HB   ARG 103          2HB       ARG 103  -0.828   5.391   5.391
  799   2HB   ARG 103          1HB       ARG 103  -1.895   6.003   6.003
  800   1HG   ARG 103          2HG       ARG 103  -0.889   8.122   8.122
  801   2HG   ARG 103          1HG       ARG 103   0.508   7.537   7.537
  802   1HD   ARG 103          2HD       ARG 103  -0.566   7.645   7.645
  803   2HD   ARG 103          1HD       ARG 103  -2.119   7.179   7.179
  804    HE   ARG 103           HE       ARG 103  -2.630   9.394   9.394
  805   1HH1  ARG 103          2HH1      ARG 103   0.801   9.089   9.089
  806   2HH1  ARG 103          1HH1      ARG 103   1.054  10.794  10.794
  807   1HH2  ARG 103          1HH2      ARG 103  -2.300  11.638  11.638
  808   2HH2  ARG 103          2HH2      ARG 103  -0.707  12.243  12.243
  809    H    LYS 104           H        LYS 104   1.904   7.170   7.170
  810    HA   LYS 104           HA       LYS 104   3.787   5.809   5.809
  811   1HB   LYS 104          2HB       LYS 104   3.273   8.153   8.153
  812   2HB   LYS 104          1HB       LYS 104   3.820   8.637   8.637
  813   1HG   LYS 104          2HG       LYS 104   5.871   7.117   7.117
  814   2HG   LYS 104          1HG       LYS 104   5.332   8.427   8.427
  815   1HD   LYS 104          2HD       LYS 104   6.126   8.790   8.790
  816   2HD   LYS 104          1HD       LYS 104   7.213   9.044   9.044
  817   1HE   LYS 104          2HE       LYS 104   4.669  10.444  10.444
  818   2HE   LYS 104          1HE       LYS 104   5.584  10.943  10.943
  819   1HZ   LYS 104          3HZ       LYS 104   7.532  11.170  11.170
  820   2HZ   LYS 104          2HZ       LYS 104   6.407  11.063  11.063
  821   3HZ   LYS 104          1HZ       LYS 104   6.306  12.328  12.328
  822    H    ASN 105           H        ASN 105   3.207   6.581   6.581
  823    HA   ASN 105           HA       ASN 105   5.982   6.230   6.230
  824   1HB   ASN 105          2HB       ASN 105   3.446   6.951   6.951
  825   2HB   ASN 105          1HB       ASN 105   4.806   6.342   6.342
  826   1HD2  ASN 105          2HD2      ASN 105   4.701  10.142  10.142
  827   2HD2  ASN 105          1HD2      ASN 105   3.376   9.043   9.043
  828    H    ILE 106           H        ILE 106   2.965   4.429   4.429
  829    HA   ILE 106           HA       ILE 106   3.802   2.361   2.361
  830    HB   ILE 106           HB       ILE 106   1.441   2.771   2.771
  831   1HG1  ILE 106          2HG1      ILE 106   0.780   0.426   0.426
  832   2HG1  ILE 106          1HG1      ILE 106   2.381  -0.013  -0.013
  833   1HG2  ILE 106          3HG2      ILE 106   1.882   3.183   3.183
  834   2HG2  ILE 106          2HG2      ILE 106   2.017   1.439   1.439
  835   3HG2  ILE 106          1HG2      ILE 106   0.498   2.149   2.149
  836   1HD1  ILE 106          3HD1      ILE 106   2.325   1.417   1.417
  837   2HD1  ILE 106          2HD1      ILE 106   1.601  -0.191  -0.191
  838   3HD1  ILE 106          1HD1      ILE 106   3.276   0.023   0.023
  839    H    CYS 107           H        CYS 107   3.762   2.536   2.536
  840    HA   CYS 107           HA       CYS 107   4.803   0.012   0.012
  841   1HB   CYS 107          2HB       CYS 107   5.773   1.127   1.127
  842   2HB   CYS 107          1HB       CYS 107   4.036   1.291   1.291
  843    HG   CYS 107           HG       CYS 107   6.095   3.580   3.580
  844    H    GLN 108           H        GLN 108   6.324   2.949   2.949
  845    HA   GLN 108           HA       GLN 108   9.032   2.153   2.153
  846   1HB   GLN 108          2HB       GLN 108   7.613   4.318   4.318
  847   2HB   GLN 108          1HB       GLN 108   9.272   3.964   3.964
  848   1HG   GLN 108          2HG       GLN 108   8.733   4.309   4.309
  849   2HG   GLN 108          1HG       GLN 108   8.613   5.744   5.744
  850   1HE2  GLN 108          2HE2      GLN 108  12.233   3.879   3.879
  851   2HE2  GLN 108          1HE2      GLN 108  10.763   3.007   3.007
  852    H    PHE 109           H        PHE 109   6.837   2.185   2.185
  853    HA   PHE 109           HA       PHE 109   8.573   1.177   1.177
  854   1HB   PHE 109          2HB       PHE 109   6.348   2.201   2.201
  855   2HB   PHE 109          1HB       PHE 109   5.587   0.748   0.748
  856    HD1  PHE 109           HD2      PHE 109   8.089   1.771   1.771
  857    HD2  PHE 109           HD1      PHE 109   4.940  -0.874  -0.874
  858    HE1  PHE 109           HE2      PHE 109   8.165   0.767   0.767
  859    HE2  PHE 109           HE1      PHE 109   5.008  -1.882  -1.882
  860    HZ   PHE 109           HZ       PHE 109   6.621  -1.059  -1.059
  861    H    LEU 110           H        LEU 110   6.226  -0.549  -0.549
  862    HA   LEU 110           HA       LEU 110   6.691  -3.121  -3.121
  863   1HB   LEU 110          2HB       LEU 110   5.681  -1.969  -1.969
  864   2HB   LEU 110          1HB       LEU 110   6.084  -3.673  -3.673
  865    HG   LEU 110           HG       LEU 110   4.414  -4.160  -4.160
  866   1HD1  LEU 110          3HD1      LEU 110   4.442  -1.216  -1.216
  867   2HD1  LEU 110          2HD1      LEU 110   3.020  -2.179  -2.179
  868   3HD1  LEU 110          1HD1      LEU 110   4.576  -2.555  -2.555
  869   1HD2  LEU 110          3HD2      LEU 110   3.715  -3.464  -3.464
  870   2HD2  LEU 110          2HD2      LEU 110   2.471  -3.647  -3.647
  871   3HD2  LEU 110          1HD2      LEU 110   3.039  -2.038  -2.038
  872    H    VAL 111           H        VAL 111   8.558  -1.148  -1.148
  873    HA   VAL 111           HA       VAL 111  10.277  -3.391  -3.391
  874    HB   VAL 111           HB       VAL 111  10.388  -0.498  -0.498
  875   1HG1  VAL 111          1HG1      VAL 111  12.039  -2.893  -2.893
  876   2HG1  VAL 111          3HG1      VAL 111  11.755  -1.666  -1.666
  877   3HG1  VAL 111          2HG1      VAL 111  12.538  -1.225  -1.225
  878   1HG2  VAL 111          3HG2      VAL 111   8.435  -2.189  -2.189
  879   2HG2  VAL 111          2HG2      VAL 111   9.079  -0.989  -0.989
  880   3HG2  VAL 111          1HG2      VAL 111   9.630  -2.663  -2.663
  881    H    GLU 112           H        GLU 112  10.201  -0.654  -0.654
  882    HA   GLU 112           HA       GLU 112  13.037  -0.557  -0.557
  883   1HB   GLU 112          2HB       GLU 112  10.695   0.709   0.709
  884   2HB   GLU 112          1HB       GLU 112  12.362   0.949   0.949
  885   1HG   GLU 112          2HG       GLU 112  12.140   1.455   1.455
  886   2HG   GLU 112          1HG       GLU 112  10.907   2.371   2.371
  887    H    ILE 113           H        ILE 113  10.239  -1.883  -1.883
  888    HA   ILE 113           HA       ILE 113  11.954  -2.939  -2.939
  889    HB   ILE 113           HB       ILE 113   9.991  -3.593  -3.593
  890   1HG1  ILE 113          2HG1      ILE 113   8.460  -3.072  -3.072
  891   2HG1  ILE 113          1HG1      ILE 113   8.795  -4.653  -4.653
  892   1HG2  ILE 113          1HG2      ILE 113  10.517  -1.054  -1.054
  893   2HG2  ILE 113          3HG2      ILE 113   8.939  -1.119  -1.119
  894   3HG2  ILE 113          2HG2      ILE 113   9.093  -1.542  -1.542
  895   1HD1  ILE 113          1HD1      ILE 113   7.450  -2.831  -2.831
  896   2HD1  ILE 113          3HD1      ILE 113   6.524  -3.202  -3.202
  897   3HD1  ILE 113          2HD1      ILE 113   7.089  -4.507  -4.507
  898    H    GLY 114           H        GLY 114  10.519  -3.991  -3.991
  899   1HA   GLY 114          2HA       GLY 114  11.156  -5.964  -5.964
  900   2HA   GLY 114          1HA       GLY 114  11.674  -6.648  -6.648
  901    H    LEU 115           H        LEU 115   8.590  -5.086  -5.086
  902    HA   LEU 115           HA       LEU 115   7.198  -7.437  -7.437
  903   1HB   LEU 115          2HB       LEU 115   6.746  -4.750  -4.750
  904   2HB   LEU 115          1HB       LEU 115   5.610  -5.192  -5.192
  905    HG   LEU 115           HG       LEU 115   4.474  -6.716  -6.716
  906   1HD1  LEU 115          1HD1      LEU 115   6.828  -6.311  -6.311
  907   2HD1  LEU 115          3HD1      LEU 115   5.273  -6.845  -6.845
  908   3HD1  LEU 115          2HD1      LEU 115   6.109  -7.816  -7.816
  909   1HD2  LEU 115          2HD2      LEU 115   4.438  -4.048  -4.048
  910   2HD2  LEU 115          1HD2      LEU 115   3.386  -5.169  -5.169
  911   3HD2  LEU 115          3HD2      LEU 115   4.858  -4.571  -4.571
  912    H    ALA 116           H        ALA 116   6.484  -5.313  -5.313
  913    HA   ALA 116           HA       ALA 116   5.440  -7.609  -7.609
  914   1HB   ALA 116          1HB       ALA 116   4.287  -5.330  -5.330
  915   2HB   ALA 116          3HB       ALA 116   5.501  -4.782  -4.782
  916   3HB   ALA 116          2HB       ALA 116   4.399  -6.086  -6.086
  917    H    LYS 117           H        LYS 117   5.934  -6.781  -6.781
  918    HA   LYS 117           HA       LYS 117   8.871  -6.892  -6.892
  919   1HB   LYS 117          2HB       LYS 117   7.048  -8.913  -8.913
  920   2HB   LYS 117          1HB       LYS 117   7.641  -8.196  -8.196
  921   1HG   LYS 117          2HG       LYS 117   8.982 -10.119 -10.119
  922   2HG   LYS 117          1HG       LYS 117   9.921  -8.627  -8.627
  923   1HD   LYS 117          2HD       LYS 117   8.849  -8.804  -8.804
  924   2HD   LYS 117          1HD       LYS 117   9.524 -10.386 -10.386
  925   1HE   LYS 117          2HE       LYS 117  11.588  -9.102  -9.102
  926   2HE   LYS 117          1HE       LYS 117  10.904  -7.718  -7.718
  927   1HZ   LYS 117          2HZ       LYS 117  11.263 -10.307 -10.307
  928   2HZ   LYS 117          1HZ       LYS 117  12.549  -9.218  -9.218
  929   3HZ   LYS 117          3HZ       LYS 117  11.135  -8.761  -8.761
  930    H    ASP 118           H        ASP 118   9.786  -5.968  -5.968
  931    HA   ASP 118           HA       ASP 118   8.615  -3.555  -3.555
  932   1HB   ASP 118          2HB       ASP 118  10.414  -3.390  -3.390
  933   2HB   ASP 118          1HB       ASP 118  11.040  -3.980  -3.980
  934    H    ASP 119           H        ASP 119   8.373  -6.765  -6.765
  935    HA   ASP 119           HA       ASP 119   7.198  -5.913  -5.913
  936   1HB   ASP 119          2HB       ASP 119   7.270  -8.685  -8.685
  937   2HB   ASP 119          1HB       ASP 119   6.922  -8.281  -8.281
  938    H    GLN 120           H        GLN 120   6.134  -6.850  -6.850
  939    HA   GLN 120           HA       GLN 120   3.383  -7.220  -7.220
  940   1HB   GLN 120          2HB       GLN 120   4.534  -6.995  -6.995
  941   2HB   GLN 120          1HB       GLN 120   2.953  -7.625  -7.625
  942   1HG   GLN 120          2HG       GLN 120   4.215  -9.388  -9.388
  943   2HG   GLN 120          1HG       GLN 120   5.645  -8.856  -8.856
  944   1HE2  GLN 120          2HE2      GLN 120   3.848  -9.788  -9.788
  945   2HE2  GLN 120          1HE2      GLN 120   4.308  -8.284  -8.284
  946    H    LEU 121           H        LEU 121   5.309  -4.568  -4.568
  947    HA   LEU 121           HA       LEU 121   3.838  -2.804  -2.804
  948   1HB   LEU 121          2HB       LEU 121   5.586  -2.369  -2.369
  949   2HB   LEU 121          1HB       LEU 121   4.837  -1.029  -1.029
  950    HG   LEU 121           HG       LEU 121   6.644  -3.021  -3.021
  951   1HD1  LEU 121          2HD1      LEU 121   7.287  -0.480  -0.480
  952   2HD1  LEU 121          1HD1      LEU 121   8.288  -1.052  -1.052
  953   3HD1  LEU 121          3HD1      LEU 121   8.083  -2.053  -2.053
  954   1HD2  LEU 121          2HD2      LEU 121   5.170  -0.594  -0.594
  955   2HD2  LEU 121          1HD2      LEU 121   5.655  -1.995  -1.995
  956   3HD2  LEU 121          3HD2      LEU 121   6.825  -0.725  -0.725
  957    H    LYS 122           H        LYS 122   1.634  -3.012  -3.012
  958    HA   LYS 122           HA       LYS 122   0.591  -2.105  -2.105
  959   1HB   LYS 122          2HB       LYS 122  -0.237  -4.255  -4.255
  960   2HB   LYS 122          1HB       LYS 122  -1.557  -3.258  -3.258
  961   1HG   LYS 122          2HG       LYS 122   0.476  -4.612  -4.612
  962   2HG   LYS 122          1HG       LYS 122  -1.116  -5.271  -5.271
  963   1HD   LYS 122          2HD       LYS 122  -2.182  -3.847  -3.847
  964   2HD   LYS 122          1HD       LYS 122  -1.105  -2.503  -2.503
  965   1HE   LYS 122          2HE       LYS 122   0.250  -2.938  -2.938
  966   2HE   LYS 122          1HE       LYS 122   0.176  -4.680  -4.680
  967   1HZ   LYS 122          1HZ       LYS 122  -2.213  -3.368  -3.368
  968   2HZ   LYS 122          3HZ       LYS 122  -0.894  -3.538  -3.538
  969   3HZ   LYS 122          2HZ       LYS 122  -1.588  -4.904  -4.904
  970    H    VAL 123           H        VAL 123   0.803   0.097   0.097
  971    HA   VAL 123           HA       VAL 123  -0.872   0.971   0.971
  972    HB   VAL 123           HB       VAL 123   1.419   1.870   1.870
  973   1HG1  VAL 123          1HG1      VAL 123   1.082   1.974   1.974
  974   2HG1  VAL 123          3HG1      VAL 123   0.745   3.654   3.654
  975   3HG1  VAL 123          2HG1      VAL 123   2.287   2.928   2.928
  976   1HG2  VAL 123          1HG2      VAL 123  -0.884   3.780   3.780
  977   2HG2  VAL 123          3HG2      VAL 123  -0.096   3.219   3.219
  978   3HG2  VAL 123          2HG2      VAL 123   0.749   4.319   4.319
  979    H    HIS 124           H        HIS 124  -2.845   1.788   1.788
  980    HA   HIS 124           HA       HIS 124  -3.513   2.885   2.885
  981   1HB   HIS 124          2HB       HIS 124  -5.419   1.278   1.278
  982   2HB   HIS 124          1HB       HIS 124  -5.664   1.835   1.835
  983    HD1  HIS 124           HD1      HIS 124  -5.126   0.187   0.187
  984    HD2  HIS 124           HD2      HIS 124  -3.208  -0.696  -0.696
  985    HE1  HIS 124           HE1      HIS 124  -3.948  -1.999  -1.999
  986    HE2  HIS 124           HE2      HIS 124  -2.922  -2.582  -2.582
  987    H    GLY 125           H        GLY 125  -2.995   4.938   4.938
  988   1HA   GLY 125          2HA       GLY 125  -4.339   5.941   5.941
  989   2HA   GLY 125          1HA       GLY 125  -3.642   6.920   6.920
  990    H    PHE 126           HN       PHE 126  -6.407   6.346   6.346
  991    HA   PHE 126           HA       PHE 126  -8.482   6.036   6.036
  992   1HB   PHE 126          2HB       PHE 126  -9.868   7.094   7.094
  993   2HB   PHE 126          1HB       PHE 126  -8.530   6.459   6.459
  994    HD1  PHE 126           HD2      PHE 126  -6.440   8.425   8.425
  995    HD2  PHE 126           HD1      PHE 126 -10.630   8.984   8.984
  996    HE1  PHE 126           HE2      PHE 126  -6.031  10.669  10.669
  997    HE2  PHE 126           HE1      PHE 126 -10.230  11.230  11.230
  998    HZ   PHE 126           HZ       PHE 126  -7.928  12.075  12.075

  Start of MODEL   17
    1   1H    MET   1          2H        MET   1  -9.172  21.204  21.204
    2   2H    MET   1          1H        MET   1  -8.997  19.575  19.575
    3   3H    MET   1          3H        MET   1 -10.229  20.557  20.557
    4    HA   MET   1           HA       MET   1  -8.616  21.967  21.967
    5   1HB   MET   1          2HB       MET   1  -7.843  20.368  20.368
    6   2HB   MET   1          1HB       MET   1  -9.489  19.990  19.990
    7   1HG   MET   1          2HG       MET   1  -7.483  18.596  18.596
    8   2HG   MET   1          1HG       MET   1  -7.398  18.224  18.224
    9   1HE   MET   1          3HE       MET   1  -7.702  15.963  15.963
   10   2HE   MET   1          2HE       MET   1  -9.021  15.966  15.966
   11   3HE   MET   1          1HE       MET   1  -9.203  15.112  15.112
   12    H    ARG   2           H        ARG   2  -7.391  22.317  22.317
   13    HA   ARG   2           HA       ARG   2  -4.646  21.317  21.317
   14   1HB   ARG   2          2HB       ARG   2  -5.689  20.395  20.395
   15   2HB   ARG   2          1HB       ARG   2  -5.975  22.029  22.029
   16   1HG   ARG   2          2HG       ARG   2  -3.856  22.295  22.295
   17   2HG   ARG   2          1HG       ARG   2  -3.191  21.454  21.454
   18   1HD   ARG   2          2HD       ARG   2  -3.647  19.321  19.321
   19   2HD   ARG   2          1HD       ARG   2  -4.558  20.059  20.059
   20    HE   ARG   2           HE       ARG   2  -1.701  19.806  19.806
   21   1HH1  ARG   2          2HH1      ARG   2  -4.321  21.590  21.590
   22   2HH1  ARG   2          1HH1      ARG   2  -3.372  22.124  22.124
   23   1HH2  ARG   2          1HH2      ARG   2  -0.452  20.508  20.508
   24   2HH2  ARG   2          2HH2      ARG   2  -1.176  21.509  21.509
   25    H    GLY   3           H        GLY   3  -3.717  22.990  22.990
   26   1HA   GLY   3          2HA       GLY   3  -4.300  25.727  25.727
   27   2HA   GLY   3          1HA       GLY   3  -2.985  25.126  25.126
   28    H    SER   4           H        SER   4  -1.666  26.799  26.799
   29    HA   SER   4           HA       SER   4  -1.104  26.860  26.860
   30   1HB   SER   4          2HB       SER   4   0.256  28.143  28.143
   31   2HB   SER   4          1HB       SER   4   0.762  28.407  28.407
   32    HG   SER   4           HG       SER   4  -0.838  29.920  29.920
   33    H    HIS   5           H        HIS   5   1.031  26.143  26.143
   34    HA   HIS   5           HA       HIS   5   2.774  24.703  24.703
   35   1HB   HIS   5          2HB       HIS   5   0.973  23.076  23.076
   36   2HB   HIS   5          1HB       HIS   5   1.707  23.188  23.188
   37    HD1  HIS   5           HD1      HIS   5   1.721  21.049  21.049
   38    HD2  HIS   5           HD2      HIS   5   4.724  22.621  22.621
   39    HE1  HIS   5           HE1      HIS   5   3.697  19.525  19.525
   40    HE2  HIS   5           HE2      HIS   5   5.529  20.545  20.545
   41    H    HIS   6           H        HIS   6   4.811  25.146  25.146
   42    HA   HIS   6           HA       HIS   6   5.882  24.969  24.969
   43   1HB   HIS   6          2HB       HIS   6   4.512  27.289  27.289
   44   2HB   HIS   6          1HB       HIS   6   6.086  27.801  27.801
   45    HD1  HIS   6           HD1      HIS   6   7.804  26.052  26.052
   46    HD2  HIS   6           HD2      HIS   6   4.628  28.499  28.499
   47    HE1  HIS   6           HE1      HIS   6   8.182  26.603  26.603
   48    HE2  HIS   6           HE2      HIS   6   6.201  28.012  28.012
   49    H    HIS   7           H        HIS   7   7.670  23.971  23.971
   50    HA   HIS   7           HA       HIS   7   9.620  25.497  25.497
   51   1HB   HIS   7          2HB       HIS   7   7.971  23.536  23.536
   52   2HB   HIS   7          1HB       HIS   7   9.666  23.060  23.060
   53    HD1  HIS   7           HD1      HIS   7  11.325  24.940  24.940
   54    HD2  HIS   7           HD2      HIS   7   7.267  25.434  25.434
   55    HE1  HIS   7           HE1      HIS   7  11.187  26.555  26.555
   56    HE2  HIS   7           HE2      HIS   7   8.726  26.762  26.762
   57    H    HIS   8           H        HIS   8   9.272  24.172  24.172
   58    HA   HIS   8           HA       HIS   8  11.200  22.000  22.000
   59   1HB   HIS   8          2HB       HIS   8   9.521  23.242  23.242
   60   2HB   HIS   8          1HB       HIS   8  10.796  22.085  22.085
   61    HD1  HIS   8           HD1      HIS   8  10.184  20.239  20.239
   62    HD2  HIS   8           HD2      HIS   8   7.438  21.546  21.546
   63    HE1  HIS   8           HE1      HIS   8   8.297  18.578  18.578
   64    HE2  HIS   8           HE2      HIS   8   6.609  19.437  19.437
   65    H    HIS   9           H        HIS   9  13.261  22.593  22.593
   66    HA   HIS   9           HA       HIS   9  14.278  24.725  24.725
   67   1HB   HIS   9          2HB       HIS   9  16.009  25.076  25.076
   68   2HB   HIS   9          1HB       HIS   9  14.395  25.748  25.748
   69    HD1  HIS   9           HD1      HIS   9  12.757  24.304  24.304
   70    HD2  HIS   9           HD2      HIS   9  16.802  23.369  23.369
   71    HE1  HIS   9           HE1      HIS   9  13.040  22.989  22.989
   72    HE2  HIS   9           HE2      HIS   9  15.479  22.360  22.360
   73    H    HIS  10           H        HIS  10  15.225  21.908  21.908
   74    HA   HIS  10           HA       HIS  10  17.506  21.456  21.456
   75   1HB   HIS  10          2HB       HIS  10  17.333  21.264  21.264
   76   2HB   HIS  10          1HB       HIS  10  16.999  19.594  19.594
   77    HD1  HIS  10           HD1      HIS  10  19.359  19.217  19.217
   78    HD2  HIS  10           HD2      HIS  10  19.518  21.159  21.159
   79    HE1  HIS  10           HE1      HIS  10  21.758  19.065  19.065
   80    HE2  HIS  10           HE2      HIS  10  21.812  20.171  20.171
   81    H    THR  11           H        THR  11  14.482  19.976  19.976
   82    HA   THR  11           HA       THR  11  14.900  17.847  17.847
   83    HB   THR  11           HB       THR  11  12.900  17.830  17.830
   84    HG1  THR  11           HG1      THR  11  14.378  16.680  16.680
   85   1HG2  THR  11          3HG2      THR  11  12.949  16.203  16.203
   86   2HG2  THR  11          2HG2      THR  11  14.026  15.331  15.331
   87   3HG2  THR  11          1HG2      THR  11  12.381  15.720  15.720
   88    H    ASP  12           H        ASP  12  13.804  18.049  18.049
   89    HA   ASP  12           HA       ASP  12  11.122  19.233  19.233
   90   1HB   ASP  12          2HB       ASP  12  13.143  19.929  19.929
   91   2HB   ASP  12          1HB       ASP  12  11.547  20.635  20.635
   92    HA   PRO  13           HA       PRO  13   9.809  15.809  15.809
   93   1HB   PRO  13          2HB       PRO  13   8.412  17.796  17.796
   94   2HB   PRO  13          1HB       PRO  13   7.769  16.371  16.371
   95   1HG   PRO  13          2HG       PRO  13   7.283  18.816  18.816
   96   2HG   PRO  13          1HG       PRO  13   7.597  17.464  17.464
   97   1HD   PRO  13          2HD       PRO  13   9.393  19.708  19.708
   98   2HD   PRO  13          1HD       PRO  13   9.237  18.896  18.896
   99    H    MET  14           H        MET  14  11.017  18.666  18.666
  100    HA   MET  14           HA       MET  14  11.555  17.255  17.255
  101   1HB   MET  14          2HB       MET  14  12.431  19.986  19.986
  102   2HB   MET  14          1HB       MET  14  12.697  19.359  19.359
  103   1HG   MET  14          2HG       MET  14  10.814  20.570  20.570
  104   2HG   MET  14          1HG       MET  14  10.089  19.022  19.022
  105   1HE   MET  14          1HE       MET  14   8.887  21.814  21.814
  106   2HE   MET  14          3HE       MET  14   7.656  20.858  20.858
  107   3HE   MET  14          2HE       MET  14   8.200  22.384  22.384
  108    H    SER  15           H        SER  15  13.314  18.064  18.064
  109    HA   SER  15           HA       SER  15  15.936  17.727  17.727
  110   1HB   SER  15          2HB       SER  15  15.267  18.622  18.622
  111   2HB   SER  15          1HB       SER  15  14.873  16.976  16.976
  112    HG   SER  15           HG       SER  15  17.420  17.865  17.865
  113    H    ALA  16           H        ALA  16  13.526  15.368  15.368
  114    HA   ALA  16           HA       ALA  16  15.290  13.244  13.244
  115   1HB   ALA  16          1HB       ALA  16  14.566  13.590  13.590
  116   2HB   ALA  16          3HB       ALA  16  13.637  12.215  12.215
  117   3HB   ALA  16          2HB       ALA  16  15.394  12.215  12.215
  118    H    ILE  17           H        ILE  17  14.144  13.146  13.146
  119    HA   ILE  17           HA       ILE  17  11.294  12.464  12.464
  120    HB   ILE  17           HB       ILE  17  12.881  13.126  13.126
  121   1HG1  ILE  17          2HG1      ILE  17  10.957  15.006  15.006
  122   2HG1  ILE  17          1HG1      ILE  17  12.638  14.945  14.945
  123   1HG2  ILE  17          2HG2      ILE  17  10.754  11.802  11.802
  124   2HG2  ILE  17          1HG2      ILE  17   9.902  13.207  13.207
  125   3HG2  ILE  17          3HG2      ILE  17  10.789  13.333  13.333
  126   1HD1  ILE  17          1HD1      ILE  17  11.750  15.473  15.473
  127   2HD1  ILE  17          3HD1      ILE  17  12.163  16.720  16.720
  128   3HD1  ILE  17          2HD1      ILE  17  13.391  15.575  15.575
  129    H    GLN  18           H        GLN  18  10.867  10.361  10.361
  130    HA   GLN  18           HA       GLN  18  12.130   8.575   8.575
  131   1HB   GLN  18          2HB       GLN  18  12.652   6.889   6.889
  132   2HB   GLN  18          1HB       GLN  18  13.588   8.364   8.364
  133   1HG   GLN  18          2HG       GLN  18  11.601   8.982   8.982
  134   2HG   GLN  18          1HG       GLN  18  11.437   7.229   7.229
  135   1HE2  GLN  18          2HE2      GLN  18  14.128   9.019   9.019
  136   2HE2  GLN  18          1HE2      GLN  18  12.775   9.780   9.780
  137    H    ASN  19           H        ASN  19   9.710   9.241   9.241
  138    HA   ASN  19           HA       ASN  19   7.843   7.465   7.465
  139   1HB   ASN  19          2HB       ASN  19   7.369   9.606   9.606
  140   2HB   ASN  19          1HB       ASN  19   6.104   8.658   8.658
  141   1HD2  ASN  19          2HD2      ASN  19   5.787  10.978  10.978
  142   2HD2  ASN  19          1HD2      ASN  19   5.071   9.877   9.877
  143    H    LEU  20           H        LEU  20   9.752   7.548   7.548
  144    HA   LEU  20           HA       LEU  20   8.256   6.248   6.248
  145   1HB   LEU  20          2HB       LEU  20  11.159   6.293   6.293
  146   2HB   LEU  20          1HB       LEU  20  10.599   5.127   5.127
  147    HG   LEU  20           HG       LEU  20  10.240   8.119   8.119
  148   1HD1  LEU  20          1HD1      LEU  20  12.569   6.898   6.898
  149   2HD1  LEU  20          3HD1      LEU  20  11.882   6.559   6.559
  150   3HD1  LEU  20          2HD1      LEU  20  12.054   8.226   8.226
  151   1HD2  LEU  20          2HD2      LEU  20   8.964   5.913   5.913
  152   2HD2  LEU  20          1HD2      LEU  20   8.625   7.640   7.640
  153   3HD2  LEU  20          3HD2      LEU  20   9.860   6.928   6.928
  154    H    HIS  21           H        HIS  21  10.169   4.779   4.779
  155    HA   HIS  21           HA       HIS  21   9.363   2.114   2.114
  156   1HB   HIS  21          2HB       HIS  21  11.541   2.680   2.680
  157   2HB   HIS  21          1HB       HIS  21  10.639   3.062   3.062
  158    HD1  HIS  21           HD1      HIS  21   9.904   0.085   0.085
  159    HD2  HIS  21           HD2      HIS  21  11.558   0.952   0.952
  160    HE1  HIS  21           HE1      HIS  21  10.211  -2.137  -2.137
  161    HE2  HIS  21           HE2      HIS  21  11.126  -1.581  -1.581
  162    H    SER  22           H        SER  22   7.689   0.957   0.957
  163    HA   SER  22           HA       SER  22   6.412   1.310   1.310
  164   1HB   SER  22          2HB       SER  22   5.349   2.919   2.919
  165   2HB   SER  22          1HB       SER  22   4.168   2.100   2.100
  166    HG   SER  22           HG       SER  22   4.531   4.054   4.054
  167    H    PHE  23           H        PHE  23   6.797  -0.972  -0.972
  168    HA   PHE  23           HA       PHE  23   5.474  -2.481  -2.481
  169   1HB   PHE  23          2HB       PHE  23   6.161  -4.442  -4.442
  170   2HB   PHE  23          1HB       PHE  23   7.495  -3.304  -3.304
  171    HD1  PHE  23           HD2      PHE  23   8.238  -1.985  -1.985
  172    HD2  PHE  23           HD1      PHE  23   5.199  -4.942  -4.942
  173    HE1  PHE  23           HE2      PHE  23   8.525  -1.977  -1.977
  174    HE2  PHE  23           HE1      PHE  23   5.479  -4.939  -4.939
  175    HZ   PHE  23           HZ       PHE  23   7.145  -3.456  -3.456
  176    H    ASP  24           H        ASP  24   3.465  -3.263  -3.263
  177    HA   ASP  24           HA       ASP  24   1.476  -2.397  -2.397
  178   1HB   ASP  24          2HB       ASP  24   1.615  -4.401  -4.401
  179   2HB   ASP  24          1HB       ASP  24   0.219  -4.453  -4.453
  180    HA   PRO  25           HA       PRO  25   1.471  -5.027  -5.027
  181   1HB   PRO  25          2HB       PRO  25  -1.398  -5.569  -5.569
  182   2HB   PRO  25          1HB       PRO  25  -0.648  -4.987  -4.987
  183   1HG   PRO  25          2HG       PRO  25  -1.996  -3.320  -3.320
  184   2HG   PRO  25          1HG       PRO  25  -0.507  -2.802  -2.802
  185   1HD   PRO  25          2HD       PRO  25  -0.949  -3.545  -3.545
  186   2HD   PRO  25          1HD       PRO  25   0.117  -2.306  -2.306
  187    H    PHE  26           H        PHE  26   0.087  -6.190  -6.190
  188    HA   PHE  26           HA       PHE  26   0.641  -8.958  -8.958
  189   1HB   PHE  26          2HB       PHE  26  -0.822  -9.111  -9.111
  190   2HB   PHE  26          1HB       PHE  26  -1.439  -9.368  -9.368
  191    HD1  PHE  26           HD2      PHE  26  -2.333  -7.319  -7.319
  192    HD2  PHE  26           HD1      PHE  26  -1.664  -7.403  -7.403
  193    HE1  PHE  26           HE2      PHE  26  -3.860  -5.409  -5.409
  194    HE2  PHE  26           HE1      PHE  26  -3.189  -5.493  -5.493
  195    HZ   PHE  26           HZ       PHE  26  -4.291  -4.495  -4.495
  196    H    ALA  27           H        ALA  27   2.644  -7.097  -7.097
  197    HA   ALA  27           HA       ALA  27   3.325  -8.148  -8.148
  198   1HB   ALA  27          3HB       ALA  27   3.326  -5.659  -5.659
  199   2HB   ALA  27          2HB       ALA  27   4.757  -5.943  -5.943
  200   3HB   ALA  27          1HB       ALA  27   4.789  -6.316  -6.316
  201    H    ASP  28           H        ASP  28   3.721 -10.225 -10.225
  202    HA   ASP  28           HA       ASP  28   6.576 -10.390 -10.390
  203   1HB   ASP  28          2HB       ASP  28   4.434 -10.873 -10.873
  204   2HB   ASP  28          1HB       ASP  28   5.797 -11.988 -11.988
  205    H    ALA  29           H        ALA  29   3.500 -12.123 -12.123
  206    HA   ALA  29           HA       ALA  29   4.329 -14.708 -14.708
  207   1HB   ALA  29          1HB       ALA  29   1.964 -13.481 -13.481
  208   2HB   ALA  29          3HB       ALA  29   2.308 -13.817 -13.817
  209   3HB   ALA  29          2HB       ALA  29   2.255 -15.138 -15.138
  210    H    SER  30           H        SER  30   5.933 -15.501 -15.501
  211    HA   SER  30           HA       SER  30   6.697 -14.245 -14.245
  212   1HB   SER  30          2HB       SER  30   8.014 -16.750 -16.750
  213   2HB   SER  30          1HB       SER  30   8.725 -15.289 -15.289
  214    HG   SER  30           HG       SER  30   8.089 -14.294 -14.294
  215    H    LYS  31           H        LYS  31   7.636 -16.329 -16.329
  216    HA   LYS  31           HA       LYS  31   5.249 -17.294 -17.294
  217   1HB   LYS  31          2HB       LYS  31   7.311 -16.724 -16.724
  218   2HB   LYS  31          1HB       LYS  31   8.111 -18.109 -18.109
  219   1HG   LYS  31          2HG       LYS  31   6.782 -19.639 -19.639
  220   2HG   LYS  31          1HG       LYS  31   5.590 -18.408 -18.408
  221   1HD   LYS  31          2HD       LYS  31   7.920 -17.416 -17.416
  222   2HD   LYS  31          1HD       LYS  31   8.075 -19.155 -19.155
  223   1HE   LYS  31          2HE       LYS  31   5.894 -19.197 -19.197
  224   2HE   LYS  31          1HE       LYS  31   5.708 -17.467 -17.467
  225   1HZ   LYS  31          1HZ       LYS  31   8.028 -17.487 -17.487
  226   2HZ   LYS  31          3HZ       LYS  31   7.327 -18.860 -18.860
  227   3HZ   LYS  31          2HZ       LYS  31   6.543 -17.365 -17.365
  228    H    GLY  32           H        GLY  32   8.049 -19.175 -19.175
  229   1HA   GLY  32          2HA       GLY  32   6.248 -21.431 -21.431
  230   2HA   GLY  32          1HA       GLY  32   8.002 -21.502 -21.502
  231    H    ASP  33           H        ASP  33   5.479 -19.864 -19.864
  232    HA   ASP  33           HA       ASP  33   6.608 -20.974 -20.974
  233   1HB   ASP  33          2HB       ASP  33   7.867 -18.843 -18.843
  234   2HB   ASP  33          1HB       ASP  33   6.340 -17.977 -17.977
  235    H    ASP  34           H        ASP  34   4.184 -21.526 -21.526
  236    HA   ASP  34           HA       ASP  34   2.050 -19.944 -19.944
  237   1HB   ASP  34          2HB       ASP  34   2.322 -22.593 -22.593
  238   2HB   ASP  34          1HB       ASP  34   0.842 -22.306 -22.306
  239    H    LEU  35           H        LEU  35   2.981 -19.761 -19.761
  240    HA   LEU  35           HA       LEU  35   2.242 -22.067 -22.067
  241   1HB   LEU  35          2HB       LEU  35   4.558 -20.439 -20.439
  242   2HB   LEU  35          1HB       LEU  35   3.711 -20.074 -20.074
  243    HG   LEU  35           HG       LEU  35   5.406 -21.842 -21.842
  244   1HD1  LEU  35          2HD1      LEU  35   3.082 -21.694 -21.694
  245   2HD1  LEU  35          1HD1      LEU  35   2.788 -23.210 -23.210
  246   3HD1  LEU  35          3HD1      LEU  35   4.153 -23.072 -23.072
  247   1HD2  LEU  35          3HD2      LEU  35   4.462 -22.764 -22.764
  248   2HD2  LEU  35          2HD2      LEU  35   5.591 -23.596 -23.596
  249   3HD2  LEU  35          1HD2      LEU  35   3.866 -23.949 -23.949
  250    H    LEU  36           H        LEU  36   0.001 -21.373 -21.373
  251    HA   LEU  36           HA       LEU  36  -1.876 -20.438 -20.438
  252   1HB   LEU  36          2HB       LEU  36  -0.103 -19.263 -19.263
  253   2HB   LEU  36          1HB       LEU  36  -1.822 -19.593 -19.593
  254    HG   LEU  36           HG       LEU  36   0.186 -21.799 -21.799
  255   1HD1  LEU  36          2HD1      LEU  36  -0.511 -20.286 -20.286
  256   2HD1  LEU  36          1HD1      LEU  36  -0.377 -22.039 -22.039
  257   3HD1  LEU  36          3HD1      LEU  36   0.992 -21.091 -21.091
  258   1HD2  LEU  36          1HD2      LEU  36  -2.706 -21.592 -21.592
  259   2HD2  LEU  36          3HD2      LEU  36  -1.903 -22.666 -22.666
  260   3HD2  LEU  36          2HD2      LEU  36  -1.757 -22.958 -22.958
  261    HA   PRO  37           HA       PRO  37  -1.739 -16.518 -16.518
  262   1HB   PRO  37          2HB       PRO  37  -4.449 -16.276 -16.276
  263   2HB   PRO  37          1HB       PRO  37  -3.946 -16.076 -16.076
  264   1HG   PRO  37          2HG       PRO  37  -5.239 -18.270 -18.270
  265   2HG   PRO  37          1HG       PRO  37  -3.914 -18.361 -18.361
  266   1HD   PRO  37          2HD       PRO  37  -3.931 -19.077 -19.077
  267   2HD   PRO  37          1HD       PRO  37  -3.089 -19.862 -19.862
  268    H    ALA  38           H        ALA  38  -0.173 -15.616 -15.616
  269    HA   ALA  38           HA       ALA  38   0.571 -14.027 -14.027
  270   1HB   ALA  38          2HB       ALA  38  -1.070 -12.605 -12.605
  271   2HB   ALA  38          1HB       ALA  38  -2.300 -13.103 -13.103
  272   3HB   ALA  38          3HB       ALA  38  -0.900 -12.177 -12.177
  273    H    GLY  39           H        GLY  39   1.138 -14.248 -14.248
  274   1HA   GLY  39          2HA       GLY  39  -0.482 -15.935 -15.935
  275   2HA   GLY  39          1HA       GLY  39   1.139 -15.348 -15.348
  276    H    THR  40           H        THR  40   1.282 -13.924 -13.924
  277    HA   THR  40           HA       THR  40  -0.418 -11.683 -11.683
  278    HB   THR  40           HB       THR  40  -1.120 -12.575 -12.575
  279    HG1  THR  40           HG1      THR  40  -1.319 -14.673 -14.673
  280   1HG2  THR  40          3HG2      THR  40  -2.489 -11.981 -11.981
  281   2HG2  THR  40          2HG2      THR  40  -2.983 -13.641 -13.641
  282   3HG2  THR  40          1HG2      THR  40  -3.209 -12.395 -12.395
  283    H    GLU  41           H        GLU  41   1.827 -13.909 -13.909
  284    HA   GLU  41           HA       GLU  41   3.720 -13.552 -13.552
  285   1HB   GLU  41          2HB       GLU  41   3.378 -11.083 -11.083
  286   2HB   GLU  41          1HB       GLU  41   4.217 -10.827 -10.827
  287   1HG   GLU  41          2HG       GLU  41   6.015 -12.107 -12.107
  288   2HG   GLU  41          1HG       GLU  41   5.079 -13.063 -13.063
  289    H    ASP  42           H        ASP  42   0.811 -12.841 -12.841
  290    HA   ASP  42           HA       ASP  42  -0.189 -12.194 -12.194
  291   1HB   ASP  42          2HB       ASP  42   1.824 -13.897 -13.897
  292   2HB   ASP  42          1HB       ASP  42   2.276 -12.491 -12.491
  293    H    TYR  43           H        TYR  43   0.180 -10.011 -10.011
  294    HA   TYR  43           HA       TYR  43   2.009  -8.132  -8.132
  295   1HB   TYR  43          2HB       TYR  43  -0.726  -7.694  -7.694
  296   2HB   TYR  43          1HB       TYR  43   0.473  -6.433  -6.433
  297    HD1  TYR  43           HD1      TYR  43   2.719  -8.666  -8.666
  298    HD2  TYR  43           HD2      TYR  43  -0.710  -6.970  -6.970
  299    HE1  TYR  43           HE1      TYR  43   3.688  -9.144  -9.144
  300    HE2  TYR  43           HE2      TYR  43   0.252  -7.443  -7.443
  301    HH   TYR  43           HH       TYR  43   3.427  -8.163  -8.163
  302    H    ILE  44           H        ILE  44   1.524  -6.188  -6.188
  303    HA   ILE  44           HA       ILE  44  -0.265  -6.828  -6.828
  304    HB   ILE  44           HB       ILE  44   2.220  -5.106  -5.106
  305   1HG1  ILE  44          2HG1      ILE  44   2.796  -7.442  -7.442
  306   2HG1  ILE  44          1HG1      ILE  44   3.072  -6.863  -6.863
  307   1HG2  ILE  44          3HG2      ILE  44   0.361  -4.353  -4.353
  308   2HG2  ILE  44          2HG2      ILE  44   0.563  -5.883  -5.883
  309   3HG2  ILE  44          1HG2      ILE  44   1.895  -4.729  -4.729
  310   1HD1  ILE  44          2HD1      ILE  44   0.698  -7.764  -7.764
  311   2HD1  ILE  44          1HD1      ILE  44   0.953  -8.691  -8.691
  312   3HD1  ILE  44          3HD1      ILE  44   2.047  -8.892  -8.892
  313    H    HIS  45           H        HIS  45  -2.108  -5.906  -5.906
  314    HA   HIS  45           HA       HIS  45  -2.273  -3.376  -3.376
  315   1HB   HIS  45          2HB       HIS  45  -4.013  -5.517  -5.517
  316   2HB   HIS  45          1HB       HIS  45  -4.735  -4.076  -4.076
  317    HD1  HIS  45           HD1      HIS  45  -3.909  -5.676  -5.676
  318    HD2  HIS  45           HD2      HIS  45  -5.568  -2.134  -2.134
  319    HE1  HIS  45           HE1      HIS  45  -4.972  -4.595  -4.595
  320    HE2  HIS  45           HE2      HIS  45  -6.065  -2.507  -2.507
  321    H    ILE  46           H        ILE  46  -1.871  -1.496  -1.496
  322    HA   ILE  46           HA       ILE  46  -2.043  -1.080  -1.080
  323    HB   ILE  46           HB       ILE  46  -1.521   0.940   0.940
  324   1HG1  ILE  46          2HG1      ILE  46   0.127  -0.935  -0.935
  325   2HG1  ILE  46          1HG1      ILE  46   0.824   0.644   0.644
  326   1HG2  ILE  46          2HG2      ILE  46  -1.276   1.082   1.082
  327   2HG2  ILE  46          1HG2      ILE  46  -0.439   2.198   2.198
  328   3HG2  ILE  46          3HG2      ILE  46  -2.202   2.130   2.130
  329   1HD1  ILE  46          2HD1      ILE  46   0.139  -0.236  -0.236
  330   2HD1  ILE  46          1HD1      ILE  46   0.618  -1.727  -1.727
  331   3HD1  ILE  46          3HD1      ILE  46   1.739  -0.367  -0.367
  332    H    ARG  47           H        ARG  47  -3.236   1.486   1.486
  333    HA   ARG  47           HA       ARG  47  -5.340   2.289   2.289
  334   1HB   ARG  47          2HB       ARG  47  -6.008  -0.243  -0.243
  335   2HB   ARG  47          1HB       ARG  47  -6.683   0.466   0.466
  336   1HG   ARG  47          2HG       ARG  47  -8.402   1.362   1.362
  337   2HG   ARG  47          1HG       ARG  47  -7.375   1.949   1.949
  338   1HD   ARG  47          2HD       ARG  47  -7.369  -0.265  -0.265
  339   2HD   ARG  47          1HD       ARG  47  -8.341  -0.892  -0.892
  340    HE   ARG  47           HE       ARG  47  -9.711   1.256   1.256
  341   1HH1  ARG  47          2HH1      ARG  47  -8.708  -1.982  -1.982
  342   2HH1  ARG  47          1HH1      ARG  47 -10.026  -2.243  -2.243
  343   1HH2  ARG  47          1HH2      ARG  47 -11.445   0.913   0.913
  344   2HH2  ARG  47          2HH2      ARG  47 -11.579  -0.600  -0.600
  345    H    ILE  48           H        ILE  48  -6.252   4.029   4.029
  346    HA   ILE  48           HA       ILE  48  -5.885   4.518   4.518
  347    HB   ILE  48           HB       ILE  48  -5.606   6.309   6.309
  348   1HG1  ILE  48          2HG1      ILE  48  -4.147   6.100   6.100
  349   2HG1  ILE  48          1HG1      ILE  48  -3.616   5.414   5.414
  350   1HG2  ILE  48          2HG2      ILE  48  -6.536   7.233   7.233
  351   2HG2  ILE  48          1HG2      ILE  48  -5.801   8.297   8.297
  352   3HG2  ILE  48          3HG2      ILE  48  -7.325   7.484   7.484
  353   1HD1  ILE  48          3HD1      ILE  48  -4.007   8.354   8.354
  354   2HD1  ILE  48          2HD1      ILE  48  -2.460   7.509   7.509
  355   3HD1  ILE  48          1HD1      ILE  48  -3.308   7.601   7.601
  356    H    GLN  49           H        GLN  49  -7.574   5.716   5.716
  357    HA   GLN  49           HA       GLN  49 -10.129   5.839   5.839
  358   1HB   GLN  49          2HB       GLN  49 -11.313   4.775   4.775
  359   2HB   GLN  49          1HB       GLN  49 -10.097   3.692   3.692
  360   1HG   GLN  49          2HG       GLN  49  -8.783   5.036   5.036
  361   2HG   GLN  49          1HG       GLN  49 -10.395   4.729   4.729
  362   1HE2  GLN  49          2HE2      GLN  49  -9.524   1.515   1.515
  363   2HE2  GLN  49          1HE2      GLN  49 -10.327   3.001   3.001
  364    H    GLN  50           H        GLN  50 -10.447   7.973   7.973
  365    HA   GLN  50           HA       GLN  50 -10.106   9.415   9.415
  366   1HB   GLN  50          2HB       GLN  50  -9.271  10.044  10.044
  367   2HB   GLN  50          1HB       GLN  50 -10.682  11.066  11.066
  368   1HG   GLN  50          2HG       GLN  50  -9.686  11.963  11.963
  369   2HG   GLN  50          1HG       GLN  50  -8.285  10.921  10.921
  370   1HE2  GLN  50          2HE2      GLN  50  -6.672  13.463  13.463
  371   2HE2  GLN  50          1HE2      GLN  50  -6.678  12.271  12.271
  372    H    ARG  51           H        ARG  51 -11.971   9.196   9.196
  373    HA   ARG  51           HA       ARG  51 -14.524   8.894   8.894
  374   1HB   ARG  51          2HB       ARG  51 -13.413   9.778   9.778
  375   2HB   ARG  51          1HB       ARG  51 -15.124  10.064  10.064
  376   1HG   ARG  51          2HG       ARG  51 -15.191   8.007   8.007
  377   2HG   ARG  51          1HG       ARG  51 -15.117   7.545   7.545
  378   1HD   ARG  51          2HD       ARG  51 -12.544   7.553   7.553
  379   2HD   ARG  51          1HD       ARG  51 -12.984   7.428   7.428
  380    HE   ARG  51           HE       ARG  51 -13.195   5.378   5.378
  381   1HH1  ARG  51          2HH1      ARG  51 -14.417   6.518   6.518
  382   2HH1  ARG  51          1HH1      ARG  51 -14.952   4.953   4.953
  383   1HH2  ARG  51          1HH2      ARG  51 -13.900   3.318   3.318
  384   2HH2  ARG  51          2HH2      ARG  51 -14.660   3.136   3.136
  385    H    ASN  52           H        ASN  52 -13.761  11.872  11.872
  386    HA   ASN  52           HA       ASN  52 -15.513  13.334  13.334
  387   1HB   ASN  52          2HB       ASN  52 -14.178  14.314  14.314
  388   2HB   ASN  52          1HB       ASN  52 -15.495  15.094  15.094
  389   1HD2  ASN  52          2HD2      ASN  52 -16.501  12.868  12.868
  390   2HD2  ASN  52          1HD2      ASN  52 -15.094  13.849  13.849
  391    H    GLY  53           H        GLY  53 -13.169  12.591  12.591
  392   1HA   GLY  53          2HA       GLY  53 -11.442  13.437  13.437
  393   2HA   GLY  53          1HA       GLY  53 -12.250  14.988  14.988
  394    H    ARG  54           H        ARG  54 -11.216  13.289  13.289
  395    HA   ARG  54           HA       ARG  54  -8.712  14.738  14.738
  396   1HB   ARG  54          2HB       ARG  54  -9.223  15.996  15.996
  397   2HB   ARG  54          1HB       ARG  54 -10.565  16.262  16.262
  398   1HG   ARG  54          2HG       ARG  54 -11.907  14.633  14.633
  399   2HG   ARG  54          1HG       ARG  54 -10.561  14.365  14.365
  400   1HD   ARG  54          2HD       ARG  54 -12.085  16.932  16.932
  401   2HD   ARG  54          1HD       ARG  54 -12.140  15.887  15.887
  402    HE   ARG  54           HE       ARG  54  -9.496  16.608  16.608
  403   1HH1  ARG  54          2HH1      ARG  54 -12.527  18.247  18.247
  404   2HH1  ARG  54          1HH1      ARG  54 -11.803  19.561  19.561
  405   1HH2  ARG  54          1HH2      ARG  54  -8.542  18.335  18.335
  406   2HH2  ARG  54          2HH2      ARG  54  -9.540  19.610  19.610
  407    H    LYS  55           H        LYS  55 -11.057  12.704  12.704
  408    HA   LYS  55           HA       LYS  55  -9.121  11.561  11.561
  409   1HB   LYS  55          2HB       LYS  55 -11.816  11.648  11.648
  410   2HB   LYS  55          1HB       LYS  55 -11.583  10.030  10.030
  411   1HG   LYS  55          2HG       LYS  55 -11.824   9.923   9.923
  412   2HG   LYS  55          1HG       LYS  55 -10.173   9.486   9.486
  413   1HD   LYS  55          2HD       LYS  55 -10.274  10.979  10.979
  414   2HD   LYS  55          1HD       LYS  55  -9.383  11.687  11.687
  415   1HE   LYS  55          2HE       LYS  55 -11.086  13.194  13.194
  416   2HE   LYS  55          1HE       LYS  55 -12.303  12.247  12.247
  417   1HZ   LYS  55          1HZ       LYS  55 -10.074  13.365  13.365
  418   2HZ   LYS  55          3HZ       LYS  55 -11.307  14.411  14.411
  419   3HZ   LYS  55          2HZ       LYS  55 -11.672  13.075  13.075
  420    H    THR  56           H        THR  56  -7.632  11.225  11.225
  421    HA   THR  56           HA       THR  56  -8.151   9.023   9.023
  422    HB   THR  56           HB       THR  56  -5.340   9.753   9.753
  423    HG1  THR  56           HG1      THR  56  -5.860  11.787  11.787
  424   1HG2  THR  56          1HG2      THR  56  -7.123   9.119   9.119
  425   2HG2  THR  56          3HG2      THR  56  -6.077  10.495  10.495
  426   3HG2  THR  56          2HG2      THR  56  -5.369   8.949   8.949
  427    H    LEU  57           H        LEU  57  -7.493   6.929   6.929
  428    HA   LEU  57           HA       LEU  57  -5.849   6.091   6.091
  429   1HB   LEU  57          2HB       LEU  57  -8.702   5.618   5.618
  430   2HB   LEU  57          1HB       LEU  57  -7.804   4.117   4.117
  431    HG   LEU  57           HG       LEU  57  -6.707   5.121   5.121
  432   1HD1  LEU  57          2HD1      LEU  57  -8.669   7.216   7.216
  433   2HD1  LEU  57          1HD1      LEU  57  -8.549   6.775   6.775
  434   3HD1  LEU  57          3HD1      LEU  57  -7.121   7.335   7.335
  435   1HD2  LEU  57          2HD2      LEU  57  -9.410   4.036   4.036
  436   2HD2  LEU  57          1HD2      LEU  57  -8.097   3.510   3.510
  437   3HD2  LEU  57          3HD2      LEU  57  -9.133   4.852   4.852
  438    H    THR  58           H        THR  58  -4.185   5.400   5.400
  439    HA   THR  58           HA       THR  58  -4.578   3.917   3.917
  440    HB   THR  58           HB       THR  58  -1.978   3.757   3.757
  441    HG1  THR  58           HG1      THR  58  -3.179   6.165   6.165
  442   1HG2  THR  58          2HG2      THR  58  -2.740   3.299   3.299
  443   2HG2  THR  58          1HG2      THR  58  -2.100   4.939   4.939
  444   3HG2  THR  58          3HG2      THR  58  -1.092   3.633   3.633
  445    H    THR  59           H        THR  59  -5.163   1.854   1.854
  446    HA   THR  59           HA       THR  59  -4.678   0.091   0.091
  447    HB   THR  59           HB       THR  59  -6.156  -1.421  -1.421
  448    HG1  THR  59           HG1      THR  59  -7.046  -0.205  -0.205
  449   1HG2  THR  59          2HG2      THR  59  -7.176   0.586   0.586
  450   2HG2  THR  59          1HG2      THR  59  -8.169  -0.658  -0.658
  451   3HG2  THR  59          3HG2      THR  59  -6.817  -1.118  -1.118
  452    H    VAL  60           H        VAL  60  -3.774  -2.008  -2.008
  453    HA   VAL  60           HA       VAL  60  -2.149  -2.268  -2.268
  454    HB   VAL  60           HB       VAL  60  -1.365  -3.100  -3.100
  455   1HG1  VAL  60          1HG1      VAL  60  -0.568  -4.590  -4.590
  456   2HG1  VAL  60          3HG1      VAL  60   0.307  -3.198  -3.198
  457   3HG1  VAL  60          2HG1      VAL  60   0.710  -3.839  -3.839
  458   1HG2  VAL  60          1HG2      VAL  60  -0.648  -0.786  -0.786
  459   2HG2  VAL  60          3HG2      VAL  60  -1.070  -0.802  -0.802
  460   3HG2  VAL  60          2HG2      VAL  60   0.506  -1.394  -1.394
  461    H    GLN  61           H        GLN  61  -2.734  -3.925  -3.925
  462    HA   GLN  61           HA       GLN  61  -3.888  -6.292  -6.292
  463   1HB   GLN  61          2HB       GLN  61  -5.165  -4.728  -4.728
  464   2HB   GLN  61          1HB       GLN  61  -4.372  -5.836  -5.836
  465   1HG   GLN  61          2HG       GLN  61  -5.414  -7.546  -7.546
  466   2HG   GLN  61          1HG       GLN  61  -6.626  -6.266  -6.266
  467   1HE2  GLN  61          2HE2      GLN  61  -6.937  -6.797  -6.797
  468   2HE2  GLN  61          1HE2      GLN  61  -6.344  -5.516  -5.516
  469    H    GLY  62           H        GLY  62  -3.359  -8.355  -8.355
  470   1HA   GLY  62          2HA       GLY  62  -2.126  -9.773  -9.773
  471   2HA   GLY  62          1HA       GLY  62  -1.040  -8.425  -8.425
  472    H    ILE  63           H        ILE  63  -0.860  -7.727  -7.727
  473    HA   ILE  63           HA       ILE  63   1.432  -9.183  -9.183
  474    HB   ILE  63           HB       ILE  63  -0.358  -7.402  -7.402
  475   1HG1  ILE  63          2HG1      ILE  63   0.710  -5.996  -5.996
  476   2HG1  ILE  63          1HG1      ILE  63   1.892  -6.024  -6.024
  477   1HG2  ILE  63          3HG2      ILE  63   1.888  -9.076  -9.076
  478   2HG2  ILE  63          2HG2      ILE  63   1.985  -7.390  -7.390
  479   3HG2  ILE  63          1HG2      ILE  63   0.580  -8.364  -8.364
  480   1HD1  ILE  63          2HD1      ILE  63   3.128  -7.772  -7.772
  481   2HD1  ILE  63          1HD1      ILE  63   1.984  -7.573  -7.573
  482   3HD1  ILE  63          3HD1      ILE  63   3.021  -6.229  -6.229
  483    H    ALA  64           H        ALA  64   1.833 -10.727 -10.727
  484    HA   ALA  64           HA       ALA  64  -0.365 -12.576 -12.576
  485   1HB   ALA  64          1HB       ALA  64   2.538 -12.740 -12.740
  486   2HB   ALA  64          3HB       ALA  64   1.836 -13.691 -13.691
  487   3HB   ALA  64          2HB       ALA  64   1.321 -13.965 -13.965
  488    H    ASP  65           H        ASP  65  -1.375 -12.972 -12.972
  489    HA   ASP  65           HA       ASP  65  -1.250 -11.181 -11.181
  490   1HB   ASP  65          2HB       ASP  65  -3.119 -12.843 -12.843
  491   2HB   ASP  65          1HB       ASP  65  -2.219 -14.015 -14.015
  492    H    ASP  66           H        ASP  66   0.678 -13.936 -13.936
  493    HA   ASP  66           HA       ASP  66   1.553 -14.685 -14.685
  494   1HB   ASP  66          2HB       ASP  66   2.912 -14.819 -14.819
  495   2HB   ASP  66          1HB       ASP  66   3.606 -15.517 -15.517
  496    H    TYR  67           H        TYR  67   2.362 -11.977 -11.977
  497    HA   TYR  67           HA       TYR  67   4.834 -11.205 -11.205
  498   1HB   TYR  67          2HB       TYR  67   2.461  -9.528  -9.528
  499   2HB   TYR  67          1HB       TYR  67   4.054  -8.858  -8.858
  500    HD1  TYR  67           HD2      TYR  67   4.123 -12.111 -12.111
  501    HD2  TYR  67           HD1      TYR  67   3.797  -7.939  -7.939
  502    HE1  TYR  67           HE2      TYR  67   4.759 -12.488 -12.488
  503    HE2  TYR  67           HE1      TYR  67   4.426  -8.300  -8.300
  504    HH   TYR  67           HH       TYR  67   4.204 -10.571 -10.571
  505    H    ASP  68           H        ASP  68   4.900  -8.914  -8.914
  506    HA   ASP  68           HA       ASP  68   3.801  -9.531  -9.531
  507   1HB   ASP  68          2HB       ASP  68   5.982  -7.651  -7.651
  508   2HB   ASP  68          1HB       ASP  68   5.380  -7.687  -7.687
  509    H    LYS  69           H        LYS  69   1.647  -8.905  -8.905
  510    HA   LYS  69           HA       LYS  69   0.656  -6.674  -6.674
  511   1HB   LYS  69          2HB       LYS  69  -0.285  -8.080  -8.080
  512   2HB   LYS  69          1HB       LYS  69  -1.208  -6.790  -6.790
  513   1HG   LYS  69          2HG       LYS  69  -1.573  -8.056  -8.056
  514   2HG   LYS  69          1HG       LYS  69  -0.343  -9.240  -9.240
  515   1HD   LYS  69          2HD       LYS  69  -2.016 -10.467 -10.467
  516   2HD   LYS  69          1HD       LYS  69  -2.094  -9.289  -9.289
  517   1HE   LYS  69          2HE       LYS  69  -3.830  -8.084  -8.084
  518   2HE   LYS  69          1HE       LYS  69  -3.590  -8.932  -8.932
  519   1HZ   LYS  69          3HZ       LYS  69  -4.397 -10.384 -10.384
  520   2HZ   LYS  69          2HZ       LYS  69  -5.545  -9.624  -9.624
  521   3HZ   LYS  69          1HZ       LYS  69  -4.571 -10.853 -10.853
  522    H    LYS  70           H        LYS  70   1.457  -6.821  -6.821
  523    HA   LYS  70           HA       LYS  70   0.987  -4.095  -4.095
  524   1HB   LYS  70          2HB       LYS  70   2.510  -6.241  -6.241
  525   2HB   LYS  70          1HB       LYS  70   2.612  -4.575  -4.575
  526   1HG   LYS  70          2HG       LYS  70  -0.120  -5.496  -5.496
  527   2HG   LYS  70          1HG       LYS  70   0.737  -6.393  -6.393
  528   1HD   LYS  70          2HD       LYS  70   1.083  -3.484  -3.484
  529   2HD   LYS  70          1HD       LYS  70  -0.576  -4.032  -4.032
  530   1HE   LYS  70          2HE       LYS  70   1.039  -5.776  -5.776
  531   2HE   LYS  70          1HE       LYS  70   1.674  -4.159  -4.159
  532   1HZ   LYS  70          1HZ       LYS  70  -1.214  -4.402  -4.402
  533   2HZ   LYS  70          3HZ       LYS  70  -0.381  -5.218  -5.218
  534   3HZ   LYS  70          2HZ       LYS  70  -0.163  -3.554  -3.554
  535    H    LYS  71           H        LYS  71   4.013  -5.844  -5.844
  536    HA   LYS  71           HA       LYS  71   5.722  -3.632  -3.632
  537   1HB   LYS  71          2HB       LYS  71   6.245  -6.177  -6.177
  538   2HB   LYS  71          1HB       LYS  71   6.273  -5.876  -5.876
  539   1HG   LYS  71          2HG       LYS  71   8.246  -4.814  -4.814
  540   2HG   LYS  71          1HG       LYS  71   7.852  -3.991  -3.991
  541   1HD   LYS  71          2HD       LYS  71   9.237  -5.398  -5.398
  542   2HD   LYS  71          1HD       LYS  71   8.085  -6.688  -6.688
  543   1HE   LYS  71          2HE       LYS  71   9.236  -6.919  -6.919
  544   2HE   LYS  71          1HE       LYS  71  10.497  -5.869  -5.869
  545   1HZ   LYS  71          2HZ       LYS  71  10.319  -7.680  -7.680
  546   2HZ   LYS  71          1HZ       LYS  71   9.900  -8.643  -8.643
  547   3HZ   LYS  71          3HZ       LYS  71  11.379  -7.823  -7.823
  548    H    LEU  72           H        LEU  72   3.888  -4.893  -4.893
  549    HA   LEU  72           HA       LEU  72   5.062  -3.377  -3.377
  550   1HB   LEU  72          2HB       LEU  72   2.351  -4.585  -4.585
  551   2HB   LEU  72          1HB       LEU  72   2.626  -3.520  -3.520
  552    HG   LEU  72           HG       LEU  72   3.698  -5.110  -5.110
  553   1HD1  LEU  72          2HD1      LEU  72   5.143  -5.758  -5.758
  554   2HD1  LEU  72          1HD1      LEU  72   5.402  -6.643  -6.643
  555   3HD1  LEU  72          3HD1      LEU  72   5.762  -4.917  -4.917
  556   1HD2  LEU  72          1HD2      LEU  72   1.798  -6.302  -6.302
  557   2HD2  LEU  72          3HD2      LEU  72   2.722  -7.119  -7.119
  558   3HD2  LEU  72          2HD2      LEU  72   3.208  -7.271  -7.271
  559    H    VAL  73           H        VAL  73   2.153  -2.615  -2.615
  560    HA   VAL  73           HA       VAL  73   1.989   0.052   0.052
  561    HB   VAL  73           HB       VAL  73   0.531  -1.520  -1.520
  562   1HG1  VAL  73          2HG1      VAL  73   0.648   1.469   1.469
  563   2HG1  VAL  73          1HG1      VAL  73  -0.816   0.642   0.642
  564   3HG1  VAL  73          3HG1      VAL  73   0.698   0.402   0.402
  565   1HG2  VAL  73          2HG2      VAL  73  -0.267   0.085   0.085
  566   2HG2  VAL  73          1HG2      VAL  73  -0.289  -1.669  -1.669
  567   3HG2  VAL  73          3HG2      VAL  73  -1.420  -0.670  -0.670
  568    H    LYS  74           H        LYS  74   3.091  -1.412  -1.412
  569    HA   LYS  74           HA       LYS  74   3.699   0.920   0.920
  570   1HB   LYS  74          2HB       LYS  74   4.923  -1.833  -1.833
  571   2HB   LYS  74          1HB       LYS  74   5.471  -0.549  -0.549
  572   1HG   LYS  74          2HG       LYS  74   2.570  -1.226  -1.226
  573   2HG   LYS  74          1HG       LYS  74   3.677  -2.252  -2.252
  574   1HD   LYS  74          2HD       LYS  74   4.468   0.103   0.103
  575   2HD   LYS  74          1HD       LYS  74   2.819   0.549   0.549
  576   1HE   LYS  74          2HE       LYS  74   1.879  -0.987  -0.987
  577   2HE   LYS  74          1HE       LYS  74   3.370  -1.918  -1.918
  578   1HZ   LYS  74          1HZ       LYS  74   3.389   0.865   0.865
  579   2HZ   LYS  74          3HZ       LYS  74   2.626  -0.289  -0.289
  580   3HZ   LYS  74          2HZ       LYS  74   4.261  -0.464  -0.464
  581    H    ALA  75           H        ALA  75   5.666  -0.969  -0.969
  582    HA   ALA  75           HA       ALA  75   7.985   0.646   0.646
  583   1HB   ALA  75          3HB       ALA  75   7.049  -1.266  -1.266
  584   2HB   ALA  75          2HB       ALA  75   8.614  -0.455  -0.455
  585   3HB   ALA  75          1HB       ALA  75   8.226  -1.567  -1.567
  586    H    PHE  76           H        PHE  76   5.276   0.560   0.560
  587    HA   PHE  76           HA       PHE  76   6.101   2.490   2.490
  588   1HB   PHE  76          2HB       PHE  76   3.918   1.106   1.106
  589   2HB   PHE  76          1HB       PHE  76   3.252   2.437   2.437
  590    HD1  PHE  76           HD1      PHE  76   4.781   1.544   1.544
  591    HD2  PHE  76           HD2      PHE  76   2.618   4.474   4.474
  592    HE1  PHE  76           HE1      PHE  76   4.384   2.806   2.806
  593    HE2  PHE  76           HE2      PHE  76   2.218   5.737   5.737
  594    HZ   PHE  76           HZ       PHE  76   3.103   4.903   4.903
  595    H    LYS  77           H        LYS  77   4.147   3.061   3.061
  596    HA   LYS  77           HA       LYS  77   4.136   5.853   5.853
  597   1HB   LYS  77          2HB       LYS  77   4.030   4.126   4.126
  598   2HB   LYS  77          1HB       LYS  77   3.505   5.801   5.801
  599   1HG   LYS  77          2HG       LYS  77   1.878   4.979   4.979
  600   2HG   LYS  77          1HG       LYS  77   2.251   3.359   3.359
  601   1HD   LYS  77          2HD       LYS  77   1.687   5.159   5.159
  602   2HD   LYS  77          1HD       LYS  77   0.356   5.129   5.129
  603   1HE   LYS  77          2HE       LYS  77  -0.012   2.852   2.852
  604   2HE   LYS  77          1HE       LYS  77   1.600   2.579   2.579
  605   1HZ   LYS  77          2HZ       LYS  77   0.764   4.094   4.094
  606   2HZ   LYS  77          1HZ       LYS  77  -0.778   3.700   3.700
  607   3HZ   LYS  77          3HZ       LYS  77   0.265   2.480   2.480
  608    H    LYS  78           H        LYS  78   6.677   3.705   3.705
  609    HA   LYS  78           HA       LYS  78   8.130   5.732   5.732
  610   1HB   LYS  78          2HB       LYS  78   8.062   3.201   3.201
  611   2HB   LYS  78          1HB       LYS  78   9.217   3.046   3.046
  612   1HG   LYS  78          2HG       LYS  78   9.911   5.114   5.114
  613   2HG   LYS  78          1HG       LYS  78   9.852   3.482   3.482
  614   1HD   LYS  78          2HD       LYS  78  11.252   3.859   3.859
  615   2HD   LYS  78          1HD       LYS  78  12.042   4.474   4.474
  616   1HE   LYS  78          2HE       LYS  78  10.924   1.741   1.741
  617   2HE   LYS  78          1HE       LYS  78  12.331   1.958   1.958
  618   1HZ   LYS  78          3HZ       LYS  78  12.441   3.132   3.132
  619   2HZ   LYS  78          2HZ       LYS  78  12.555   1.448   1.448
  620   3HZ   LYS  78          1HZ       LYS  78  13.671   2.424   2.424
  621    H    LYS  79           H        LYS  79   7.904   4.558   4.558
  622    HA   LYS  79           HA       LYS  79  10.543   5.570   5.570
  623   1HB   LYS  79          2HB       LYS  79   9.365   3.367   3.367
  624   2HB   LYS  79          1HB       LYS  79   8.638   4.466   4.466
  625   1HG   LYS  79          2HG       LYS  79  11.436   4.987   4.987
  626   2HG   LYS  79          1HG       LYS  79  11.185   3.253   3.253
  627   1HD   LYS  79          2HD       LYS  79  10.010   3.542   3.542
  628   2HD   LYS  79          1HD       LYS  79   9.709   5.251   5.251
  629   1HE   LYS  79          2HE       LYS  79  12.428   4.059   4.059
  630   2HE   LYS  79          1HE       LYS  79  11.429   4.847   4.847
  631   1HZ   LYS  79          2HZ       LYS  79  11.479   6.712   6.712
  632   2HZ   LYS  79          1HZ       LYS  79  13.000   6.011   6.011
  633   3HZ   LYS  79          3HZ       LYS  79  12.585   6.648   6.648
  634    H    PHE  80           H        PHE  80   7.126   6.283   6.283
  635    HA   PHE  80           HA       PHE  80   7.972   8.749   8.749
  636   1HB   PHE  80          2HB       PHE  80   5.259   7.521   7.521
  637   2HB   PHE  80          1HB       PHE  80   6.113   8.649   8.649
  638    HD1  PHE  80           HD2      PHE  80   5.801   5.153   5.153
  639    HD2  PHE  80           HD1      PHE  80   7.741   7.883   7.883
  640    HE1  PHE  80           HE2      PHE  80   6.600   3.268   3.268
  641    HE2  PHE  80           HE1      PHE  80   8.544   6.003   6.003
  642    HZ   PHE  80           HZ       PHE  80   7.974   3.693   3.693
  643    H    ALA  81           H        ALA  81   6.368   7.501   7.501
  644    HA   ALA  81           HA       ALA  81   5.427   8.583   8.583
  645   1HB   ALA  81          2HB       ALA  81   7.003  10.500  10.500
  646   2HB   ALA  81          1HB       ALA  81   5.466  11.239  11.239
  647   3HB   ALA  81          3HB       ALA  81   5.785  10.816  10.816
  648    H    CYS  82           H        CYS  82   4.006   7.579   7.579
  649    HA   CYS  82           HA       CYS  82   1.668   9.295   9.295
  650   1HB   CYS  82          2HB       CYS  82   2.317   6.649   6.649
  651   2HB   CYS  82          1HB       CYS  82   0.880   7.609   7.609
  652    HG   CYS  82           HG       CYS  82   3.686   8.775   8.775
  653    H    ASN  83           H        ASN  83  -0.402   7.560   7.560
  654    HA   ASN  83           HA       ASN  83  -0.523   6.312   6.312
  655   1HB   ASN  83          2HB       ASN  83  -2.282   8.208   8.208
  656   2HB   ASN  83          1HB       ASN  83  -3.151   6.759   6.759
  657   1HD2  ASN  83          2HD2      ASN  83  -1.129   8.597   8.597
  658   2HD2  ASN  83          1HD2      ASN  83  -0.344   8.217   8.217
  659    H    GLY  84           H        GLY  84  -0.473   4.184   4.184
  660   1HA   GLY  84          2HA       GLY  84  -1.649   2.882   2.882
  661   2HA   GLY  84          1HA       GLY  84  -0.430   2.172   2.172
  662    H    THR  85           H        THR  85  -3.242   1.394   1.394
  663    HA   THR  85           HA       THR  85  -4.056   0.384   0.384
  664    HB   THR  85           HB       THR  85  -6.378   1.122   1.122
  665    HG1  THR  85           HG1      THR  85  -5.423   2.578   2.578
  666   1HG2  THR  85          3HG2      THR  85  -4.460   3.424   3.424
  667   2HG2  THR  85          2HG2      THR  85  -6.118   3.504   3.504
  668   3HG2  THR  85          1HG2      THR  85  -4.904   2.570   2.570
  669    H    VAL  86           H        VAL  86  -4.476  -1.689  -1.689
  670    HA   VAL  86           HA       VAL  86  -4.775  -2.873  -2.873
  671    HB   VAL  86           HB       VAL  86  -3.470  -4.001  -4.001
  672   1HG1  VAL  86          3HG1      VAL  86  -6.125  -4.271  -4.271
  673   2HG1  VAL  86          2HG1      VAL  86  -4.650  -5.122  -5.122
  674   3HG1  VAL  86          1HG1      VAL  86  -4.720  -3.363  -3.363
  675   1HG2  VAL  86          2HG2      VAL  86  -4.881  -5.190  -5.190
  676   2HG2  VAL  86          1HG2      VAL  86  -4.074  -6.136  -6.136
  677   3HG2  VAL  86          3HG2      VAL  86  -5.800  -5.801  -5.801
  678    H    ILE  87           H        ILE  87  -6.549  -3.954  -3.954
  679    HA   ILE  87           HA       ILE  87  -9.021  -4.116  -4.116
  680    HB   ILE  87           HB       ILE  87 -10.359  -2.800  -2.800
  681   1HG1  ILE  87          2HG1      ILE  87  -8.419  -1.246  -1.246
  682   2HG1  ILE  87          1HG1      ILE  87  -7.992  -2.933  -2.933
  683   1HG2  ILE  87          2HG2      ILE  87  -9.377  -1.720  -1.720
  684   2HG2  ILE  87          1HG2      ILE  87  -8.040  -1.155  -1.155
  685   3HG2  ILE  87          3HG2      ILE  87  -9.680  -0.593  -0.593
  686   1HD1  ILE  87          2HD1      ILE  87 -10.395  -3.292  -3.292
  687   2HD1  ILE  87          1HD1      ILE  87 -10.546  -1.534  -1.534
  688   3HD1  ILE  87          3HD1      ILE  87  -9.395  -2.335  -2.335
  689    H    GLU  88           H        GLU  88 -10.698  -5.268  -5.268
  690    HA   GLU  88           HA       GLU  88  -9.562  -7.034  -7.034
  691   1HB   GLU  88          2HB       GLU  88 -10.649  -7.815  -7.815
  692   2HB   GLU  88          1HB       GLU  88 -12.125  -7.702  -7.702
  693   1HG   GLU  88          2HG       GLU  88 -11.400  -9.329  -9.329
  694   2HG   GLU  88          1HG       GLU  88  -9.734  -9.232  -9.232
  695    H    HIS  89           H        HIS  89  -9.967  -5.336  -5.336
  696    HA   HIS  89           HA       HIS  89 -12.431  -4.223  -4.223
  697   1HB   HIS  89          2HB       HIS  89  -9.969  -3.931  -3.931
  698   2HB   HIS  89          1HB       HIS  89 -10.658  -4.936  -4.936
  699    HD1  HIS  89           HD1      HIS  89 -11.922  -3.734  -3.734
  700    HD2  HIS  89           HD2      HIS  89 -11.573  -1.489  -1.489
  701    HE1  HIS  89           HE1      HIS  89 -12.937  -1.498  -1.498
  702    HE2  HIS  89           HE2      HIS  89 -12.620  -0.121  -0.121
  703    HA   PRO  90           HA       PRO  90 -14.647  -7.766  -7.766
  704   1HB   PRO  90          2HB       PRO  90 -16.896  -6.515  -6.515
  705   2HB   PRO  90          1HB       PRO  90 -16.488  -6.732  -6.732
  706   1HG   PRO  90          2HG       PRO  90 -16.163  -4.314  -4.314
  707   2HG   PRO  90          1HG       PRO  90 -16.743  -4.422  -4.422
  708   1HD   PRO  90          2HD       PRO  90 -14.189  -3.705  -3.705
  709   2HD   PRO  90          1HD       PRO  90 -14.620  -4.465  -4.465
  710    H    GLU  91           H        GLU  91 -13.618  -5.054  -5.054
  711    HA   GLU  91           HA       GLU  91 -14.624  -6.029  -6.029
  712   1HB   GLU  91          2HB       GLU  91 -13.661  -3.561  -3.561
  713   2HB   GLU  91          1HB       GLU  91 -12.606  -4.031  -4.031
  714   1HG   GLU  91          2HG       GLU  91 -14.454  -2.622  -2.622
  715   2HG   GLU  91          1HG       GLU  91 -14.502  -4.221  -4.221
  716    H    TYR  92           H        TYR  92 -11.779  -6.328  -6.328
  717    HA   TYR  92           HA       TYR  92 -10.489  -7.833  -7.833
  718   1HB   TYR  92          2HB       TYR  92  -8.834  -6.414  -6.414
  719   2HB   TYR  92          1HB       TYR  92  -8.418  -6.879  -6.879
  720    HD1  TYR  92           HD2      TYR  92 -10.291  -5.710  -5.710
  721    HD2  TYR  92           HD1      TYR  92  -8.798  -4.126  -4.126
  722    HE1  TYR  92           HE2      TYR  92 -10.818  -3.442  -3.442
  723    HE2  TYR  92           HE1      TYR  92  -9.325  -1.850  -1.850
  724    HH   TYR  92           HH       TYR  92  -9.975  -1.078  -1.078
  725    H    GLY  93           H        GLY  93 -10.359  -7.277  -7.277
  726   1HA   GLY  93          2HA       GLY  93 -10.801  -9.049  -9.049
  727   2HA   GLY  93          1HA       GLY  93 -10.250 -10.198 -10.198
  728    H    GLU  94           H        GLU  94  -9.418  -8.423  -8.423
  729    HA   GLU  94           HA       GLU  94  -7.533  -8.294  -8.294
  730   1HB   GLU  94          2HB       GLU  94  -7.522 -10.787 -10.787
  731   2HB   GLU  94          1HB       GLU  94  -6.212 -10.312 -10.312
  732   1HG   GLU  94          2HG       GLU  94  -4.869 -10.746 -10.746
  733   2HG   GLU  94          1HG       GLU  94  -5.444  -9.221  -9.221
  734    H    VAL  95           H        VAL  95  -7.056  -6.179  -6.179
  735    HA   VAL  95           HA       VAL  95  -4.602  -5.962  -5.962
  736    HB   VAL  95           HB       VAL  95  -5.490  -3.981  -3.981
  737   1HG1  VAL  95          3HG1      VAL  95  -5.508  -6.530  -6.530
  738   2HG1  VAL  95          2HG1      VAL  95  -7.246  -6.236  -6.236
  739   3HG1  VAL  95          1HG1      VAL  95  -6.154  -5.249  -5.249
  740   1HG2  VAL  95          3HG2      VAL  95  -7.491  -3.883  -3.883
  741   2HG2  VAL  95          2HG2      VAL  95  -7.684  -3.329  -3.329
  742   3HG2  VAL  95          1HG2      VAL  95  -8.264  -4.927  -4.927
  743    H    ILE  96           H        ILE  96  -3.353  -4.116  -4.116
  744    HA   ILE  96           HA       ILE  96  -3.988  -3.031  -3.031
  745    HB   ILE  96           HB       ILE  96  -1.577  -3.578  -3.578
  746   1HG1  ILE  96          2HG1      ILE  96  -0.588  -3.332  -3.332
  747   2HG1  ILE  96          1HG1      ILE  96  -1.845  -2.215  -2.215
  748   1HG2  ILE  96          2HG2      ILE  96  -1.800  -0.672  -0.672
  749   2HG2  ILE  96          1HG2      ILE  96  -0.303  -1.508  -1.508
  750   3HG2  ILE  96          3HG2      ILE  96  -1.565  -1.311  -1.311
  751   1HD1  ILE  96          2HD1      ILE  96  -2.443  -5.065  -5.065
  752   2HD1  ILE  96          1HD1      ILE  96  -1.933  -4.570  -4.570
  753   3HD1  ILE  96          3HD1      ILE  96  -3.420  -3.920  -3.920
  754    H    GLN  97           H        GLN  97  -4.727  -1.107  -1.107
  755    HA   GLN  97           HA       GLN  97  -5.285   0.689   0.689
  756   1HB   GLN  97          2HB       GLN  97  -6.847  -0.201  -0.201
  757   2HB   GLN  97          1HB       GLN  97  -6.532   1.500   1.500
  758   1HG   GLN  97          2HG       GLN  97  -7.460   2.121   2.121
  759   2HG   GLN  97          1HG       GLN  97  -7.631   0.430   0.430
  760   1HE2  GLN  97          2HE2      GLN  97 -10.056   1.543   1.543
  761   2HE2  GLN  97          1HE2      GLN  97  -8.361   1.875   1.875
  762    H    LEU  98           H        LEU  98  -3.728   2.138   2.138
  763    HA   LEU  98           HA       LEU  98  -2.328   3.327   3.327
  764   1HB   LEU  98          2HB       LEU  98  -1.869   3.068   3.068
  765   2HB   LEU  98          1HB       LEU  98  -1.403   4.619   4.619
  766    HG   LEU  98           HG       LEU  98   0.191   3.629   3.629
  767   1HD1  LEU  98          1HD1      LEU  98  -1.301   1.658   1.658
  768   2HD1  LEU  98          3HD1      LEU  98  -0.651   0.881   0.881
  769   3HD1  LEU  98          2HD1      LEU  98   0.428   1.333   1.333
  770   1HD2  LEU  98          3HD2      LEU  98   0.292   2.253   2.253
  771   2HD2  LEU  98          2HD2      LEU  98   0.921   3.857   3.857
  772   3HD2  LEU  98          1HD2      LEU  98   1.648   2.428   2.428
  773    H    GLN  99           H        GLN  99  -2.050   5.754   5.754
  774    HA   GLN  99           HA       GLN  99  -4.655   6.984   6.984
  775   1HB   GLN  99          2HB       GLN  99  -3.409   6.928   6.928
  776   2HB   GLN  99          1HB       GLN  99  -2.640   8.366   8.366
  777   1HG   GLN  99          2HG       GLN  99  -5.617   8.029   8.029
  778   2HG   GLN  99          1HG       GLN  99  -4.717   8.687   8.687
  779   1HE2  GLN  99          2HE2      GLN  99  -5.867  11.551  11.551
  780   2HE2  GLN  99          1HE2      GLN  99  -6.554  10.283  10.283
  781    H    GLY 100           H        GLY 100  -4.836   8.796   8.796
  782   1HA   GLY 100          2HA       GLY 100  -4.215  10.527  10.527
  783   2HA   GLY 100          1HA       GLY 100  -2.578  10.381  10.381
  784    H    ASP 101           H        ASP 101  -2.498  10.924  10.924
  785    HA   ASP 101           HA       ASP 101  -2.761   8.622   8.622
  786   1HB   ASP 101          2HB       ASP 101  -1.751  10.091  10.091
  787   2HB   ASP 101          1HB       ASP 101  -3.154  10.816  10.816
  788    H    GLN 102           H        GLN 102  -1.417   7.074   7.074
  789    HA   GLN 102           HA       GLN 102   1.458   7.651   7.651
  790   1HB   GLN 102          2HB       GLN 102  -0.314   5.851   5.851
  791   2HB   GLN 102          1HB       GLN 102   1.259   5.192   5.192
  792   1HG   GLN 102          2HG       GLN 102   0.979   6.397   6.397
  793   2HG   GLN 102          1HG       GLN 102   2.400   6.756   6.756
  794   1HE2  GLN 102          2HE2      GLN 102  -0.570   9.567   9.567
  795   2HE2  GLN 102          1HE2      GLN 102  -0.937   7.888   7.888
  796    H    ARG 103           H        ARG 103  -0.700   6.598   6.598
  797    HA   ARG 103           HA       ARG 103   0.012   4.126   4.126
  798   1HB   ARG 103          2HB       ARG 103  -0.669   4.896   4.896
  799   2HB   ARG 103          1HB       ARG 103  -1.781   5.455   5.455
  800   1HG   ARG 103          2HG       ARG 103  -1.170   7.645   7.645
  801   2HG   ARG 103          1HG       ARG 103   0.448   7.244   7.244
  802   1HD   ARG 103          2HD       ARG 103  -0.211   7.283   7.283
  803   2HD   ARG 103          1HD       ARG 103  -1.613   6.270   6.270
  804    HE   ARG 103           HE       ARG 103  -2.913   8.153   8.153
  805   1HH1  ARG 103          2HH1      ARG 103   0.448   9.085   9.085
  806   2HH1  ARG 103          1HH1      ARG 103   0.114  10.777  10.777
  807   1HH2  ARG 103          1HH2      ARG 103  -3.354  10.378  10.378
  808   2HH2  ARG 103          2HH2      ARG 103  -2.044  11.511  11.511
  809    H    LYS 104           H        LYS 104   1.868   7.065   7.065
  810    HA   LYS 104           HA       LYS 104   3.812   5.892   5.892
  811   1HB   LYS 104          2HB       LYS 104   3.442   8.636   8.636
  812   2HB   LYS 104          1HB       LYS 104   4.944   8.183   8.183
  813   1HG   LYS 104          2HG       LYS 104   3.990   8.102   8.102
  814   2HG   LYS 104          1HG       LYS 104   2.388   7.713   7.713
  815   1HD   LYS 104          2HD       LYS 104   2.375   9.960   9.960
  816   2HD   LYS 104          1HD       LYS 104   2.218  10.023  10.023
  817   1HE   LYS 104          2HE       LYS 104   3.828  11.600  11.600
  818   2HE   LYS 104          1HE       LYS 104   4.876  10.184  10.184
  819   1HZ   LYS 104          1HZ       LYS 104   4.754  10.174  10.174
  820   2HZ   LYS 104          3HZ       LYS 104   3.946  11.659  11.659
  821   3HZ   LYS 104          2HZ       LYS 104   5.531  11.530  11.530
  822    H    ASN 105           H        ASN 105   3.345   6.461   6.461
  823    HA   ASN 105           HA       ASN 105   6.172   6.100   6.100
  824   1HB   ASN 105          2HB       ASN 105   3.722   6.749   6.749
  825   2HB   ASN 105          1HB       ASN 105   5.173   6.166   6.166
  826   1HD2  ASN 105          2HD2      ASN 105   4.860   9.982   9.982
  827   2HD2  ASN 105          1HD2      ASN 105   3.560   8.846   8.846
  828    H    ILE 106           H        ILE 106   3.149   4.305   4.305
  829    HA   ILE 106           HA       ILE 106   4.091   2.175   2.175
  830    HB   ILE 106           HB       ILE 106   1.704   2.572   2.572
  831   1HG1  ILE 106          2HG1      ILE 106   1.066   0.192   0.192
  832   2HG1  ILE 106          1HG1      ILE 106   2.720  -0.132  -0.132
  833   1HG2  ILE 106          1HG2      ILE 106   1.912   3.170   3.170
  834   2HG2  ILE 106          3HG2      ILE 106   2.109   1.454   1.454
  835   3HG2  ILE 106          2HG2      ILE 106   0.606   2.039   2.039
  836   1HD1  ILE 106          1HD1      ILE 106   1.871   0.843   0.843
  837   2HD1  ILE 106          3HD1      ILE 106   2.328  -0.809  -0.809
  838   3HD1  ILE 106          2HD1      ILE 106   3.522   0.485   0.485
  839    H    CYS 107           H        CYS 107   3.795   2.462   2.462
  840    HA   CYS 107           HA       CYS 107   4.879  -0.027  -0.027
  841   1HB   CYS 107          2HB       CYS 107   5.628   1.166   1.166
  842   2HB   CYS 107          1HB       CYS 107   3.909   1.234   1.234
  843    HG   CYS 107           HG       CYS 107   4.519   3.721   3.721
  844    H    GLN 108           H        GLN 108   6.326   2.990   2.990
  845    HA   GLN 108           HA       GLN 108   9.037   2.251   2.251
  846   1HB   GLN 108          2HB       GLN 108   8.815   4.537   4.537
  847   2HB   GLN 108          1HB       GLN 108   7.591   4.526   4.526
  848   1HG   GLN 108          2HG       GLN 108   9.212   5.408   5.408
  849   2HG   GLN 108          1HG       GLN 108   9.758   3.742   3.742
  850   1HE2  GLN 108          2HE2      GLN 108  12.532   4.117   4.117
  851   2HE2  GLN 108          1HE2      GLN 108  11.342   2.995   2.995
  852    H    PHE 109           H        PHE 109   6.835   2.090   2.090
  853    HA   PHE 109           HA       PHE 109   8.778   1.370   1.370
  854   1HB   PHE 109          2HB       PHE 109   6.607   2.352   2.352
  855   2HB   PHE 109          1HB       PHE 109   5.782   0.938   0.938
  856    HD1  PHE 109           HD1      PHE 109   8.355   1.891   1.891
  857    HD2  PHE 109           HD2      PHE 109   5.247  -0.803  -0.803
  858    HE1  PHE 109           HE1      PHE 109   8.533   0.802   0.802
  859    HE2  PHE 109           HE2      PHE 109   5.420  -1.899  -1.899
  860    HZ   PHE 109           HZ       PHE 109   7.063  -1.094  -1.094
  861    H    LEU 110           H        LEU 110   6.413  -0.445  -0.445
  862    HA   LEU 110           HA       LEU 110   6.916  -2.988  -2.988
  863   1HB   LEU 110          2HB       LEU 110   5.828  -1.913  -1.913
  864   2HB   LEU 110          1HB       LEU 110   6.241  -3.613  -3.613
  865    HG   LEU 110           HG       LEU 110   4.611  -4.067  -4.067
  866   1HD1  LEU 110          3HD1      LEU 110   4.299  -1.091  -1.091
  867   2HD1  LEU 110          2HD1      LEU 110   3.346  -2.336  -2.336
  868   3HD1  LEU 110          1HD1      LEU 110   5.075  -2.202  -2.202
  869   1HD2  LEU 110          3HD2      LEU 110   3.786  -3.546  -3.546
  870   2HD2  LEU 110          2HD2      LEU 110   2.584  -3.430  -3.430
  871   3HD2  LEU 110          1HD2      LEU 110   3.304  -1.966  -1.966
  872    H    VAL 111           H        VAL 111   8.696  -1.055  -1.055
  873    HA   VAL 111           HA       VAL 111  10.410  -3.291  -3.291
  874    HB   VAL 111           HB       VAL 111  10.544  -0.397  -0.397
  875   1HG1  VAL 111          1HG1      VAL 111  12.176  -2.786  -2.786
  876   2HG1  VAL 111          3HG1      VAL 111  11.750  -1.766  -1.766
  877   3HG1  VAL 111          2HG1      VAL 111  12.619  -1.079  -1.079
  878   1HG2  VAL 111          3HG2      VAL 111   8.531  -2.076  -2.076
  879   2HG2  VAL 111          2HG2      VAL 111   9.116  -0.823  -0.823
  880   3HG2  VAL 111          1HG2      VAL 111   9.667  -2.489  -2.489
  881    H    GLU 112           H        GLU 112  10.411  -0.482  -0.482
  882    HA   GLU 112           HA       GLU 112  13.235  -0.385  -0.385
  883   1HB   GLU 112          2HB       GLU 112  10.869   0.831   0.831
  884   2HB   GLU 112          1HB       GLU 112  12.489   0.985   0.985
  885   1HG   GLU 112          2HG       GLU 112  12.357   1.675   1.675
  886   2HG   GLU 112          1HG       GLU 112  11.308   2.674   2.674
  887    H    ILE 113           H        ILE 113  10.508  -1.737  -1.737
  888    HA   ILE 113           HA       ILE 113  12.271  -2.837  -2.837
  889    HB   ILE 113           HB       ILE 113  10.334  -3.520  -3.520
  890   1HG1  ILE 113          2HG1      ILE 113   8.772  -3.036  -3.036
  891   2HG1  ILE 113          1HG1      ILE 113   9.137  -4.605  -4.605
  892   1HG2  ILE 113          3HG2      ILE 113  10.781  -0.945  -0.945
  893   2HG2  ILE 113          2HG2      ILE 113   9.138  -1.097  -1.097
  894   3HG2  ILE 113          1HG2      ILE 113   9.483  -1.482  -1.482
  895   1HD1  ILE 113          2HD1      ILE 113   7.803  -2.866  -2.866
  896   2HD1  ILE 113          1HD1      ILE 113   6.864  -3.099  -3.099
  897   3HD1  ILE 113          3HD1      ILE 113   7.386  -4.495  -4.495
  898    H    GLY 114           H        GLY 114  10.736  -3.872  -3.872
  899   1HA   GLY 114          2HA       GLY 114  11.394  -5.814  -5.814
  900   2HA   GLY 114          1HA       GLY 114  11.959  -6.514  -6.514
  901    H    LEU 115           H        LEU 115   8.851  -4.970  -4.970
  902    HA   LEU 115           HA       LEU 115   7.499  -7.332  -7.332
  903   1HB   LEU 115          2HB       LEU 115   7.016  -4.707  -4.707
  904   2HB   LEU 115          1HB       LEU 115   5.962  -5.024  -5.024
  905    HG   LEU 115           HG       LEU 115   4.699  -6.634  -6.634
  906   1HD1  LEU 115          2HD1      LEU 115   6.906  -6.332  -6.332
  907   2HD1  LEU 115          1HD1      LEU 115   5.298  -6.864  -6.864
  908   3HD1  LEU 115          3HD1      LEU 115   6.211  -7.803  -7.803
  909   1HD2  LEU 115          1HD2      LEU 115   4.530  -4.032  -4.032
  910   2HD2  LEU 115          3HD2      LEU 115   3.555  -5.171  -5.171
  911   3HD2  LEU 115          2HD2      LEU 115   5.020  -4.482  -4.482
  912    H    ALA 116           H        ALA 116   6.825  -5.249  -5.249
  913    HA   ALA 116           HA       ALA 116   5.747  -7.569  -7.569
  914   1HB   ALA 116          1HB       ALA 116   4.508  -5.371  -5.371
  915   2HB   ALA 116          3HB       ALA 116   5.737  -4.715  -4.715
  916   3HB   ALA 116          2HB       ALA 116   4.713  -6.045  -6.045
  917    H    LYS 117           H        LYS 117   6.179  -6.779  -6.779
  918    HA   LYS 117           HA       LYS 117   9.110  -6.772  -6.772
  919   1HB   LYS 117          2HB       LYS 117   7.197  -8.797  -8.797
  920   2HB   LYS 117          1HB       LYS 117   8.250  -8.235  -8.235
  921   1HG   LYS 117          2HG       LYS 117   9.466  -8.980  -8.980
  922   2HG   LYS 117          1HG       LYS 117   8.922 -10.260 -10.260
  923   1HD   LYS 117          2HD       LYS 117  11.078 -10.003 -10.003
  924   2HD   LYS 117          1HD       LYS 117  10.257  -8.848  -8.848
  925   1HE   LYS 117          2HE       LYS 117  11.319  -7.103  -7.103
  926   2HE   LYS 117          1HE       LYS 117  11.059  -7.694  -7.694
  927   1HZ   LYS 117          3HZ       LYS 117  12.913  -9.329  -9.329
  928   2HZ   LYS 117          2HZ       LYS 117  13.264  -8.348  -8.348
  929   3HZ   LYS 117          1HZ       LYS 117  13.359  -7.713  -7.713
  930    H    ASP 118           H        ASP 118   9.951  -5.694  -5.694
  931    HA   ASP 118           HA       ASP 118   8.635  -3.448  -3.448
  932   1HB   ASP 118          2HB       ASP 118  10.391  -3.237  -3.237
  933   2HB   ASP 118          1HB       ASP 118  11.076  -3.768  -3.768
  934    H    ASP 119           H        ASP 119   8.480  -6.701  -6.701
  935    HA   ASP 119           HA       ASP 119   7.258  -5.982  -5.982
  936   1HB   ASP 119          2HB       ASP 119   6.906  -8.445  -8.445
  937   2HB   ASP 119          1HB       ASP 119   8.584  -7.999  -7.999
  938    H    GLN 120           H        GLN 120   6.238  -6.732  -6.732
  939    HA   GLN 120           HA       GLN 120   3.478  -7.161  -7.161
  940   1HB   GLN 120          2HB       GLN 120   4.629  -6.968  -6.968
  941   2HB   GLN 120          1HB       GLN 120   3.056  -7.609  -7.609
  942   1HG   GLN 120          2HG       GLN 120   4.260  -9.383  -9.383
  943   2HG   GLN 120          1HG       GLN 120   5.754  -8.801  -8.801
  944   1HE2  GLN 120          2HE2      GLN 120   4.250  -9.665  -9.665
  945   2HE2  GLN 120          1HE2      GLN 120   4.610  -8.176  -8.176
  946    H    LEU 121           H        LEU 121   5.392  -4.509  -4.509
  947    HA   LEU 121           HA       LEU 121   3.952  -2.765  -2.765
  948   1HB   LEU 121          2HB       LEU 121   5.669  -2.328  -2.328
  949   2HB   LEU 121          1HB       LEU 121   4.895  -0.982  -0.982
  950    HG   LEU 121           HG       LEU 121   6.743  -2.909  -2.909
  951   1HD1  LEU 121          1HD1      LEU 121   7.325  -0.305  -0.305
  952   2HD1  LEU 121          3HD1      LEU 121   8.375  -0.983  -0.983
  953   3HD1  LEU 121          2HD1      LEU 121   8.094  -1.873  -1.873
  954   1HD2  LEU 121          2HD2      LEU 121   5.183  -0.533  -0.533
  955   2HD2  LEU 121          1HD2      LEU 121   5.729  -1.902  -1.902
  956   3HD2  LEU 121          3HD2      LEU 121   6.843  -0.588  -0.588
  957    H    LYS 122           H        LYS 122   1.730  -3.032  -3.032
  958    HA   LYS 122           HA       LYS 122   0.636  -2.114  -2.114
  959   1HB   LYS 122          2HB       LYS 122  -0.182  -4.210  -4.210
  960   2HB   LYS 122          1HB       LYS 122  -1.496  -3.214  -3.214
  961   1HG   LYS 122          2HG       LYS 122   0.498  -4.660  -4.660
  962   2HG   LYS 122          1HG       LYS 122  -1.117  -5.252  -5.252
  963   1HD   LYS 122          2HD       LYS 122  -2.113  -3.857  -3.857
  964   2HD   LYS 122          1HD       LYS 122  -1.036  -2.516  -2.516
  965   1HE   LYS 122          2HE       LYS 122   0.718  -4.042  -4.042
  966   2HE   LYS 122          1HE       LYS 122  -0.744  -4.656  -4.656
  967   1HZ   LYS 122          2HZ       LYS 122  -1.277  -2.197  -2.197
  968   2HZ   LYS 122          1HZ       LYS 122   0.360  -1.919  -1.919
  969   3HZ   LYS 122          3HZ       LYS 122  -0.090  -2.909  -2.909
  970    H    VAL 123           H        VAL 123   0.995   0.090   0.090
  971    HA   VAL 123           HA       VAL 123  -0.622   1.037   1.037
  972    HB   VAL 123           HB       VAL 123   1.668   1.896   1.896
  973   1HG1  VAL 123          1HG1      VAL 123   1.188   1.943   1.943
  974   2HG1  VAL 123          3HG1      VAL 123   1.034   3.651   3.651
  975   3HG1  VAL 123          2HG1      VAL 123   2.520   2.782   2.782
  976   1HG2  VAL 123          1HG2      VAL 123  -0.383   3.255   3.255
  977   2HG2  VAL 123          3HG2      VAL 123   1.169   4.057   4.057
  978   3HG2  VAL 123          2HG2      VAL 123  -0.108   4.227   4.227
  979    H    HIS 124           H        HIS 124  -2.664   1.633   1.633
  980    HA   HIS 124           HA       HIS 124  -3.389   2.830   2.830
  981   1HB   HIS 124          2HB       HIS 124  -5.251   1.177   1.177
  982   2HB   HIS 124          1HB       HIS 124  -5.514   1.742   1.742
  983    HD1  HIS 124           HD1      HIS 124  -4.853   0.187   0.187
  984    HD2  HIS 124           HD2      HIS 124  -3.167  -0.864  -0.864
  985    HE1  HIS 124           HE1      HIS 124  -3.724  -2.023  -2.023
  986    HE2  HIS 124           HE2      HIS 124  -2.876  -2.718  -2.718
  987    H    GLY 125           H        GLY 125  -2.972   4.909   4.909
  988   1HA   GLY 125          2HA       GLY 125  -4.272   5.833   5.833
  989   2HA   GLY 125          1HA       GLY 125  -3.638   6.849   6.849
  990    H    PHE 126           HN       PHE 126  -6.354   6.173   6.173
  991    HA   PHE 126           HA       PHE 126  -8.429   5.807   5.807
  992   1HB   PHE 126          2HB       PHE 126  -9.849   6.700   6.700
  993   2HB   PHE 126          1HB       PHE 126  -8.455   6.154   6.154
  994    HD1  PHE 126           HD1      PHE 126  -6.523   8.261   8.261
  995    HD2  PHE 126           HD2      PHE 126 -10.748   8.529   8.529
  996    HE1  PHE 126           HE1      PHE 126  -6.280  10.517  10.517
  997    HE2  PHE 126           HE2      PHE 126 -10.515  10.785  10.785
  998    HZ   PHE 126           HZ       PHE 126  -8.279  11.782  11.782

  Start of MODEL   18
    1   1H    MET   1          1H        MET   1 -16.164  23.808  23.808
    2   2H    MET   1          3H        MET   1 -17.216  22.599  22.599
    3   3H    MET   1          2H        MET   1 -15.535  22.523  22.523
    4    HA   MET   1           HA       MET   1 -15.912  20.966  20.966
    5   1HB   MET   1          2HB       MET   1 -17.720  23.100  23.100
    6   2HB   MET   1          1HB       MET   1 -16.990  22.013  22.013
    7   1HG   MET   1          2HG       MET   1 -18.635  20.596  20.596
    8   2HG   MET   1          1HG       MET   1 -17.938  20.344  20.344
    9   1HE   MET   1          1HE       MET   1 -21.012  20.655  20.655
   10   2HE   MET   1          3HE       MET   1 -21.979  21.942  21.942
   11   3HE   MET   1          2HE       MET   1 -20.693  22.339  22.339
   12    H    ARG   2           H        ARG   2 -15.762  24.129  24.129
   13    HA   ARG   2           HA       ARG   2 -12.948  24.245  24.245
   14   1HB   ARG   2          2HB       ARG   2 -13.725  22.278  22.278
   15   2HB   ARG   2          1HB       ARG   2 -14.074  23.607  23.607
   16   1HG   ARG   2          2HG       ARG   2 -11.951  23.377  23.377
   17   2HG   ARG   2          1HG       ARG   2 -11.563  24.236  24.236
   18   1HD   ARG   2          2HD       ARG   2 -10.624  22.428  22.428
   19   2HD   ARG   2          1HD       ARG   2 -11.959  21.387  21.387
   20    HE   ARG   2           HE       ARG   2  -9.441  21.665  21.665
   21   1HH1  ARG   2          2HH1      ARG   2 -12.826  21.048  21.048
   22   2HH1  ARG   2          1HH1      ARG   2 -12.543  20.163  20.163
   23   1HH2  ARG   2          1HH2      ARG   2  -9.066  20.501  20.501
   24   2HH2  ARG   2          2HH2      ARG   2 -10.410  19.851  19.851
   25    H    GLY   3           H        GLY   3 -15.847  24.954  24.954
   26   1HA   GLY   3          2HA       GLY   3 -16.771  27.067  27.067
   27   2HA   GLY   3          1HA       GLY   3 -15.346  27.802  27.802
   28    H    SER   4           H        SER   4 -15.833  25.567  25.567
   29    HA   SER   4           HA       SER   4 -13.808  26.746  26.746
   30   1HB   SER   4          2HB       SER   4 -14.434  24.473  24.473
   31   2HB   SER   4          1HB       SER   4 -16.113  24.929  24.929
   32    HG   SER   4           HG       SER   4 -15.157  24.692  24.692
   33    H    HIS   5           H        HIS   5 -13.902  28.145  28.145
   34    HA   HIS   5           HA       HIS   5 -16.163  29.972  29.972
   35   1HB   HIS   5          2HB       HIS   5 -13.341  30.093  30.093
   36   2HB   HIS   5          1HB       HIS   5 -14.451  30.984  30.984
   37    HD1  HIS   5           HD1      HIS   5 -12.699  31.159  31.159
   38    HD2  HIS   5           HD2      HIS   5 -15.931  33.044  33.044
   39    HE1  HIS   5           HE1      HIS   5 -13.113  33.234  33.234
   40    HE2  HIS   5           HE2      HIS   5 -15.129  34.312  34.312
   41    H    HIS   6           H        HIS   6 -14.620  27.657  27.657
   42    HA   HIS   6           HA       HIS   6 -16.988  27.450  27.450
   43   1HB   HIS   6          2HB       HIS   6 -15.897  28.045  28.045
   44   2HB   HIS   6          1HB       HIS   6 -16.070  29.420  29.420
   45    HD1  HIS   6           HD1      HIS   6 -13.854  28.709  28.709
   46    HD2  HIS   6           HD2      HIS   6 -13.316  28.999  28.999
   47    HE1  HIS   6           HE1      HIS   6 -11.408  29.195  29.195
   48    HE2  HIS   6           HE2      HIS   6 -11.125  29.459  29.459
   49    H    HIS   7           H        HIS   7 -16.346  26.033  26.033
   50    HA   HIS   7           HA       HIS   7 -14.656  23.851  23.851
   51   1HB   HIS   7          2HB       HIS   7 -17.304  23.888  23.888
   52   2HB   HIS   7          1HB       HIS   7 -16.202  22.671  22.671
   53    HD1  HIS   7           HD1      HIS   7 -18.740  21.892  21.892
   54    HD2  HIS   7           HD2      HIS   7 -14.956  22.305  22.305
   55    HE1  HIS   7           HE1      HIS   7 -18.772  20.498  20.498
   56    HE2  HIS   7           HE2      HIS   7 -16.499  20.829  20.829
   57    H    HIS   8           H        HIS   8 -12.746  23.845  23.845
   58    HA   HIS   8           HA       HIS   8 -12.255  25.046  25.046
   59   1HB   HIS   8          2HB       HIS   8 -10.632  24.521  24.521
   60   2HB   HIS   8          1HB       HIS   8 -10.418  22.984  22.984
   61    HD1  HIS   8           HD1      HIS   8 -10.193  23.767  23.767
   62    HD2  HIS   8           HD2      HIS   8  -8.465  25.993  25.993
   63    HE1  HIS   8           HE1      HIS   8  -8.342  25.077  25.077
   64    HE2  HIS   8           HE2      HIS   8  -7.260  26.356  26.356
   65    H    HIS   9           H        HIS   9 -12.845  21.735  21.735
   66    HA   HIS   9           HA       HIS   9 -13.373  20.994  20.994
   67   1HB   HIS   9          2HB       HIS   9 -10.906  20.433  20.433
   68   2HB   HIS   9          1HB       HIS   9 -11.767  19.002  19.002
   69    HD1  HIS   9           HD1      HIS   9 -13.641  19.344  19.344
   70    HD2  HIS   9           HD2      HIS   9  -9.566  18.642  18.642
   71    HE1  HIS   9           HE1      HIS   9 -12.929  18.278  18.278
   72    HE2  HIS   9           HE2      HIS   9 -10.475  17.786  17.786
   73    H    HIS  10           H        HIS  10 -15.370  20.220  20.220
   74    HA   HIS  10           HA       HIS  10 -16.125  18.489  18.489
   75   1HB   HIS  10          2HB       HIS  10 -17.342  20.649  20.649
   76   2HB   HIS  10          1HB       HIS  10 -17.943  20.262  20.262
   77    HD1  HIS  10           HD1      HIS  10 -20.399  20.114  20.114
   78    HD2  HIS  10           HD2      HIS  10 -17.997  17.653  17.653
   79    HE1  HIS  10           HE1      HIS  10 -21.986  18.649  18.649
   80    HE2  HIS  10           HE2      HIS  10 -20.514  17.226  17.226
   81    H    THR  11           H        THR  11 -16.842  16.495  16.495
   82    HA   THR  11           HA       THR  11 -18.106  15.780  15.780
   83    HB   THR  11           HB       THR  11 -16.178  14.016  14.016
   84    HG1  THR  11           HG1      THR  11 -14.158  14.898  14.898
   85   1HG2  THR  11          2HG2      THR  11 -17.011  16.034  16.034
   86   2HG2  THR  11          1HG2      THR  11 -15.480  16.748  16.748
   87   3HG2  THR  11          3HG2      THR  11 -15.492  15.218  15.218
   88    H    ASP  12           H        ASP  12 -15.885  14.002  14.002
   89    HA   ASP  12           HA       ASP  12 -18.012  12.780  12.780
   90   1HB   ASP  12          2HB       ASP  12 -17.453  10.438  10.438
   91   2HB   ASP  12          1HB       ASP  12 -18.294  11.422  11.422
   92    HA   PRO  13           HA       PRO  13 -14.111  12.732  12.732
   93   1HB   PRO  13          2HB       PRO  13 -15.135  13.322  13.322
   94   2HB   PRO  13          1HB       PRO  13 -14.935  14.560  14.560
   95   1HG   PRO  13          2HG       PRO  13 -17.401  13.083  13.083
   96   2HG   PRO  13          1HG       PRO  13 -17.205  14.797  14.797
   97   1HD   PRO  13          2HD       PRO  13 -18.178  12.881  12.881
   98   2HD   PRO  13          1HD       PRO  13 -17.430  14.408  14.408
   99    H    MET  14           H        MET  14 -14.797  10.317  10.317
  100    HA   MET  14           HA       MET  14 -14.966   8.122   8.122
  101   1HB   MET  14          2HB       MET  14 -13.456   9.394   9.394
  102   2HB   MET  14          1HB       MET  14 -14.044   7.761   7.761
  103   1HG   MET  14          2HG       MET  14 -11.785   7.710   7.710
  104   2HG   MET  14          1HG       MET  14 -12.898   6.994   6.994
  105   1HE   MET  14          1HE       MET  14 -10.535   7.177   7.177
  106   2HE   MET  14          3HE       MET  14 -11.128   7.702   7.702
  107   3HE   MET  14          2HE       MET  14  -9.855   8.614   8.614
  108    H    SER  15           H        SER  15 -17.156  10.075  10.075
  109    HA   SER  15           HA       SER  15 -18.629   8.142   8.142
  110   1HB   SER  15          2HB       SER  15 -18.176  11.046  11.046
  111   2HB   SER  15          1HB       SER  15 -19.717  10.311  10.311
  112    HG   SER  15           HG       SER  15 -17.176   9.301   9.301
  113    H    ALA  16           H        ALA  16 -18.392   9.267   9.267
  114    HA   ALA  16           HA       ALA  16 -21.275   9.544   9.544
  115   1HB   ALA  16          2HB       ALA  16 -19.196  11.499  11.499
  116   2HB   ALA  16          1HB       ALA  16 -20.102  11.071  11.071
  117   3HB   ALA  16          3HB       ALA  16 -20.952  11.682  11.682
  118    H    ILE  17           H        ILE  17 -19.163   7.396   7.396
  119    HA   ILE  17           HA       ILE  17 -18.914   6.940   6.940
  120    HB   ILE  17           HB       ILE  17 -18.336   4.860   4.860
  121   1HG1  ILE  17          2HG1      ILE  17 -15.931   6.177   6.177
  122   2HG1  ILE  17          1HG1      ILE  17 -17.090   7.490   7.490
  123   1HG2  ILE  17          3HG2      ILE  17 -18.163   4.686   4.686
  124   2HG2  ILE  17          2HG2      ILE  17 -16.602   5.455   5.455
  125   3HG2  ILE  17          1HG2      ILE  17 -16.980   3.912   3.912
  126   1HD1  ILE  17          3HD1      ILE  17 -17.173   5.267   5.267
  127   2HD1  ILE  17          2HD1      ILE  17 -15.858   6.438   6.438
  128   3HD1  ILE  17          1HD1      ILE  17 -17.534   6.980   6.980
  129    H    GLN  18           H        GLN  18 -19.979   5.417   5.417
  130    HA   GLN  18           HA       GLN  18 -22.588   4.649   4.649
  131   1HB   GLN  18          2HB       GLN  18 -21.232   3.842   3.842
  132   2HB   GLN  18          1HB       GLN  18 -22.956   3.835   3.835
  133   1HG   GLN  18          2HG       GLN  18 -22.196   6.448   6.448
  134   2HG   GLN  18          1HG       GLN  18 -21.256   5.981   5.981
  135   1HE2  GLN  18          2HE2      GLN  18 -25.133   6.856   6.856
  136   2HE2  GLN  18          1HE2      GLN  18 -24.205   7.098   7.098
  137    H    ASN  19           H        ASN  19 -23.235   2.736   2.736
  138    HA   ASN  19           HA       ASN  19 -21.442   0.424   0.424
  139   1HB   ASN  19          2HB       ASN  19 -21.156   1.503   1.503
  140   2HB   ASN  19          1HB       ASN  19 -22.856   1.175   1.175
  141   1HD2  ASN  19          2HD2      ASN  19 -20.098  -1.825  -1.825
  142   2HD2  ASN  19          1HD2      ASN  19 -19.746  -0.307  -0.307
  143    H    LEU  20           H        LEU  20 -22.598  -0.908  -0.908
  144    HA   LEU  20           HA       LEU  20 -25.479  -1.082  -1.082
  145   1HB   LEU  20          2HB       LEU  20 -23.513  -1.723  -1.723
  146   2HB   LEU  20          1HB       LEU  20 -24.596  -3.077  -3.077
  147    HG   LEU  20           HG       LEU  20 -25.469  -0.267  -0.267
  148   1HD1  LEU  20          1HD1      LEU  20 -24.791  -2.628  -2.628
  149   2HD1  LEU  20          3HD1      LEU  20 -26.245  -1.739  -1.739
  150   3HD1  LEU  20          2HD1      LEU  20 -24.689  -0.910  -0.910
  151   1HD2  LEU  20          1HD2      LEU  20 -26.908  -2.766  -2.766
  152   2HD2  LEU  20          3HD2      LEU  20 -27.310  -1.086  -1.086
  153   3HD2  LEU  20          2HD2      LEU  20 -27.598  -1.740  -1.740
  154    H    HIS  21           H        HIS  21 -22.642  -3.108  -3.108
  155    HA   HIS  21           HA       HIS  21 -24.084  -4.649  -4.649
  156   1HB   HIS  21          2HB       HIS  21 -24.049  -5.609  -5.609
  157   2HB   HIS  21          1HB       HIS  21 -22.846  -6.565  -6.565
  158    HD1  HIS  21           HD1      HIS  21 -26.260  -5.324  -5.324
  159    HD2  HIS  21           HD2      HIS  21 -24.127  -8.855  -8.855
  160    HE1  HIS  21           HE1      HIS  21 -27.757  -7.141  -7.141
  161    HE2  HIS  21           HE2      HIS  21 -26.481  -9.279  -9.279
  162    H    SER  22           H        SER  22 -22.533  -6.561  -6.561
  163    HA   SER  22           HA       SER  22 -19.858  -5.363  -5.363
  164   1HB   SER  22          2HB       SER  22 -19.696  -6.410  -6.410
  165   2HB   SER  22          1HB       SER  22 -21.245  -5.570  -5.570
  166    HG   SER  22           HG       SER  22 -22.238  -7.564  -7.564
  167    H    PHE  23           H        PHE  23 -19.071  -6.367  -6.367
  168    HA   PHE  23           HA       PHE  23 -19.024  -9.277  -9.277
  169   1HB   PHE  23          2HB       PHE  23 -19.414  -7.758  -7.758
  170   2HB   PHE  23          1HB       PHE  23 -17.686  -7.421  -7.421
  171    HD1  PHE  23           HD2      PHE  23 -19.847 -10.461 -10.461
  172    HD2  PHE  23           HD1      PHE  23 -16.453  -8.593  -8.593
  173    HE1  PHE  23           HE2      PHE  23 -19.403 -12.503 -12.503
  174    HE2  PHE  23           HE1      PHE  23 -16.002 -10.631 -10.631
  175    HZ   PHE  23           HZ       PHE  23 -17.478 -12.590 -12.590
  176    H    ASP  24           H        ASP  24 -17.345 -10.494 -10.494
  177    HA   ASP  24           HA       ASP  24 -15.317 -11.109 -11.109
  178   1HB   ASP  24          2HB       ASP  24 -14.346  -8.704  -8.704
  179   2HB   ASP  24          1HB       ASP  24 -13.325  -9.986  -9.986
  180    HA   PRO  25           HA       PRO  25 -15.913  -8.035  -8.035
  181   1HB   PRO  25          2HB       PRO  25 -15.323 -10.570 -10.570
  182   2HB   PRO  25          1HB       PRO  25 -16.552  -9.346  -9.346
  183   1HG   PRO  25          2HG       PRO  25 -17.222 -11.677 -11.677
  184   2HG   PRO  25          1HG       PRO  25 -17.999 -10.168 -10.168
  185   1HD   PRO  25          2HD       PRO  25 -15.885 -11.780 -11.780
  186   2HD   PRO  25          1HD       PRO  25 -17.248 -10.883 -10.883
  187    H    PHE  26           H        PHE  26 -13.463 -10.439 -10.439
  188    HA   PHE  26           HA       PHE  26 -11.498  -8.935  -8.935
  189   1HB   PHE  26          2HB       PHE  26 -10.871 -11.570 -11.570
  190   2HB   PHE  26          1HB       PHE  26 -10.234 -10.868 -10.868
  191    HD1  PHE  26           HD1      PHE  26 -13.207 -12.473 -12.473
  192    HD2  PHE  26           HD2      PHE  26 -11.198 -11.361 -11.361
  193    HE1  PHE  26           HE1      PHE  26 -14.804 -13.814 -13.814
  194    HE2  PHE  26           HE2      PHE  26 -12.790 -12.701 -12.701
  195    HZ   PHE  26           HZ       PHE  26 -14.595 -13.931 -13.931
  196    H    ALA  27           H        ALA  27 -12.117 -10.257 -10.257
  197    HA   ALA  27           HA       ALA  27 -11.286  -9.738  -9.738
  198   1HB   ALA  27          1HB       ALA  27 -11.776  -7.381  -7.381
  199   2HB   ALA  27          3HB       ALA  27 -10.022  -7.236  -7.236
  200   3HB   ALA  27          2HB       ALA  27 -10.981  -7.528  -7.528
  201    H    ASP  28           H        ASP  28  -9.801 -11.548 -11.548
  202    HA   ASP  28           HA       ASP  28  -7.198 -11.236 -11.236
  203   1HB   ASP  28          2HB       ASP  28  -6.719 -13.315 -13.315
  204   2HB   ASP  28          1HB       ASP  28  -8.038 -13.447 -13.447
  205    H    ALA  29           H        ALA  29  -5.444 -10.289 -10.289
  206    HA   ALA  29           HA       ALA  29  -5.137  -9.997  -9.997
  207   1HB   ALA  29          2HB       ALA  29  -6.199  -7.918  -7.918
  208   2HB   ALA  29          1HB       ALA  29  -4.487  -7.564  -7.564
  209   3HB   ALA  29          3HB       ALA  29  -5.146  -7.738  -7.738
  210    H    SER  30           H        SER  30  -3.829 -11.629 -11.629
  211    HA   SER  30           HA       SER  30  -1.131 -11.150 -11.150
  212   1HB   SER  30          2HB       SER  30  -1.519  -9.439  -9.439
  213   2HB   SER  30          1HB       SER  30  -1.663 -10.810 -10.810
  214    HG   SER  30           HG       SER  30   0.576 -10.270 -10.270
  215    H    LYS  31           H        LYS  31  -0.604 -13.187 -13.187
  216    HA   LYS  31           HA       LYS  31  -0.799 -15.171 -15.171
  217   1HB   LYS  31          2HB       LYS  31  -2.724 -15.112 -15.112
  218   2HB   LYS  31          1HB       LYS  31  -1.584 -16.317 -16.317
  219   1HG   LYS  31          2HG       LYS  31  -2.880 -16.337 -16.337
  220   2HG   LYS  31          1HG       LYS  31  -3.405 -17.290 -17.290
  221   1HD   LYS  31          2HD       LYS  31  -1.536 -18.656 -18.656
  222   2HD   LYS  31          1HD       LYS  31  -0.576 -17.468 -17.468
  223   1HE   LYS  31          2HE       LYS  31  -2.978 -18.461 -18.461
  224   2HE   LYS  31          1HE       LYS  31  -1.699 -19.648 -19.648
  225   1HZ   LYS  31          3HZ       LYS  31  -0.852 -17.060 -17.060
  226   2HZ   LYS  31          2HZ       LYS  31  -1.768 -18.000 -18.000
  227   3HZ   LYS  31          1HZ       LYS  31  -0.329 -18.613 -18.613
  228    H    GLY  32           H        GLY  32   1.288 -15.684 -15.684
  229   1HA   GLY  32          2HA       GLY  32   2.745 -16.488 -16.488
  230   2HA   GLY  32          1HA       GLY  32   3.507 -15.469 -15.469
  231    H    ASP  33           H        ASP  33   5.151 -16.946 -16.946
  232    HA   ASP  33           HA       ASP  33   4.335 -19.165 -19.165
  233   1HB   ASP  33          2HB       ASP  33   4.963 -19.738 -19.738
  234   2HB   ASP  33          1HB       ASP  33   6.574 -19.765 -19.765
  235    H    ASP  34           H        ASP  34   7.104 -17.391 -17.391
  236    HA   ASP  34           HA       ASP  34   8.942 -18.033 -18.033
  237   1HB   ASP  34          2HB       ASP  34   9.515 -17.012 -17.012
  238   2HB   ASP  34          1HB       ASP  34   8.856 -15.485 -15.485
  239    H    LEU  35           H        LEU  35   7.402 -14.844 -14.844
  240    HA   LEU  35           HA       LEU  35   7.922 -14.103 -14.103
  241   1HB   LEU  35          2HB       LEU  35   6.598 -12.859 -12.859
  242   2HB   LEU  35          1HB       LEU  35   6.172 -12.237 -12.237
  243    HG   LEU  35           HG       LEU  35   8.546 -11.754 -11.754
  244   1HD1  LEU  35          1HD1      LEU  35   9.357 -13.570 -13.570
  245   2HD1  LEU  35          3HD1      LEU  35   9.080 -12.415 -12.415
  246   3HD1  LEU  35          2HD1      LEU  35  10.239 -12.043 -12.043
  247   1HD2  LEU  35          2HD2      LEU  35   7.413 -10.582 -10.582
  248   2HD2  LEU  35          1HD2      LEU  35   7.186  -9.985  -9.985
  249   3HD2  LEU  35          3HD2      LEU  35   8.779  -9.911  -9.911
  250    H    LEU  36           H        LEU  36   5.822 -12.933 -12.933
  251    HA   LEU  36           HA       LEU  36   3.886 -15.119 -15.119
  252   1HB   LEU  36          2HB       LEU  36   4.596 -12.872 -12.872
  253   2HB   LEU  36          1HB       LEU  36   3.433 -14.144 -14.144
  254    HG   LEU  36           HG       LEU  36   5.453 -14.669 -14.669
  255   1HD1  LEU  36          1HD1      LEU  36   4.183 -16.471 -16.471
  256   2HD1  LEU  36          3HD1      LEU  36   5.556 -16.440 -16.440
  257   3HD1  LEU  36          2HD1      LEU  36   5.800 -16.857 -16.857
  258   1HD2  LEU  36          2HD2      LEU  36   6.755 -13.314 -13.314
  259   2HD2  LEU  36          1HD2      LEU  36   7.540 -14.350 -14.350
  260   3HD2  LEU  36          3HD2      LEU  36   7.157 -14.981 -14.981
  261    HA   PRO  37           HA       PRO  37   0.807 -12.564 -12.564
  262   1HB   PRO  37          2HB       PRO  37  -1.395 -13.752 -13.752
  263   2HB   PRO  37          1HB       PRO  37  -0.573 -14.354 -14.354
  264   1HG   PRO  37          2HG       PRO  37  -0.316 -15.241 -15.241
  265   2HG   PRO  37          1HG       PRO  37  -0.324 -16.210 -16.210
  266   1HD   PRO  37          2HD       PRO  37   1.952 -15.650 -15.650
  267   2HD   PRO  37          1HD       PRO  37   1.900 -15.765 -15.765
  268    H    ALA  38           H        ALA  38  -0.351 -13.425 -13.425
  269    HA   ALA  38           HA       ALA  38   0.076 -10.922 -10.922
  270   1HB   ALA  38          1HB       ALA  38  -2.699 -11.297 -11.297
  271   2HB   ALA  38          3HB       ALA  38  -2.227 -10.037 -10.037
  272   3HB   ALA  38          2HB       ALA  38  -1.527 -10.069 -10.069
  273    H    GLY  39           H        GLY  39   0.695 -12.845 -12.845
  274   1HA   GLY  39          2HA       GLY  39  -1.316 -14.423 -14.423
  275   2HA   GLY  39          1HA       GLY  39   0.338 -14.230 -14.230
  276    H    THR  40           H        THR  40   0.588 -13.273 -13.273
  277    HA   THR  40           HA       THR  40  -0.958 -11.008 -11.008
  278    HB   THR  40           HB       THR  40  -1.712 -12.283 -12.283
  279    HG1  THR  40           HG1      THR  40  -2.113 -14.431 -14.431
  280   1HG2  THR  40          1HG2      THR  40  -3.082 -11.455 -11.455
  281   2HG2  THR  40          3HG2      THR  40  -3.425 -13.185 -13.185
  282   3HG2  THR  40          2HG2      THR  40  -3.813 -12.235 -12.235
  283    H    GLU  41           H        GLU  41   1.161 -13.654 -13.654
  284    HA   GLU  41           HA       GLU  41   3.051 -13.692 -13.692
  285   1HB   GLU  41          2HB       GLU  41   3.063 -11.143 -11.143
  286   2HB   GLU  41          1HB       GLU  41   3.795 -10.993 -10.993
  287   1HG   GLU  41          2HG       GLU  41   4.654 -13.304 -13.304
  288   2HG   GLU  41          1HG       GLU  41   5.143 -11.713 -11.713
  289    H    ASP  42           H        ASP  42   0.287 -12.874 -12.874
  290    HA   ASP  42           HA       ASP  42  -0.635 -12.253 -12.253
  291   1HB   ASP  42          2HB       ASP  42   1.592 -14.040 -14.040
  292   2HB   ASP  42          1HB       ASP  42   1.332 -12.974 -12.974
  293    H    TYR  43           H        TYR  43  -0.014 -10.004 -10.004
  294    HA   TYR  43           HA       TYR  43   2.058  -8.521  -8.521
  295   1HB   TYR  43          2HB       TYR  43  -0.525  -7.503  -7.503
  296   2HB   TYR  43          1HB       TYR  43   0.922  -6.550  -6.550
  297    HD1  TYR  43           HD1      TYR  43   2.874  -8.776  -8.776
  298    HD2  TYR  43           HD2      TYR  43  -0.628  -7.022  -7.022
  299    HE1  TYR  43           HE1      TYR  43   3.698  -9.284  -9.284
  300    HE2  TYR  43           HE2      TYR  43   0.188  -7.536  -7.536
  301    HH   TYR  43           HH       TYR  43   2.635  -7.909  -7.909
  302    H    ILE  44           H        ILE  44   1.379  -6.384  -6.384
  303    HA   ILE  44           HA       ILE  44  -0.382  -7.152  -7.152
  304    HB   ILE  44           HB       ILE  44   2.114  -5.451  -5.451
  305   1HG1  ILE  44          2HG1      ILE  44   2.712  -7.752  -7.752
  306   2HG1  ILE  44          1HG1      ILE  44   2.823  -7.215  -7.215
  307   1HG2  ILE  44          3HG2      ILE  44   0.069  -6.007  -6.007
  308   2HG2  ILE  44          2HG2      ILE  44   1.682  -5.370  -5.370
  309   3HG2  ILE  44          1HG2      ILE  44   0.548  -4.440  -4.440
  310   1HD1  ILE  44          2HD1      ILE  44   0.388  -8.127  -8.127
  311   2HD1  ILE  44          1HD1      ILE  44   0.854  -9.048  -9.048
  312   3HD1  ILE  44          3HD1      ILE  44   1.762  -9.231  -9.231
  313    H    HIS  45           H        HIS  45  -2.245  -6.151  -6.151
  314    HA   HIS  45           HA       HIS  45  -2.421  -3.641  -3.641
  315   1HB   HIS  45          2HB       HIS  45  -4.210  -5.694  -5.694
  316   2HB   HIS  45          1HB       HIS  45  -4.819  -4.158  -4.158
  317    HD1  HIS  45           HD1      HIS  45  -3.819  -5.816  -5.816
  318    HD2  HIS  45           HD2      HIS  45  -6.033  -2.579  -2.579
  319    HE1  HIS  45           HE1      HIS  45  -4.988  -4.895  -4.895
  320    HE2  HIS  45           HE2      HIS  45  -6.397  -2.996  -2.996
  321    H    ILE  46           H        ILE  46  -2.381  -1.660  -1.660
  322    HA   ILE  46           HA       ILE  46  -2.669  -1.198  -1.198
  323    HB   ILE  46           HB       ILE  46  -0.666  -0.009  -0.009
  324   1HG1  ILE  46          2HG1      ILE  46  -0.664  -2.037  -2.037
  325   2HG1  ILE  46          1HG1      ILE  46   0.672  -1.502  -1.502
  326   1HG2  ILE  46          2HG2      ILE  46  -1.552   1.045   1.045
  327   2HG2  ILE  46          1HG2      ILE  46  -0.040   1.510   1.510
  328   3HG2  ILE  46          3HG2      ILE  46  -1.584   1.882   1.882
  329   1HD1  ILE  46          2HD1      ILE  46  -0.084  -0.126  -0.126
  330   2HD1  ILE  46          1HD1      ILE  46   1.048  -1.474  -1.474
  331   3HD1  ILE  46          3HD1      ILE  46   1.413   0.023   0.023
  332    H    ARG  47           H        ARG  47  -4.597  -0.310  -0.310
  333    HA   ARG  47           HA       ARG  47  -5.493   1.598   1.598
  334   1HB   ARG  47          2HB       ARG  47  -6.783  -0.479  -0.479
  335   2HB   ARG  47          1HB       ARG  47  -7.468   0.995   0.995
  336   1HG   ARG  47          2HG       ARG  47  -8.671   1.363   1.363
  337   2HG   ARG  47          1HG       ARG  47  -7.271   1.141   1.141
  338   1HD   ARG  47          2HD       ARG  47  -7.574  -1.257  -1.257
  339   2HD   ARG  47          1HD       ARG  47  -8.896  -1.100  -1.100
  340    HE   ARG  47           HE       ARG  47  -9.733   0.388   0.388
  341   1HH1  ARG  47          2HH1      ARG  47  -8.538  -2.880  -2.880
  342   2HH1  ARG  47          1HH1      ARG  47  -9.465  -3.465  -3.465
  343   1HH2  ARG  47          1HH2      ARG  47 -10.954  -0.381  -0.381
  344   2HH2  ARG  47          2HH2      ARG  47 -10.837  -2.047  -2.047
  345    H    ILE  48           H        ILE  48  -6.826   3.425   3.425
  346    HA   ILE  48           HA       ILE  48  -5.989   4.563   4.563
  347    HB   ILE  48           HB       ILE  48  -4.752   5.379   5.379
  348   1HG1  ILE  48          2HG1      ILE  48  -5.515   7.139   7.139
  349   2HG1  ILE  48          1HG1      ILE  48  -4.130   6.052   6.052
  350   1HG2  ILE  48          2HG2      ILE  48  -7.123   6.211   6.211
  351   2HG2  ILE  48          1HG2      ILE  48  -6.730   7.578   7.578
  352   3HG2  ILE  48          3HG2      ILE  48  -5.691   7.185   7.185
  353   1HD1  ILE  48          1HD1      ILE  48  -3.853   7.659   7.659
  354   2HD1  ILE  48          3HD1      ILE  48  -4.409   8.756   8.756
  355   3HD1  ILE  48          2HD1      ILE  48  -2.955   7.789   7.789
  356    H    GLN  49           H        GLN  49  -7.564   5.846   5.846
  357    HA   GLN  49           HA       GLN  49 -10.069   6.189   6.189
  358   1HB   GLN  49          2HB       GLN  49 -11.287   5.720   5.720
  359   2HB   GLN  49          1HB       GLN  49 -10.493   4.335   4.335
  360   1HG   GLN  49          2HG       GLN  49  -8.594   5.415   5.415
  361   2HG   GLN  49          1HG       GLN  49 -10.118   5.509   5.509
  362   1HE2  GLN  49          2HE2      GLN  49 -10.244   2.138   2.138
  363   2HE2  GLN  49          1HE2      GLN  49 -10.879   3.731   3.731
  364    H    GLN  50           H        GLN  50  -9.703   8.352   8.352
  365    HA   GLN  50           HA       GLN  50  -9.287  10.123  10.123
  366   1HB   GLN  50          2HB       GLN  50  -8.099  10.274  10.274
  367   2HB   GLN  50          1HB       GLN  50  -9.589  11.055  11.055
  368   1HG   GLN  50          2HG       GLN  50  -9.244  12.901  12.901
  369   2HG   GLN  50          1HG       GLN  50  -8.200  12.031  12.031
  370   1HE2  GLN  50          2HE2      GLN  50  -5.603  13.797  13.797
  371   2HE2  GLN  50          1HE2      GLN  50  -6.619  13.629  13.629
  372    H    ARG  51           H        ARG  51 -11.175  10.302  10.302
  373    HA   ARG  51           HA       ARG  51 -13.657  10.777  10.777
  374   1HB   ARG  51          2HB       ARG  51 -13.476  10.915  10.915
  375   2HB   ARG  51          1HB       ARG  51 -14.771  10.292  10.292
  376   1HG   ARG  51          2HG       ARG  51 -12.165   8.960   8.960
  377   2HG   ARG  51          1HG       ARG  51 -13.796   8.445   8.445
  378   1HD   ARG  51          2HD       ARG  51 -13.855   8.613   8.613
  379   2HD   ARG  51          1HD       ARG  51 -12.262   7.944   7.944
  380    HE   ARG  51           HE       ARG  51 -13.263   6.002   6.002
  381   1HH1  ARG  51          2HH1      ARG  51 -15.678   8.516   8.516
  382   2HH1  ARG  51          1HH1      ARG  51 -17.005   7.431   7.431
  383   1HH2  ARG  51          1HH2      ARG  51 -15.008   4.575   4.575
  384   2HH2  ARG  51          2HH2      ARG  51 -16.625   5.194   5.194
  385    H    ASN  52           H        ASN  52 -14.753  12.681  12.681
  386    HA   ASN  52           HA       ASN  52 -15.124  14.923  14.923
  387   1HB   ASN  52          2HB       ASN  52 -15.161  14.403  14.403
  388   2HB   ASN  52          1HB       ASN  52 -13.491  14.958  14.958
  389   1HD2  ASN  52          2HD2      ASN  52 -14.276  18.326  18.326
  390   2HD2  ASN  52          1HD2      ASN  52 -13.066  17.093  17.093
  391    H    GLY  53           H        GLY  53 -12.585  13.745  13.745
  392   1HA   GLY  53          2HA       GLY  53 -10.742  14.532  14.532
  393   2HA   GLY  53          1HA       GLY  53 -11.437  16.135  16.135
  394    H    ARG  54           H        ARG  54 -10.366  13.871  13.871
  395    HA   ARG  54           HA       ARG  54  -7.886  15.098  15.098
  396   1HB   ARG  54          2HB       ARG  54  -8.322  16.458  16.458
  397   2HB   ARG  54          1HB       ARG  54  -9.438  16.969  16.969
  398   1HG   ARG  54          2HG       ARG  54 -11.240  15.739  15.739
  399   2HG   ARG  54          1HG       ARG  54 -10.131  15.131  15.131
  400   1HD   ARG  54          2HD       ARG  54 -10.767  18.041  18.041
  401   2HD   ARG  54          1HD       ARG  54 -11.499  17.037  17.037
  402    HE   ARG  54           HE       ARG  54  -8.635  17.062  17.062
  403   1HH1  ARG  54          2HH1      ARG  54 -11.530  18.758  18.758
  404   2HH1  ARG  54          1HH1      ARG  54 -10.778  19.527  19.527
  405   1HH2  ARG  54          1HH2      ARG  54  -7.645  18.072  18.072
  406   2HH2  ARG  54          2HH2      ARG  54  -8.573  19.138  19.138
  407    H    LYS  55           H        LYS  55 -10.662  13.498  13.498
  408    HA   LYS  55           HA       LYS  55  -9.155  12.180  12.180
  409   1HB   LYS  55          2HB       LYS  55 -11.841  12.515  12.515
  410   2HB   LYS  55          1HB       LYS  55 -11.594  10.799  10.799
  411   1HG   LYS  55          2HG       LYS  55 -12.201  10.911  10.911
  412   2HG   LYS  55          1HG       LYS  55 -10.441  10.796  10.796
  413   1HD   LYS  55          2HD       LYS  55 -10.851  13.502  13.502
  414   2HD   LYS  55          1HD       LYS  55 -12.215  12.964  12.964
  415   1HE   LYS  55          2HE       LYS  55 -10.751  11.927  11.927
  416   2HE   LYS  55          1HE       LYS  55  -9.352  12.198  12.198
  417   1HZ   LYS  55          3HZ       LYS  55 -10.229  14.688  14.688
  418   2HZ   LYS  55          2HZ       LYS  55 -10.725  14.040  14.040
  419   3HZ   LYS  55          1HZ       LYS  55  -9.095  13.977  13.977
  420    H    THR  56           H        THR  56  -7.405  11.550  11.550
  421    HA   THR  56           HA       THR  56  -7.989   9.267   9.267
  422    HB   THR  56           HB       THR  56  -5.176   9.994   9.994
  423    HG1  THR  56           HG1      THR  56  -5.324  11.962  11.962
  424   1HG2  THR  56          1HG2      THR  56  -6.857   9.061   9.061
  425   2HG2  THR  56          3HG2      THR  56  -5.801  10.386  10.386
  426   3HG2  THR  56          2HG2      THR  56  -5.114   8.927   8.927
  427    H    LEU  57           H        LEU  57  -7.278   7.198   7.198
  428    HA   LEU  57           HA       LEU  57  -5.771   6.503   6.503
  429   1HB   LEU  57          2HB       LEU  57  -8.635   6.143   6.143
  430   2HB   LEU  57          1HB       LEU  57  -7.821   4.609   4.609
  431    HG   LEU  57           HG       LEU  57  -7.233   6.922   6.922
  432   1HD1  LEU  57          2HD1      LEU  57  -9.772   5.514   5.514
  433   2HD1  LEU  57          1HD1      LEU  57  -9.076   5.426   5.426
  434   3HD1  LEU  57          3HD1      LEU  57  -9.373   6.995   6.995
  435   1HD2  LEU  57          2HD2      LEU  57  -6.535   4.141   4.141
  436   2HD2  LEU  57          1HD2      LEU  57  -5.911   5.388   5.388
  437   3HD2  LEU  57          3HD2      LEU  57  -7.351   4.474   4.474
  438    H    THR  58           H        THR  58  -4.156   5.843   5.843
  439    HA   THR  58           HA       THR  58  -4.554   4.136   4.136
  440    HB   THR  58           HB       THR  58  -2.068   4.497   4.497
  441    HG1  THR  58           HG1      THR  58  -3.187   6.372   6.372
  442   1HG2  THR  58          1HG2      THR  58  -2.525   3.261   3.261
  443   2HG2  THR  58          3HG2      THR  58  -1.008   4.089   4.089
  444   3HG2  THR  58          2HG2      THR  58  -1.509   2.714   2.714
  445    H    THR  59           H        THR  59  -4.932   2.024   2.024
  446    HA   THR  59           HA       THR  59  -4.482   0.367   0.367
  447    HB   THR  59           HB       THR  59  -6.182  -1.102  -1.102
  448    HG1  THR  59           HG1      THR  59  -7.028   1.601   1.601
  449   1HG2  THR  59          2HG2      THR  59  -6.549   0.610   0.610
  450   2HG2  THR  59          1HG2      THR  59  -8.002   0.107   0.107
  451   3HG2  THR  59          3HG2      THR  59  -6.886  -1.105  -1.105
  452    H    VAL  60           H        VAL  60  -3.950  -1.914  -1.914
  453    HA   VAL  60           HA       VAL  60  -2.506  -2.305  -2.305
  454    HB   VAL  60           HB       VAL  60  -1.449  -3.131  -3.131
  455   1HG1  VAL  60          2HG1      VAL  60  -0.830  -4.644  -4.644
  456   2HG1  VAL  60          1HG1      VAL  60  -0.178  -3.272  -3.272
  457   3HG1  VAL  60          3HG1      VAL  60   0.566  -3.766  -3.766
  458   1HG2  VAL  60          3HG2      VAL  60  -1.146  -0.687  -0.687
  459   2HG2  VAL  60          2HG2      VAL  60  -0.853  -0.971  -0.971
  460   3HG2  VAL  60          1HG2      VAL  60   0.375  -1.406  -1.406
  461    H    GLN  61           H        GLN  61  -3.036  -4.113  -4.113
  462    HA   GLN  61           HA       GLN  61  -4.194  -6.324  -6.324
  463   1HB   GLN  61          2HB       GLN  61  -5.088  -6.373  -6.373
  464   2HB   GLN  61          1HB       GLN  61  -6.041  -6.331  -6.331
  465   1HG   GLN  61          2HG       GLN  61  -5.693  -3.847  -3.847
  466   2HG   GLN  61          1HG       GLN  61  -4.982  -3.996  -3.996
  467   1HE2  GLN  61          2HE2      GLN  61  -8.323  -5.360  -5.360
  468   2HE2  GLN  61          1HE2      GLN  61  -6.795  -6.112  -6.112
  469    H    GLY  62           H        GLY  62  -3.595  -8.401  -8.401
  470   1HA   GLY  62          2HA       GLY  62  -2.604  -9.953  -9.953
  471   2HA   GLY  62          1HA       GLY  62  -1.569  -8.643  -8.643
  472    H    ILE  63           H        ILE  63  -1.122  -7.773  -7.773
  473    HA   ILE  63           HA       ILE  63   1.268  -9.158  -9.158
  474    HB   ILE  63           HB       ILE  63  -0.376  -7.328  -7.328
  475   1HG1  ILE  63          2HG1      ILE  63   0.588  -5.952  -5.952
  476   2HG1  ILE  63          1HG1      ILE  63   1.882  -5.985  -5.985
  477   1HG2  ILE  63          3HG2      ILE  63   1.894  -9.004  -9.004
  478   2HG2  ILE  63          2HG2      ILE  63   2.073  -7.301  -7.301
  479   3HG2  ILE  63          1HG2      ILE  63   0.680  -8.210  -8.210
  480   1HD1  ILE  63          3HD1      ILE  63   2.829  -7.921  -7.921
  481   2HD1  ILE  63          2HD1      ILE  63   1.720  -7.366  -7.366
  482   3HD1  ILE  63          1HD1      ILE  63   2.965  -6.281  -6.281
  483    H    ALA  64           H        ALA  64   1.856 -10.672 -10.672
  484    HA   ALA  64           HA       ALA  64  -0.197 -12.571 -12.571
  485   1HB   ALA  64          1HB       ALA  64   2.303 -12.960 -12.960
  486   2HB   ALA  64          3HB       ALA  64   2.591 -12.841 -12.841
  487   3HB   ALA  64          2HB       ALA  64   1.492 -14.069 -14.069
  488    H    ASP  65           H        ASP  65  -0.866 -13.176 -13.176
  489    HA   ASP  65           HA       ASP  65  -0.877 -11.126 -11.126
  490   1HB   ASP  65          2HB       ASP  65  -2.771 -12.694 -12.694
  491   2HB   ASP  65          1HB       ASP  65  -1.778 -14.001 -14.001
  492    H    ASP  66           H        ASP  66   1.397 -13.480 -13.480
  493    HA   ASP  66           HA       ASP  66   2.327 -13.798 -13.798
  494   1HB   ASP  66          2HB       ASP  66   2.216 -15.672 -15.672
  495   2HB   ASP  66          1HB       ASP  66   3.708 -14.953 -14.953
  496    H    TYR  67           H        TYR  67   2.483 -11.214 -11.214
  497    HA   TYR  67           HA       TYR  67   5.341 -10.850 -10.850
  498   1HB   TYR  67          2HB       TYR  67   2.908  -9.156  -9.156
  499   2HB   TYR  67          1HB       TYR  67   4.503  -8.416  -8.416
  500    HD1  TYR  67           HD1      TYR  67   4.359 -11.792 -11.792
  501    HD2  TYR  67           HD2      TYR  67   3.998  -7.680  -7.680
  502    HE1  TYR  67           HE1      TYR  67   4.674 -12.353 -12.353
  503    HE2  TYR  67           HE2      TYR  67   4.307  -8.220  -8.220
  504    HH   TYR  67           HH       TYR  67   3.967 -11.195 -11.195
  505    H    ASP  68           H        ASP  68   4.159 -11.406 -11.406
  506    HA   ASP  68           HA       ASP  68   4.805 -10.861 -10.861
  507   1HB   ASP  68          2HB       ASP  68   6.731  -9.635  -9.635
  508   2HB   ASP  68          1HB       ASP  68   5.868  -8.192  -8.192
  509    H    LYS  69           H        LYS  69   2.861  -8.927  -8.927
  510    HA   LYS  69           HA       LYS  69   1.046  -7.624  -7.624
  511   1HB   LYS  69          2HB       LYS  69   0.293  -9.451  -9.451
  512   2HB   LYS  69          1HB       LYS  69   1.244  -8.845  -8.845
  513   1HG   LYS  69          2HG       LYS  69  -0.363  -6.701  -6.701
  514   2HG   LYS  69          1HG       LYS  69  -1.412  -8.111  -8.111
  515   1HD   LYS  69          2HD       LYS  69   0.293  -7.678  -7.678
  516   2HD   LYS  69          1HD       LYS  69  -1.307  -6.949  -6.949
  517   1HE   LYS  69          2HE       LYS  69  -1.981  -9.424  -9.424
  518   2HE   LYS  69          1HE       LYS  69  -0.534  -9.807  -9.807
  519   1HZ   LYS  69          1HZ       LYS  69  -2.665  -8.048  -8.048
  520   2HZ   LYS  69          3HZ       LYS  69  -2.712  -9.729  -9.729
  521   3HZ   LYS  69          2HZ       LYS  69  -1.438  -8.837  -8.837
  522    H    LYS  70           H        LYS  70   2.419  -7.381  -7.381
  523    HA   LYS  70           HA       LYS  70   2.070  -4.654  -4.654
  524   1HB   LYS  70          2HB       LYS  70   2.946  -6.619  -6.619
  525   2HB   LYS  70          1HB       LYS  70   4.464  -5.790  -5.790
  526   1HG   LYS  70          2HG       LYS  70   3.429  -4.940  -4.940
  527   2HG   LYS  70          1HG       LYS  70   3.476  -3.689  -3.689
  528   1HD   LYS  70          2HD       LYS  70   1.296  -3.399  -3.399
  529   2HD   LYS  70          1HD       LYS  70   1.046  -4.952  -4.952
  530   1HE   LYS  70          2HE       LYS  70   0.307  -5.835  -5.835
  531   2HE   LYS  70          1HE       LYS  70   1.822  -5.427  -5.427
  532   1HZ   LYS  70          1HZ       LYS  70   0.782  -3.100  -3.100
  533   2HZ   LYS  70          3HZ       LYS  70  -0.688  -3.885  -3.885
  534   3HZ   LYS  70          2HZ       LYS  70   0.244  -4.310  -4.310
  535    H    LYS  71           H        LYS  71   5.262  -6.177  -6.177
  536    HA   LYS  71           HA       LYS  71   6.709  -3.922  -3.922
  537   1HB   LYS  71          2HB       LYS  71   7.126  -6.693  -6.693
  538   2HB   LYS  71          1HB       LYS  71   7.552  -6.055  -6.055
  539   1HG   LYS  71          2HG       LYS  71   9.047  -4.422  -4.422
  540   2HG   LYS  71          1HG       LYS  71   8.686  -5.207  -5.207
  541   1HD   LYS  71          2HD       LYS  71   9.492  -7.360  -7.360
  542   2HD   LYS  71          1HD       LYS  71  10.105  -6.362  -6.362
  543   1HE   LYS  71          2HE       LYS  71  11.712  -5.366  -5.366
  544   2HE   LYS  71          1HE       LYS  71  10.827  -5.679  -5.679
  545   1HZ   LYS  71          3HZ       LYS  71  12.188  -7.745  -7.745
  546   2HZ   LYS  71          2HZ       LYS  71  12.800  -7.078  -7.078
  547   3HZ   LYS  71          1HZ       LYS  71  11.388  -8.008  -8.008
  548    H    LEU  72           H        LEU  72   4.406  -5.528  -5.528
  549    HA   LEU  72           HA       LEU  72   5.205  -4.517  -4.517
  550   1HB   LEU  72          2HB       LEU  72   3.424  -6.309  -6.309
  551   2HB   LEU  72          1HB       LEU  72   2.325  -4.946  -4.946
  552    HG   LEU  72           HG       LEU  72   3.865  -5.897  -5.897
  553   1HD1  LEU  72          2HD1      LEU  72   1.728  -7.074  -7.074
  554   2HD1  LEU  72          1HD1      LEU  72   0.896  -5.628  -5.628
  555   3HD1  LEU  72          3HD1      LEU  72   1.834  -6.608  -6.608
  556   1HD2  LEU  72          3HD2      LEU  72   2.252  -3.410  -3.410
  557   2HD2  LEU  72          2HD2      LEU  72   3.865  -3.567  -3.567
  558   3HD2  LEU  72          1HD2      LEU  72   2.454  -4.096  -4.096
  559    H    VAL  73           H        VAL  73   2.375  -3.396  -3.396
  560    HA   VAL  73           HA       VAL  73   2.447  -0.852  -0.852
  561    HB   VAL  73           HB       VAL  73   0.316  -2.007  -2.007
  562   1HG1  VAL  73          2HG1      VAL  73   1.178  -2.698  -2.698
  563   2HG1  VAL  73          1HG1      VAL  73   0.715  -1.076  -1.076
  564   3HG1  VAL  73          3HG1      VAL  73  -0.504  -2.179  -2.179
  565   1HG2  VAL  73          2HG2      VAL  73   0.836   0.635   0.635
  566   2HG2  VAL  73          1HG2      VAL  73  -0.782  -0.041  -0.041
  567   3HG2  VAL  73          3HG2      VAL  73   0.101   0.531   0.531
  568    H    LYS  74           H        LYS  74   3.059  -2.047  -2.047
  569    HA   LYS  74           HA       LYS  74   3.297   0.281   0.281
  570   1HB   LYS  74          2HB       LYS  74   3.581  -2.049  -2.049
  571   2HB   LYS  74          1HB       LYS  74   5.213  -2.042  -2.042
  572   1HG   LYS  74          2HG       LYS  74   5.245   0.238   0.238
  573   2HG   LYS  74          1HG       LYS  74   4.135  -0.753  -0.753
  574   1HD   LYS  74          2HD       LYS  74   5.765  -2.482  -2.482
  575   2HD   LYS  74          1HD       LYS  74   6.842  -1.701  -1.701
  576   1HE   LYS  74          2HE       LYS  74   6.859   0.275   0.275
  577   2HE   LYS  74          1HE       LYS  74   6.146  -0.836  -0.836
  578   1HZ   LYS  74          2HZ       LYS  74   8.065  -2.298  -2.298
  579   2HZ   LYS  74          1HZ       LYS  74   8.753  -1.187  -1.187
  580   3HZ   LYS  74          3HZ       LYS  74   8.532  -0.768  -0.768
  581    H    ALA  75           H        ALA  75   5.726  -1.190  -1.190
  582    HA   ALA  75           HA       ALA  75   7.795   0.649   0.649
  583   1HB   ALA  75          2HB       ALA  75   7.231  -1.302  -1.302
  584   2HB   ALA  75          1HB       ALA  75   8.524  -0.122  -0.122
  585   3HB   ALA  75          3HB       ALA  75   8.571  -1.247  -1.247
  586    H    PHE  76           H        PHE  76   5.008   0.762   0.762
  587    HA   PHE  76           HA       PHE  76   5.805   2.808   2.808
  588   1HB   PHE  76          2HB       PHE  76   3.660   1.284   1.284
  589   2HB   PHE  76          1HB       PHE  76   2.965   2.620   2.620
  590    HD1  PHE  76           HD1      PHE  76   4.379   1.598   1.598
  591    HD2  PHE  76           HD2      PHE  76   2.452   4.709   4.709
  592    HE1  PHE  76           HE1      PHE  76   3.942   2.796   2.796
  593    HE2  PHE  76           HE2      PHE  76   2.010   5.908   5.908
  594    HZ   PHE  76           HZ       PHE  76   2.756   4.951   4.951
  595    H    LYS  77           H        LYS  77   4.121   2.946   2.946
  596    HA   LYS  77           HA       LYS  77   3.920   5.781   5.781
  597   1HB   LYS  77          2HB       LYS  77   3.842   3.861   3.861
  598   2HB   LYS  77          1HB       LYS  77   3.221   5.507   5.507
  599   1HG   LYS  77          2HG       LYS  77   1.264   4.787   4.787
  600   2HG   LYS  77          1HG       LYS  77   2.032   4.055   4.055
  601   1HD   LYS  77          2HD       LYS  77   1.237   2.137   2.137
  602   2HD   LYS  77          1HD       LYS  77   2.665   2.246   2.246
  603   1HE   LYS  77          2HE       LYS  77   1.434   3.124   3.124
  604   2HE   LYS  77          1HE       LYS  77   0.057   3.518   3.518
  605   1HZ   LYS  77          2HZ       LYS  77   0.874   0.711   0.711
  606   2HZ   LYS  77          1HZ       LYS  77   0.017   1.424   1.424
  607   3HZ   LYS  77          3HZ       LYS  77  -0.662   1.363   1.363
  608    H    LYS  78           H        LYS  78   6.564   3.742   3.742
  609    HA   LYS  78           HA       LYS  78   7.981   5.647   5.647
  610   1HB   LYS  78          2HB       LYS  78   8.335   2.749   2.749
  611   2HB   LYS  78          1HB       LYS  78   9.751   3.689   3.689
  612   1HG   LYS  78          2HG       LYS  78   7.431   4.041   4.041
  613   2HG   LYS  78          1HG       LYS  78   8.125   2.418   2.418
  614   1HD   LYS  78          2HD       LYS  78  10.082   4.606   4.606
  615   2HD   LYS  78          1HD       LYS  78   9.015   4.469   4.469
  616   1HE   LYS  78          2HE       LYS  78  10.121   2.689   2.689
  617   2HE   LYS  78          1HE       LYS  78   9.948   1.870   1.870
  618   1HZ   LYS  78          2HZ       LYS  78  11.867   3.372   3.372
  619   2HZ   LYS  78          1HZ       LYS  78  12.133   3.624   3.624
  620   3HZ   LYS  78          3HZ       LYS  78  12.226   2.062   2.062
  621    H    LYS  79           H        LYS  79   7.751   4.489   4.489
  622    HA   LYS  79           HA       LYS  79  10.355   5.580   5.580
  623   1HB   LYS  79          2HB       LYS  79   9.404   3.346   3.346
  624   2HB   LYS  79          1HB       LYS  79   8.376   4.329   4.329
  625   1HG   LYS  79          2HG       LYS  79  11.112   5.191   5.191
  626   2HG   LYS  79          1HG       LYS  79  10.980   3.461   3.461
  627   1HD   LYS  79          2HD       LYS  79   9.511   3.785   3.785
  628   2HD   LYS  79          1HD       LYS  79   9.125   5.432   5.432
  629   1HE   LYS  79          2HE       LYS  79  11.960   4.909   4.909
  630   2HE   LYS  79          1HE       LYS  79  10.858   4.816   4.816
  631   1HZ   LYS  79          1HZ       LYS  79  10.011   7.064   7.064
  632   2HZ   LYS  79          3HZ       LYS  79  11.585   7.120   7.120
  633   3HZ   LYS  79          2HZ       LYS  79  11.336   7.024   7.024
  634    H    PHE  80           H        PHE  80   6.915   6.150   6.150
  635    HA   PHE  80           HA       PHE  80   7.619   8.649   8.649
  636   1HB   PHE  80          2HB       PHE  80   4.941   7.287   7.287
  637   2HB   PHE  80          1HB       PHE  80   5.614   8.517   8.517
  638    HD1  PHE  80           HD1      PHE  80   5.628   4.971   4.971
  639    HD2  PHE  80           HD2      PHE  80   7.184   7.939   7.939
  640    HE1  PHE  80           HE1      PHE  80   6.447   3.206   3.206
  641    HE2  PHE  80           HE2      PHE  80   8.006   6.179   6.179
  642    HZ   PHE  80           HZ       PHE  80   7.638   3.809   3.809
  643    H    ALA  81           H        ALA  81   6.124   7.311   7.311
  644    HA   ALA  81           HA       ALA  81   5.271   8.321   8.321
  645   1HB   ALA  81          2HB       ALA  81   6.873  10.250  10.250
  646   2HB   ALA  81          1HB       ALA  81   5.318  11.057  11.057
  647   3HB   ALA  81          3HB       ALA  81   5.802  10.476  10.476
  648    H    CYS  82           H        CYS  82   3.692   7.415   7.415
  649    HA   CYS  82           HA       CYS  82   1.382   9.227   9.227
  650   1HB   CYS  82          2HB       CYS  82   2.030   6.971   6.971
  651   2HB   CYS  82          1HB       CYS  82   0.529   7.890   7.890
  652    HG   CYS  82           HG       CYS  82   1.898   9.989   9.989
  653    H    ASN  83           H        ASN  83  -0.741   7.723   7.723
  654    HA   ASN  83           HA       ASN  83  -0.716   5.862   5.862
  655   1HB   ASN  83          2HB       ASN  83  -2.295   7.414   7.414
  656   2HB   ASN  83          1HB       ASN  83  -2.707   7.815   7.815
  657   1HD2  ASN  83          2HD2      ASN  83  -5.125   5.269   5.269
  658   2HD2  ASN  83          1HD2      ASN  83  -3.948   6.189   6.189
  659    H    GLY  84           H        GLY  84  -0.712   3.791   3.791
  660   1HA   GLY  84          2HA       GLY  84  -2.149   3.004   3.004
  661   2HA   GLY  84          1HA       GLY  84  -0.614   2.289   2.289
  662    H    THR  85           H        THR  85  -3.641   1.470   1.470
  663    HA   THR  85           HA       THR  85  -3.637  -0.166  -0.166
  664    HB   THR  85           HB       THR  85  -6.020  -0.008  -0.008
  665    HG1  THR  85           HG1      THR  85  -6.768   0.030   0.030
  666   1HG2  THR  85          3HG2      THR  85  -4.408   2.289   2.289
  667   2HG2  THR  85          2HG2      THR  85  -5.929   2.780   2.780
  668   3HG2  THR  85          1HG2      THR  85  -5.936   1.954   1.954
  669    H    VAL  86           H        VAL  86  -5.063  -2.144  -2.144
  670    HA   VAL  86           HA       VAL  86  -4.735  -3.293  -3.293
  671    HB   VAL  86           HB       VAL  86  -3.209  -4.302  -4.302
  672   1HG1  VAL  86          2HG1      VAL  86  -5.240  -3.997  -3.997
  673   2HG1  VAL  86          1HG1      VAL  86  -5.287  -5.731  -5.731
  674   3HG1  VAL  86          3HG1      VAL  86  -3.798  -4.978  -4.978
  675   1HG2  VAL  86          2HG2      VAL  86  -5.416  -5.956  -5.956
  676   2HG2  VAL  86          1HG2      VAL  86  -3.745  -5.786  -5.786
  677   3HG2  VAL  86          3HG2      VAL  86  -4.112  -6.710  -6.710
  678    H    ILE  87           H        ILE  87  -6.700  -3.339  -3.339
  679    HA   ILE  87           HA       ILE  87  -8.982  -4.235  -4.235
  680    HB   ILE  87           HB       ILE  87 -10.433  -3.079  -3.079
  681   1HG1  ILE  87          2HG1      ILE  87  -7.867  -1.842  -1.842
  682   2HG1  ILE  87          1HG1      ILE  87  -8.734  -3.124  -3.124
  683   1HG2  ILE  87          1HG2      ILE  87  -9.783  -2.016  -2.016
  684   2HG2  ILE  87          3HG2      ILE  87  -8.393  -1.288  -1.288
  685   3HG2  ILE  87          2HG2      ILE  87 -10.029  -0.837  -0.837
  686   1HD1  ILE  87          2HD1      ILE  87 -10.724  -1.355  -1.355
  687   2HD1  ILE  87          1HD1      ILE  87  -9.346  -0.257  -0.257
  688   3HD1  ILE  87          3HD1      ILE  87  -9.648  -1.383  -1.383
  689    H    GLU  88           H        GLU  88 -10.510  -5.651  -5.651
  690    HA   GLU  88           HA       GLU  88  -9.377  -7.312  -7.312
  691   1HB   GLU  88          2HB       GLU  88 -10.105  -8.216  -8.216
  692   2HB   GLU  88          1HB       GLU  88 -11.734  -8.102  -8.102
  693   1HG   GLU  88          2HG       GLU  88 -10.982  -9.521  -9.521
  694   2HG   GLU  88          1HG       GLU  88  -9.453  -9.747  -9.747
  695    H    HIS  89           H        HIS  89 -10.095  -5.552  -5.552
  696    HA   HIS  89           HA       HIS  89 -12.734  -4.849  -4.849
  697   1HB   HIS  89          2HB       HIS  89 -10.410  -4.101  -4.101
  698   2HB   HIS  89          1HB       HIS  89 -10.936  -5.199  -5.199
  699    HD1  HIS  89           HD1      HIS  89 -12.427  -4.217  -4.217
  700    HD2  HIS  89           HD2      HIS  89 -12.430  -2.002  -2.002
  701    HE1  HIS  89           HE1      HIS  89 -13.834  -2.190  -2.190
  702    HE2  HIS  89           HE2      HIS  89 -13.884  -0.900  -0.900
  703    HA   PRO  90           HA       PRO  90 -14.416  -8.635  -8.635
  704   1HB   PRO  90          2HB       PRO  90 -16.812  -7.719  -7.719
  705   2HB   PRO  90          1HB       PRO  90 -16.395  -7.866  -7.866
  706   1HG   PRO  90          2HG       PRO  90 -16.397  -5.436  -5.436
  707   2HG   PRO  90          1HG       PRO  90 -16.974  -5.615  -5.615
  708   1HD   PRO  90          2HD       PRO  90 -14.538  -4.548  -4.548
  709   2HD   PRO  90          1HD       PRO  90 -14.876  -5.347  -5.347
  710    H    GLU  91           H        GLU  91 -13.914  -5.756  -5.756
  711    HA   GLU  91           HA       GLU  91 -14.680  -6.886  -6.886
  712   1HB   GLU  91          2HB       GLU  91 -14.161  -4.305  -4.305
  713   2HB   GLU  91          1HB       GLU  91 -13.008  -4.576  -4.576
  714   1HG   GLU  91          2HG       GLU  91 -15.056  -3.492  -3.492
  715   2HG   GLU  91          1HG       GLU  91 -14.797  -5.059  -5.059
  716    H    TYR  92           H        TYR  92 -11.826  -6.728  -6.728
  717    HA   TYR  92           HA       TYR  92 -10.279  -7.910  -7.910
  718   1HB   TYR  92          2HB       TYR  92  -8.905  -6.453  -6.453
  719   2HB   TYR  92          1HB       TYR  92  -8.389  -6.694  -6.694
  720    HD1  TYR  92           HD2      TYR  92 -10.521  -5.680  -5.680
  721    HD2  TYR  92           HD1      TYR  92  -9.068  -4.186  -4.186
  722    HE1  TYR  92           HE2      TYR  92 -11.352  -3.444  -3.444
  723    HE2  TYR  92           HE1      TYR  92  -9.895  -1.943  -1.943
  724    HH   TYR  92           HH       TYR  92 -12.098  -1.301  -1.301
  725    H    GLY  93           H        GLY  93 -10.463  -7.668  -7.668
  726   1HA   GLY  93          2HA       GLY  93 -10.654  -9.607  -9.607
  727   2HA   GLY  93          1HA       GLY  93  -9.857 -10.542 -10.542
  728    H    GLU  94           H        GLU  94  -9.452  -8.629  -8.629
  729    HA   GLU  94           HA       GLU  94  -7.665  -8.220  -8.220
  730   1HB   GLU  94          2HB       GLU  94  -7.351 -10.709 -10.709
  731   2HB   GLU  94          1HB       GLU  94  -6.153 -10.259 -10.259
  732   1HG   GLU  94          2HG       GLU  94  -5.165  -8.870  -8.870
  733   2HG   GLU  94          1HG       GLU  94  -6.037 -10.074 -10.074
  734    H    VAL  95           H        VAL  95  -7.377  -6.106  -6.106
  735    HA   VAL  95           HA       VAL  95  -4.918  -5.764  -5.764
  736    HB   VAL  95           HB       VAL  95  -5.959  -3.869  -3.869
  737   1HG1  VAL  95          2HG1      VAL  95  -5.746  -6.351  -6.351
  738   2HG1  VAL  95          1HG1      VAL  95  -7.505  -6.341  -6.341
  739   3HG1  VAL  95          3HG1      VAL  95  -6.688  -5.213  -5.213
  740   1HG2  VAL  95          2HG2      VAL  95  -7.994  -4.068  -4.068
  741   2HG2  VAL  95          1HG2      VAL  95  -8.112  -3.255  -3.255
  742   3HG2  VAL  95          3HG2      VAL  95  -8.674  -4.918  -4.918
  743    H    ILE  96           H        ILE  96  -3.645  -4.116  -4.116
  744    HA   ILE  96           HA       ILE  96  -4.268  -2.898  -2.898
  745    HB   ILE  96           HB       ILE  96  -1.936  -2.833  -2.833
  746   1HG1  ILE  96          2HG1      ILE  96  -2.458  -4.471  -4.471
  747   2HG1  ILE  96          1HG1      ILE  96  -0.816  -3.888  -3.888
  748   1HG2  ILE  96          3HG2      ILE  96  -2.373  -0.834  -0.834
  749   2HG2  ILE  96          2HG2      ILE  96  -0.804  -1.173  -1.173
  750   3HG2  ILE  96          1HG2      ILE  96  -2.106  -0.501  -0.501
  751   1HD1  ILE  96          2HD1      ILE  96  -1.283  -2.143  -2.143
  752   2HD1  ILE  96          1HD1      ILE  96  -2.814  -2.956  -2.956
  753   3HD1  ILE  96          3HD1      ILE  96  -1.295  -3.804  -3.804
  754    H    GLN  97           H        GLN  97  -4.340  -0.594  -0.594
  755    HA   GLN  97           HA       GLN  97  -5.201   0.993   0.993
  756   1HB   GLN  97          2HB       GLN  97  -6.941   0.021   0.021
  757   2HB   GLN  97          1HB       GLN  97  -6.600   1.642   1.642
  758   1HG   GLN  97          2HG       GLN  97  -7.084   2.263   2.263
  759   2HG   GLN  97          1HG       GLN  97  -8.012   0.766   0.766
  760   1HE2  GLN  97          2HE2      GLN  97  -9.944   2.258   2.258
  761   2HE2  GLN  97          1HE2      GLN  97  -8.793   0.975   0.975
  762    H    LEU  98           H        LEU  98  -3.566   2.419   2.419
  763    HA   LEU  98           HA       LEU  98  -2.457   3.655   3.655
  764   1HB   LEU  98          2HB       LEU  98  -1.696   4.250   4.250
  765   2HB   LEU  98          1HB       LEU  98  -0.767   4.559   4.559
  766    HG   LEU  98           HG       LEU  98  -1.435   1.730   1.730
  767   1HD1  LEU  98          1HD1      LEU  98  -0.512   3.132   3.132
  768   2HD1  LEU  98          3HD1      LEU  98   1.019   2.852   2.852
  769   3HD1  LEU  98          2HD1      LEU  98   0.025   1.484   1.484
  770   1HD2  LEU  98          1HD2      LEU  98   0.081   3.021   3.021
  771   2HD2  LEU  98          3HD2      LEU  98   0.139   1.303   1.303
  772   3HD2  LEU  98          2HD2      LEU  98   1.279   2.421   2.421
  773    H    GLN  99           H        GLN  99  -2.323   5.979   5.979
  774    HA   GLN  99           HA       GLN  99  -4.786   7.239   7.239
  775   1HB   GLN  99          2HB       GLN  99  -3.003   7.544   7.544
  776   2HB   GLN  99          1HB       GLN  99  -3.306   9.098   9.098
  777   1HG   GLN  99          2HG       GLN  99  -5.688   7.436   7.436
  778   2HG   GLN  99          1HG       GLN  99  -4.881   7.973   7.973
  779   1HE2  GLN  99          2HE2      GLN  99  -7.127  10.495  10.495
  780   2HE2  GLN  99          1HE2      GLN  99  -6.956   8.818   8.818
  781    H    GLY 100           H        GLY 100  -4.901   9.173   9.173
  782   1HA   GLY 100          2HA       GLY 100  -4.276  10.719  10.719
  783   2HA   GLY 100          1HA       GLY 100  -2.660  10.643  10.643
  784    H    ASP 101           H        ASP 101  -2.862  11.014  11.014
  785    HA   ASP 101           HA       ASP 101  -2.869   8.563   8.563
  786   1HB   ASP 101          2HB       ASP 101  -2.015   9.933   9.933
  787   2HB   ASP 101          1HB       ASP 101  -3.438  10.643  10.643
  788    H    GLN 102           H        GLN 102  -1.401   7.120   7.120
  789    HA   GLN 102           HA       GLN 102   1.408   7.939   7.939
  790   1HB   GLN 102          2HB       GLN 102  -0.270   5.942   5.942
  791   2HB   GLN 102          1HB       GLN 102   1.332   5.372   5.372
  792   1HG   GLN 102          2HG       GLN 102   0.955   6.433   6.433
  793   2HG   GLN 102          1HG       GLN 102   2.393   6.866   6.866
  794   1HE2  GLN 102          2HE2      GLN 102  -0.608   9.640   9.640
  795   2HE2  GLN 102          1HE2      GLN 102  -0.942   7.968   7.968
  796    H    ARG 103           H        ARG 103  -0.391   7.085   7.085
  797    HA   ARG 103           HA       ARG 103   0.303   4.697   4.697
  798   1HB   ARG 103          2HB       ARG 103  -0.386   7.347   7.347
  799   2HB   ARG 103          1HB       ARG 103   0.469   6.297   6.297
  800   1HG   ARG 103          2HG       ARG 103  -1.258   4.530   4.530
  801   2HG   ARG 103          1HG       ARG 103  -2.169   5.821   5.821
  802   1HD   ARG 103          2HD       ARG 103  -1.230   5.960   5.960
  803   2HD   ARG 103          1HD       ARG 103  -2.806   5.330   5.330
  804    HE   ARG 103           HE       ARG 103  -3.486   7.482   7.482
  805   1HH1  ARG 103          2HH1      ARG 103  -0.133   7.466   7.466
  806   2HH1  ARG 103          1HH1      ARG 103  -0.056   9.184   9.184
  807   1HH2  ARG 103          1HH2      ARG 103  -3.379   9.738   9.738
  808   2HH2  ARG 103          2HH2      ARG 103  -1.895  10.473  10.473
  809    H    LYS 104           H        LYS 104   2.336   7.529   7.529
  810    HA   LYS 104           HA       LYS 104   4.474   6.272   6.272
  811   1HB   LYS 104          2HB       LYS 104   3.976   9.018   9.018
  812   2HB   LYS 104          1HB       LYS 104   5.629   8.527   8.527
  813   1HG   LYS 104          2HG       LYS 104   5.308   8.520   8.520
  814   2HG   LYS 104          1HG       LYS 104   3.616   8.036   8.036
  815   1HD   LYS 104          2HD       LYS 104   3.578  10.256  10.256
  816   2HD   LYS 104          1HD       LYS 104   3.175  10.361  10.361
  817   1HE   LYS 104          2HE       LYS 104   4.829  12.067  12.067
  818   2HE   LYS 104          1HE       LYS 104   5.343  11.128  11.128
  819   1HZ   LYS 104          1HZ       LYS 104   6.072  10.262  10.262
  820   2HZ   LYS 104          3HZ       LYS 104   6.974  11.461  11.461
  821   3HZ   LYS 104          2HZ       LYS 104   6.840   9.921   9.921
  822    H    ASN 105           H        ASN 105   3.500   6.794   6.794
  823    HA   ASN 105           HA       ASN 105   6.165   6.304   6.304
  824   1HB   ASN 105          2HB       ASN 105   3.512   7.050   7.050
  825   2HB   ASN 105          1HB       ASN 105   4.710   6.298   6.298
  826   1HD2  ASN 105          2HD2      ASN 105   4.925  10.170  10.170
  827   2HD2  ASN 105          1HD2      ASN 105   3.560   9.163   9.163
  828    H    ILE 106           H        ILE 106   3.063   4.635   4.635
  829    HA   ILE 106           HA       ILE 106   3.802   2.385   2.385
  830    HB   ILE 106           HB       ILE 106   1.446   2.973   2.973
  831   1HG1  ILE 106          2HG1      ILE 106   0.670   0.690   0.690
  832   2HG1  ILE 106          1HG1      ILE 106   2.203   0.190   0.190
  833   1HG2  ILE 106          2HG2      ILE 106   1.836   3.516   3.516
  834   2HG2  ILE 106          1HG2      ILE 106   1.972   1.791   1.791
  835   3HG2  ILE 106          3HG2      ILE 106   0.457   2.457   2.457
  836   1HD1  ILE 106          1HD1      ILE 106   2.419   1.455   1.455
  837   2HD1  ILE 106          3HD1      ILE 106   1.555  -0.082  -0.082
  838   3HD1  ILE 106          2HD1      ILE 106   3.205   0.014   0.014
  839    H    CYS 107           H        CYS 107   3.721   2.911   2.911
  840    HA   CYS 107           HA       CYS 107   4.771   0.396   0.396
  841   1HB   CYS 107          2HB       CYS 107   4.672   3.085   3.085
  842   2HB   CYS 107          1HB       CYS 107   5.659   1.811   1.811
  843    HG   CYS 107           HG       CYS 107   2.959   2.039   2.039
  844    H    GLN 108           H        GLN 108   6.169   3.369   3.369
  845    HA   GLN 108           HA       GLN 108   8.903   2.696   2.696
  846   1HB   GLN 108          2HB       GLN 108   8.502   4.997   4.997
  847   2HB   GLN 108          1HB       GLN 108   7.448   4.837   4.837
  848   1HG   GLN 108          2HG       GLN 108   9.267   5.779   5.779
  849   2HG   GLN 108          1HG       GLN 108   9.662   4.077   4.077
  850   1HE2  GLN 108          2HE2      GLN 108  12.392   4.088   4.088
  851   2HE2  GLN 108          1HE2      GLN 108  11.210   3.121   3.121
  852    H    PHE 109           H        PHE 109   6.614   2.300   2.300
  853    HA   PHE 109           HA       PHE 109   8.501   1.499   1.499
  854   1HB   PHE 109          2HB       PHE 109   6.288   2.402   2.402
  855   2HB   PHE 109          1HB       PHE 109   5.518   1.013   1.013
  856    HD1  PHE 109           HD1      PHE 109   8.074   1.777   1.777
  857    HD2  PHE 109           HD2      PHE 109   4.876  -0.731  -0.731
  858    HE1  PHE 109           HE1      PHE 109   8.192   0.559   0.559
  859    HE2  PHE 109           HE2      PHE 109   4.990  -1.956  -1.956
  860    HZ   PHE 109           HZ       PHE 109   6.647  -1.309  -1.309
  861    H    LEU 110           H        LEU 110   6.305  -0.205  -0.205
  862    HA   LEU 110           HA       LEU 110   6.808  -2.815  -2.815
  863   1HB   LEU 110          2HB       LEU 110   5.806  -1.572  -1.572
  864   2HB   LEU 110          1HB       LEU 110   6.285  -3.257  -3.257
  865    HG   LEU 110           HG       LEU 110   4.616  -3.892  -3.892
  866   1HD1  LEU 110          2HD1      LEU 110   4.941  -1.941  -1.941
  867   2HD1  LEU 110          1HD1      LEU 110   3.951  -0.985  -0.985
  868   3HD1  LEU 110          3HD1      LEU 110   3.252  -2.373  -2.373
  869   1HD2  LEU 110          2HD2      LEU 110   3.984  -3.072  -3.072
  870   2HD2  LEU 110          1HD2      LEU 110   2.744  -3.566  -3.566
  871   3HD2  LEU 110          3HD2      LEU 110   3.079  -1.854  -1.854
  872    H    VAL 111           H        VAL 111   8.645  -0.670  -0.670
  873    HA   VAL 111           HA       VAL 111  10.451  -2.802  -2.802
  874    HB   VAL 111           HB       VAL 111  10.572   0.155   0.155
  875   1HG1  VAL 111          2HG1      VAL 111  12.261  -2.164  -2.164
  876   2HG1  VAL 111          1HG1      VAL 111  11.902  -1.012  -1.012
  877   3HG1  VAL 111          3HG1      VAL 111  12.689  -0.464  -0.464
  878   1HG2  VAL 111          3HG2      VAL 111   8.563  -1.296  -1.296
  879   2HG2  VAL 111          2HG2      VAL 111   9.377  -0.204  -0.204
  880   3HG2  VAL 111          1HG2      VAL 111   9.740  -1.930  -1.930
  881    H    GLU 112           H        GLU 112  10.301  -0.113  -0.113
  882    HA   GLU 112           HA       GLU 112  13.077   0.010   0.010
  883   1HB   GLU 112          2HB       GLU 112  10.590   1.006   1.006
  884   2HB   GLU 112          1HB       GLU 112  12.151   1.128   1.128
  885   1HG   GLU 112          2HG       GLU 112  12.278   2.104   2.104
  886   2HG   GLU 112          1HG       GLU 112  11.032   2.934   2.934
  887    H    ILE 113           H        ILE 113  10.320  -1.608  -1.608
  888    HA   ILE 113           HA       ILE 113  12.053  -2.879  -2.879
  889    HB   ILE 113           HB       ILE 113  10.096  -3.678  -3.678
  890   1HG1  ILE 113          2HG1      ILE 113   8.646  -2.990  -2.990
  891   2HG1  ILE 113          1HG1      ILE 113   8.880  -4.590  -4.590
  892   1HG2  ILE 113          2HG2      ILE 113  10.582  -1.147  -1.147
  893   2HG2  ILE 113          1HG2      ILE 113   9.138  -1.047  -1.047
  894   3HG2  ILE 113          3HG2      ILE 113   9.030  -1.696  -1.696
  895   1HD1  ILE 113          3HD1      ILE 113   7.551  -2.915  -2.915
  896   2HD1  ILE 113          2HD1      ILE 113   6.708  -2.858  -2.858
  897   3HD1  ILE 113          1HD1      ILE 113   6.997  -4.407  -4.407
  898    H    GLY 114           H        GLY 114  10.793  -3.559  -3.559
  899   1HA   GLY 114          2HA       GLY 114  11.334  -5.389  -5.389
  900   2HA   GLY 114          1HA       GLY 114  11.958  -6.217  -6.217
  901    H    LEU 115           H        LEU 115   8.800  -4.734  -4.734
  902    HA   LEU 115           HA       LEU 115   7.535  -7.186  -7.186
  903   1HB   LEU 115          2HB       LEU 115   6.968  -4.536  -4.536
  904   2HB   LEU 115          1HB       LEU 115   5.817  -4.976  -4.976
  905    HG   LEU 115           HG       LEU 115   4.809  -6.631  -6.631
  906   1HD1  LEU 115          3HD1      LEU 115   7.247  -6.230  -6.230
  907   2HD1  LEU 115          2HD1      LEU 115   5.743  -6.649  -6.649
  908   3HD1  LEU 115          1HD1      LEU 115   6.398  -7.715  -7.715
  909   1HD2  LEU 115          2HD2      LEU 115   4.717  -3.937  -3.937
  910   2HD2  LEU 115          1HD2      LEU 115   3.626  -5.147  -5.147
  911   3HD2  LEU 115          3HD2      LEU 115   5.033  -4.615  -4.615
  912    H    ALA 116           H        ALA 116   6.602  -4.991  -4.991
  913    HA   ALA 116           HA       ALA 116   5.653  -7.286  -7.286
  914   1HB   ALA 116          1HB       ALA 116   4.322  -5.155  -5.155
  915   2HB   ALA 116          3HB       ALA 116   5.488  -4.394  -4.394
  916   3HB   ALA 116          2HB       ALA 116   4.510  -5.747  -5.747
  917    H    LYS 117           H        LYS 117   5.994  -6.459  -6.459
  918    HA   LYS 117           HA       LYS 117   8.901  -6.163  -6.163
  919   1HB   LYS 117          2HB       LYS 117   7.309  -8.487  -8.487
  920   2HB   LYS 117          1HB       LYS 117   8.026  -7.840  -7.840
  921   1HG   LYS 117          2HG       LYS 117   9.438  -9.541  -9.541
  922   2HG   LYS 117          1HG       LYS 117  10.235  -7.967  -7.967
  923   1HD   LYS 117          2HD       LYS 117   8.719  -8.328  -8.328
  924   2HD   LYS 117          1HD       LYS 117   9.886  -9.633  -9.633
  925   1HE   LYS 117          2HE       LYS 117  11.693  -8.081  -8.081
  926   2HE   LYS 117          1HE       LYS 117  10.584  -6.712  -6.712
  927   1HZ   LYS 117          1HZ       LYS 117   9.911  -7.231  -7.231
  928   2HZ   LYS 117          3HZ       LYS 117  10.998  -8.527  -8.527
  929   3HZ   LYS 117          2HZ       LYS 117  11.575  -6.943  -6.943
  930    H    ASP 118           H        ASP 118   9.572  -5.179  -5.179
  931    HA   ASP 118           HA       ASP 118   7.900  -3.166  -3.166
  932   1HB   ASP 118          2HB       ASP 118  10.231  -2.825  -2.825
  933   2HB   ASP 118          1HB       ASP 118  10.462  -4.347  -4.347
  934    H    ASP 119           H        ASP 119   8.320  -6.463  -6.463
  935    HA   ASP 119           HA       ASP 119   7.005  -6.153  -6.153
  936   1HB   ASP 119          2HB       ASP 119   8.165  -8.376  -8.376
  937   2HB   ASP 119          1HB       ASP 119   6.802  -8.814  -8.814
  938    H    GLN 120           H        GLN 120   6.073  -6.469  -6.469
  939    HA   GLN 120           HA       GLN 120   3.344  -7.252  -7.252
  940   1HB   GLN 120          2HB       GLN 120   4.618  -7.060  -7.060
  941   2HB   GLN 120          1HB       GLN 120   3.017  -7.690  -7.690
  942   1HG   GLN 120          2HG       GLN 120   4.046  -9.501  -9.501
  943   2HG   GLN 120          1HG       GLN 120   5.640  -8.884  -8.884
  944   1HE2  GLN 120          2HE2      GLN 120   3.330 -10.357 -10.357
  945   2HE2  GLN 120          1HE2      GLN 120   2.627  -9.397  -9.397
  946    H    LEU 121           H        LEU 121   5.220  -4.540  -4.540
  947    HA   LEU 121           HA       LEU 121   3.632  -2.921  -2.921
  948   1HB   LEU 121          2HB       LEU 121   5.539  -2.370  -2.370
  949   2HB   LEU 121          1HB       LEU 121   4.591  -1.048  -1.048
  950    HG   LEU 121           HG       LEU 121   6.450  -2.804  -2.804
  951   1HD1  LEU 121          3HD1      LEU 121   7.053  -0.672  -0.672
  952   2HD1  LEU 121          2HD1      LEU 121   7.185  -0.036  -0.036
  953   3HD1  LEU 121          1HD1      LEU 121   8.122  -1.454  -1.454
  954   1HD2  LEU 121          2HD2      LEU 121   4.289  -1.267  -1.267
  955   2HD2  LEU 121          1HD2      LEU 121   5.602  -1.898  -1.898
  956   3HD2  LEU 121          3HD2      LEU 121   5.707  -0.271  -0.271
  957    H    LYS 122           H        LYS 122   1.456  -3.176  -3.176
  958    HA   LYS 122           HA       LYS 122   0.427  -2.180  -2.180
  959   1HB   LYS 122          2HB       LYS 122  -0.461  -4.360  -4.360
  960   2HB   LYS 122          1HB       LYS 122  -1.719  -3.426  -3.426
  961   1HG   LYS 122          2HG       LYS 122   0.555  -4.690  -4.690
  962   2HG   LYS 122          1HG       LYS 122  -0.962  -5.530  -5.530
  963   1HD   LYS 122          2HD       LYS 122  -2.098  -4.333  -4.333
  964   2HD   LYS 122          1HD       LYS 122  -1.250  -2.837  -2.837
  965   1HE   LYS 122          2HE       LYS 122   0.765  -3.917  -3.917
  966   2HE   LYS 122          1HE       LYS 122  -0.408  -5.055  -5.055
  967   1HZ   LYS 122          3HZ       LYS 122  -1.653  -2.915  -2.915
  968   2HZ   LYS 122          2HZ       LYS 122  -0.149  -2.166  -2.166
  969   3HZ   LYS 122          1HZ       LYS 122  -0.329  -3.429  -3.429
  970    H    VAL 123           H        VAL 123   0.548   0.009   0.009
  971    HA   VAL 123           HA       VAL 123  -1.064   0.749   0.749
  972    HB   VAL 123           HB       VAL 123   1.114   1.841   1.841
  973   1HG1  VAL 123          3HG1      VAL 123   0.484   1.903   1.903
  974   2HG1  VAL 123          2HG1      VAL 123   0.149   3.571   3.571
  975   3HG1  VAL 123          1HG1      VAL 123   1.748   2.881   2.881
  976   1HG2  VAL 123          1HG2      VAL 123  -1.434   3.286   3.286
  977   2HG2  VAL 123          3HG2      VAL 123  -0.025   3.285   3.285
  978   3HG2  VAL 123          2HG2      VAL 123  -0.037   4.288   4.288
  979    H    HIS 124           H        HIS 124  -3.117   1.344   1.344
  980    HA   HIS 124           HA       HIS 124  -4.138   2.487   2.487
  981   1HB   HIS 124          2HB       HIS 124  -5.633   0.483   0.483
  982   2HB   HIS 124          1HB       HIS 124  -6.186   1.200   1.200
  983    HD1  HIS 124           HD1      HIS 124  -5.508   0.053   0.053
  984    HD2  HIS 124           HD2      HIS 124  -3.456  -1.381  -1.381
  985    HE1  HIS 124           HE1      HIS 124  -4.246  -1.963  -1.963
  986    HE2  HIS 124           HE2      HIS 124  -3.096  -2.875  -2.875
  987    H    GLY 125           H        GLY 125  -3.940   4.549   4.549
  988   1HA   GLY 125          2HA       GLY 125  -5.270   5.126   5.126
  989   2HA   GLY 125          1HA       GLY 125  -4.584   6.300   6.300
  990    H    PHE 126           HN       PHE 126  -7.420   4.754   4.754
  991    HA   PHE 126           HA       PHE 126  -9.610   4.758   4.758
  992   1HB   PHE 126          2HB       PHE 126 -10.500   7.118   7.118
  993   2HB   PHE 126          1HB       PHE 126  -9.567   6.678   6.678
  994    HD1  PHE 126           HD2      PHE 126  -8.826   8.084   8.084
  995    HD2  PHE 126           HD1      PHE 126  -8.249   8.328   8.328
  996    HE1  PHE 126           HE2      PHE 126  -7.386  10.051  10.051
  997    HE2  PHE 126           HE1      PHE 126  -6.807  10.297  10.297
  998    HZ   PHE 126           HZ       PHE 126  -6.374  11.160  11.160

  Start of MODEL   19
    1   1H    MET   1          1H        MET   1 -32.351 -15.953 -15.953
    2   2H    MET   1          3H        MET   1 -31.231 -16.802 -16.802
    3   3H    MET   1          2H        MET   1 -31.231 -15.086 -15.086
    4    HA   MET   1           HA       MET   1 -32.261 -15.691 -15.691
    5   1HB   MET   1          2HB       MET   1 -32.620 -18.068 -18.068
    6   2HB   MET   1          1HB       MET   1 -34.165 -17.450 -17.450
    7   1HG   MET   1          2HG       MET   1 -33.919 -16.716 -16.716
    8   2HG   MET   1          1HG       MET   1 -33.458 -18.412 -18.412
    9   1HE   MET   1          2HE       MET   1 -35.435 -17.728 -17.728
   10   2HE   MET   1          1HE       MET   1 -36.058 -19.341 -19.341
   11   3HE   MET   1          3HE       MET   1 -37.137 -17.947 -17.947
   12    H    ARG   2           H        ARG   2 -34.458 -15.850 -15.850
   13    HA   ARG   2           HA       ARG   2 -35.744 -13.390 -13.390
   14   1HB   ARG   2          2HB       ARG   2 -36.980 -15.769 -15.769
   15   2HB   ARG   2          1HB       ARG   2 -37.286 -15.245 -15.245
   16   1HG   ARG   2          2HG       ARG   2 -38.611 -13.487 -13.487
   17   2HG   ARG   2          1HG       ARG   2 -37.865 -13.380 -13.380
   18   1HD   ARG   2          2HD       ARG   2 -39.861 -14.336 -14.336
   19   2HD   ARG   2          1HD       ARG   2 -38.905 -15.787 -15.787
   20    HE   ARG   2           HE       ARG   2 -40.274 -16.266 -16.266
   21   1HH1  ARG   2          2HH1      ARG   2 -40.614 -12.879 -12.879
   22   2HH1  ARG   2          1HH1      ARG   2 -41.909 -12.627 -12.627
   23   1HH2  ARG   2          1HH2      ARG   2 -41.979 -15.937 -15.937
   24   2HH2  ARG   2          2HH2      ARG   2 -42.683 -14.362 -14.362
   25    H    GLY   3           H        GLY   3 -34.237 -12.196 -12.196
   26   1HA   GLY   3          2HA       GLY   3 -35.248 -11.292 -11.292
   27   2HA   GLY   3          1HA       GLY   3 -34.116 -12.567 -12.567
   28    H    SER   4           H        SER   4 -33.679 -10.027 -10.027
   29    HA   SER   4           HA       SER   4 -31.665  -8.865  -8.865
   30   1HB   SER   4          2HB       SER   4 -32.715  -7.755  -7.755
   31   2HB   SER   4          1HB       SER   4 -31.756  -6.901  -6.901
   32    HG   SER   4           HG       SER   4 -34.318  -6.913  -6.913
   33    H    HIS   5           H        HIS   5 -29.620  -9.444  -9.444
   34    HA   HIS   5           HA       HIS   5 -28.573  -9.873  -9.873
   35   1HB   HIS   5          2HB       HIS   5 -29.164 -12.006 -12.006
   36   2HB   HIS   5          1HB       HIS   5 -27.445 -11.753 -11.753
   37    HD1  HIS   5           HD1      HIS   5 -27.833 -14.301 -14.301
   38    HD2  HIS   5           HD2      HIS   5 -27.841 -10.834 -10.834
   39    HE1  HIS   5           HE1      HIS   5 -27.326 -15.045 -15.045
   40    HE2  HIS   5           HE2      HIS   5 -27.416 -12.941 -12.941
   41    H    HIS   6           H        HIS   6 -26.013 -10.577 -10.577
   42    HA   HIS   6           HA       HIS   6 -25.037  -8.195  -8.195
   43   1HB   HIS   6          2HB       HIS   6 -24.402  -9.265  -9.265
   44   2HB   HIS   6          1HB       HIS   6 -23.001  -9.592  -9.592
   45    HD1  HIS   6           HD1      HIS   6 -24.065  -7.179  -7.179
   46    HD2  HIS   6           HD2      HIS   6 -22.444  -6.947  -6.947
   47    HE1  HIS   6           HE1      HIS   6 -23.117  -4.858  -4.858
   48    HE2  HIS   6           HE2      HIS   6 -22.213  -4.714  -4.714
   49    H    HIS   7           H        HIS   7 -25.839 -10.328 -10.328
   50    HA   HIS   7           HA       HIS   7 -23.641 -12.027 -12.027
   51   1HB   HIS   7          2HB       HIS   7 -26.338 -12.066 -12.066
   52   2HB   HIS   7          1HB       HIS   7 -25.670 -11.621 -11.621
   53    HD1  HIS   7           HD1      HIS   7 -26.571 -14.016 -14.016
   54    HD2  HIS   7           HD2      HIS   7 -23.429 -14.043 -14.043
   55    HE1  HIS   7           HE1      HIS   7 -25.627 -16.346 -16.346
   56    HE2  HIS   7           HE2      HIS   7 -23.778 -16.361 -16.361
   57    H    HIS   8           H        HIS   8 -25.227  -9.384  -9.384
   58    HA   HIS   8           HA       HIS   8 -24.435  -7.899  -7.899
   59   1HB   HIS   8          2HB       HIS   8 -22.616  -7.835  -7.835
   60   2HB   HIS   8          1HB       HIS   8 -21.585  -8.347  -8.347
   61    HD1  HIS   8           HD1      HIS   8 -20.618  -5.823  -5.823
   62    HD2  HIS   8           HD2      HIS   8 -24.129  -6.034  -6.034
   63    HE1  HIS   8           HE1      HIS   8 -20.900  -3.548  -3.548
   64    HE2  HIS   8           HE2      HIS   8 -22.980  -3.729  -3.729
   65    H    HIS   9           H        HIS   9 -22.287  -7.770  -7.770
   66    HA   HIS   9           HA       HIS   9 -21.763 -10.383 -10.383
   67   1HB   HIS   9          2HB       HIS   9 -23.696  -8.469  -8.469
   68   2HB   HIS   9          1HB       HIS   9 -22.536  -9.152  -9.152
   69    HD1  HIS   9           HD1      HIS   9 -22.534 -11.827 -11.827
   70    HD2  HIS   9           HD2      HIS   9 -25.771 -10.118 -10.118
   71    HE1  HIS   9           HE1      HIS   9 -24.291 -13.625 -13.625
   72    HE2  HIS   9           HE2      HIS   9 -26.276 -12.536 -12.536
   73    H    HIS  10           H        HIS  10 -21.730  -7.145  -7.145
   74    HA   HIS  10           HA       HIS  10 -19.040  -7.461  -7.461
   75   1HB   HIS  10          2HB       HIS  10 -21.035  -6.002  -6.002
   76   2HB   HIS  10          1HB       HIS  10 -20.345  -4.775  -4.775
   77    HD1  HIS  10           HD1      HIS  10 -18.718  -3.329  -3.329
   78    HD2  HIS  10           HD2      HIS  10 -18.813  -7.145  -7.145
   79    HE1  HIS  10           HE1      HIS  10 -17.085  -3.278  -3.278
   80    HE2  HIS  10           HE2      HIS  10 -17.102  -5.620  -5.620
   81    H    THR  11           H        THR  11 -17.669  -7.728  -7.728
   82    HA   THR  11           HA       THR  11 -17.383  -5.391  -5.391
   83    HB   THR  11           HB       THR  11 -16.422  -7.025  -7.025
   84    HG1  THR  11           HG1      THR  11 -16.270  -9.031  -9.031
   85   1HG2  THR  11          3HG2      THR  11 -19.211  -6.690  -6.690
   86   2HG2  THR  11          2HG2      THR  11 -18.895  -8.219  -8.219
   87   3HG2  THR  11          1HG2      THR  11 -18.432  -6.698  -6.698
   88    H    ASP  12           H        ASP  12 -15.341  -8.253  -8.253
   89    HA   ASP  12           HA       ASP  12 -13.136  -8.476  -8.476
   90   1HB   ASP  12          2HB       ASP  12 -14.133  -6.395  -6.395
   91   2HB   ASP  12          1HB       ASP  12 -12.385  -6.570  -6.570
   92    HA   PRO  13           HA       PRO  13 -12.096  -4.908  -4.908
   93   1HB   PRO  13          2HB       PRO  13 -11.572  -6.403  -6.403
   94   2HB   PRO  13          1HB       PRO  13 -13.189  -5.799  -5.799
   95   1HG   PRO  13          2HG       PRO  13 -12.022  -8.515  -8.515
   96   2HG   PRO  13          1HG       PRO  13 -13.630  -8.077  -8.077
   97   1HD   PRO  13          2HD       PRO  13 -13.182  -8.812  -8.812
   98   2HD   PRO  13          1HD       PRO  13 -14.448  -7.655  -7.655
   99    H    MET  14           H        MET  14 -10.673  -8.056  -8.056
  100    HA   MET  14           HA       MET  14  -8.008  -7.043  -7.043
  101   1HB   MET  14          2HB       MET  14  -8.687  -9.839  -9.839
  102   2HB   MET  14          1HB       MET  14  -7.258  -9.295  -9.295
  103   1HG   MET  14          2HG       MET  14  -9.203  -8.578  -8.578
  104   2HG   MET  14          1HG       MET  14  -9.921 -10.010 -10.010
  105   1HE   MET  14          3HE       MET  14  -9.940 -11.066 -11.066
  106   2HE   MET  14          2HE       MET  14  -8.488 -11.257 -11.257
  107   3HE   MET  14          1HE       MET  14  -9.121  -9.645  -9.645
  108    H    SER  15           H        SER  15  -9.305  -5.942  -5.942
  109    HA   SER  15           HA       SER  15  -7.795  -7.120  -7.120
  110   1HB   SER  15          2HB       SER  15 -10.412  -6.688  -6.688
  111   2HB   SER  15          1HB       SER  15  -9.906  -5.057  -5.057
  112    HG   SER  15           HG       SER  15  -9.345  -5.760  -5.760
  113    H    ALA  16           H        ALA  16  -8.210  -4.290  -4.290
  114    HA   ALA  16           HA       ALA  16  -6.546  -2.667  -2.667
  115   1HB   ALA  16          3HB       ALA  16  -8.159  -2.059  -2.059
  116   2HB   ALA  16          2HB       ALA  16  -6.992  -0.908  -0.908
  117   3HB   ALA  16          1HB       ALA  16  -8.359  -1.433  -1.433
  118    H    ILE  17           H        ILE  17  -5.251  -4.890  -4.890
  119    HA   ILE  17           HA       ILE  17  -3.215  -3.541  -3.541
  120    HB   ILE  17           HB       ILE  17  -4.158  -6.326  -6.326
  121   1HG1  ILE  17          2HG1      ILE  17  -4.763  -3.814  -3.814
  122   2HG1  ILE  17          1HG1      ILE  17  -5.897  -4.533  -4.533
  123   1HG2  ILE  17          3HG2      ILE  17  -2.118  -4.453  -4.453
  124   2HG2  ILE  17          2HG2      ILE  17  -2.934  -5.558  -5.558
  125   3HG2  ILE  17          1HG2      ILE  17  -2.026  -6.194  -6.194
  126   1HD1  ILE  17          3HD1      ILE  17  -4.752  -6.055  -6.055
  127   2HD1  ILE  17          2HD1      ILE  17  -6.229  -5.100  -5.100
  128   3HD1  ILE  17          1HD1      ILE  17  -6.146  -6.466  -6.466
  129    H    GLN  18           H        GLN  18  -1.766  -3.508  -3.508
  130    HA   GLN  18           HA       GLN  18  -0.112  -4.274  -4.274
  131   1HB   GLN  18          2HB       GLN  18  -0.051  -5.937  -5.937
  132   2HB   GLN  18          1HB       GLN  18  -0.243  -7.084  -7.084
  133   1HG   GLN  18          2HG       GLN  18   1.729  -6.128  -6.128
  134   2HG   GLN  18          1HG       GLN  18   1.930  -5.019  -5.019
  135   1HE2  GLN  18          2HE2      GLN  18   2.672  -7.831  -7.831
  136   2HE2  GLN  18          1HE2      GLN  18   1.496  -6.569  -6.569
  137    H    ASN  19           H        ASN  19  -0.261  -4.688  -4.688
  138    HA   ASN  19           HA       ASN  19  -2.067  -6.817  -6.817
  139   1HB   ASN  19          2HB       ASN  19  -2.799  -4.198  -4.198
  140   2HB   ASN  19          1HB       ASN  19  -2.003  -4.428  -4.428
  141   1HD2  ASN  19          2HD2      ASN  19  -5.334  -5.295  -5.295
  142   2HD2  ASN  19          1HD2      ASN  19  -4.255  -3.956  -3.956
  143    H    LEU  20           H        LEU  20  -0.731  -8.227  -8.227
  144    HA   LEU  20           HA       LEU  20   1.291  -7.206  -7.206
  145   1HB   LEU  20          2HB       LEU  20   1.738  -8.687  -8.687
  146   2HB   LEU  20          1HB       LEU  20   1.803  -9.885  -9.885
  147    HG   LEU  20           HG       LEU  20   4.026  -9.045  -9.045
  148   1HD1  LEU  20          2HD1      LEU  20   2.750  -8.525  -8.525
  149   2HD1  LEU  20          1HD1      LEU  20   4.378  -7.895  -7.895
  150   3HD1  LEU  20          3HD1      LEU  20   4.064  -9.622  -9.622
  151   1HD2  LEU  20          3HD2      LEU  20   2.649  -6.444  -6.444
  152   2HD2  LEU  20          2HD2      LEU  20   4.027  -6.939  -6.939
  153   3HD2  LEU  20          1HD2      LEU  20   4.260  -6.513  -6.513
  154    H    HIS  21           H        HIS  21   0.716  -7.629  -7.629
  155    HA   HIS  21           HA       HIS  21  -1.244  -9.589  -9.589
  156   1HB   HIS  21          2HB       HIS  21   0.604  -7.954  -7.954
  157   2HB   HIS  21          1HB       HIS  21  -0.715  -8.952  -8.952
  158    HD1  HIS  21           HD1      HIS  21  -2.007  -7.562  -7.562
  159    HD2  HIS  21           HD2      HIS  21  -1.279  -6.055  -6.055
  160    HE1  HIS  21           HE1      HIS  21  -3.450  -5.513  -5.513
  161    HE2  HIS  21           HE2      HIS  21  -2.932  -4.573  -4.573
  162    H    SER  22           H        SER  22  -0.354 -11.542 -11.542
  163    HA   SER  22           HA       SER  22   1.378 -12.853 -12.853
  164   1HB   SER  22          2HB       SER  22   2.197 -12.259 -12.259
  165   2HB   SER  22          1HB       SER  22   2.680 -13.800 -13.800
  166    HG   SER  22           HG       SER  22   3.376 -11.187 -11.187
  167    H    PHE  23           H        PHE  23  -0.183 -14.306 -14.306
  168    HA   PHE  23           HA       PHE  23  -1.645 -15.716 -15.716
  169   1HB   PHE  23          2HB       PHE  23  -1.852 -15.436 -15.436
  170   2HB   PHE  23          1HB       PHE  23  -2.433 -16.948 -16.948
  171    HD1  PHE  23           HD1      PHE  23  -3.846 -16.450 -16.450
  172    HD2  PHE  23           HD2      PHE  23  -3.478 -13.881 -13.881
  173    HE1  PHE  23           HE1      PHE  23  -5.966 -15.358 -15.358
  174    HE2  PHE  23           HE2      PHE  23  -5.597 -12.785 -12.785
  175    HZ   PHE  23           HZ       PHE  23  -6.845 -13.523 -13.523
  176    H    ASP  24           H        ASP  24  -1.267 -17.744 -17.744
  177    HA   ASP  24           HA       ASP  24  -0.199 -19.720 -19.720
  178   1HB   ASP  24          2HB       ASP  24   0.087 -19.513 -19.513
  179   2HB   ASP  24          1HB       ASP  24   0.595 -20.929 -20.929
  180    HA   PRO  25           HA       PRO  25   3.869 -17.327 -17.327
  181   1HB   PRO  25          2HB       PRO  25   3.723 -18.159 -18.159
  182   2HB   PRO  25          1HB       PRO  25   4.144 -16.590 -16.590
  183   1HG   PRO  25          2HG       PRO  25   1.791 -16.984 -16.984
  184   2HG   PRO  25          1HG       PRO  25   1.935 -15.946 -15.946
  185   1HD   PRO  25          2HD       PRO  25   0.887 -18.736 -18.736
  186   2HD   PRO  25          1HD       PRO  25   0.312 -17.392 -17.392
  187    H    PHE  26           H        PHE  26   2.976 -20.278 -20.278
  188    HA   PHE  26           HA       PHE  26   5.561 -21.448 -21.448
  189   1HB   PHE  26          2HB       PHE  26   5.133 -23.046 -23.046
  190   2HB   PHE  26          1HB       PHE  26   5.457 -21.377 -21.377
  191    HD1  PHE  26           HD1      PHE  26   3.549 -19.900 -19.900
  192    HD2  PHE  26           HD2      PHE  26   3.111 -24.099 -24.099
  193    HE1  PHE  26           HE1      PHE  26   1.455 -19.843 -19.843
  194    HE2  PHE  26           HE2      PHE  26   1.015 -24.050 -24.050
  195    HZ   PHE  26           HZ       PHE  26   0.184 -21.920 -21.920
  196    H    ALA  27           H        ALA  27   2.101 -21.836 -21.836
  197    HA   ALA  27           HA       ALA  27   0.723 -23.251 -23.251
  198   1HB   ALA  27          2HB       ALA  27   3.210 -23.288 -23.288
  199   2HB   ALA  27          1HB       ALA  27   2.137 -24.661 -24.661
  200   3HB   ALA  27          3HB       ALA  27   1.545 -23.018 -23.018
  201    H    ASP  28           H        ASP  28   0.356 -24.504 -24.504
  202    HA   ASP  28           HA       ASP  28   0.922 -27.260 -27.260
  203   1HB   ASP  28          2HB       ASP  28   3.022 -25.967 -25.967
  204   2HB   ASP  28          1HB       ASP  28   2.080 -26.430 -26.430
  205    H    ALA  29           H        ALA  29   0.585 -28.131 -28.131
  206    HA   ALA  29           HA       ALA  29  -2.161 -28.043 -28.043
  207   1HB   ALA  29          2HB       ALA  29   0.127 -28.917 -28.917
  208   2HB   ALA  29          1HB       ALA  29  -1.393 -28.642 -28.642
  209   3HB   ALA  29          3HB       ALA  29  -1.325 -29.791 -29.791
  210    H    SER  30           H        SER  30  -2.957 -27.415 -27.415
  211    HA   SER  30           HA       SER  30  -3.658 -25.727 -25.727
  212   1HB   SER  30          2HB       SER  30  -1.093 -24.297 -24.297
  213   2HB   SER  30          1HB       SER  30  -2.072 -24.088 -24.088
  214    HG   SER  30           HG       SER  30  -0.317 -26.153 -26.153
  215    H    LYS  31           H        LYS  31  -4.762 -23.754 -23.754
  216    HA   LYS  31           HA       LYS  31  -5.072 -22.704 -22.704
  217   1HB   LYS  31          2HB       LYS  31  -7.238 -21.851 -21.851
  218   2HB   LYS  31          1HB       LYS  31  -7.106 -23.579 -23.579
  219   1HG   LYS  31          2HG       LYS  31  -6.434 -22.982 -22.982
  220   2HG   LYS  31          1HG       LYS  31  -6.955 -21.338 -21.338
  221   1HD   LYS  31          2HD       LYS  31  -8.715 -23.757 -23.757
  222   2HD   LYS  31          1HD       LYS  31  -8.678 -22.791 -22.791
  223   1HE   LYS  31          2HE       LYS  31  -9.098 -20.798 -20.798
  224   2HE   LYS  31          1HE       LYS  31  -9.653 -22.053 -22.053
  225   1HZ   LYS  31          1HZ       LYS  31 -10.983 -22.741 -22.741
  226   2HZ   LYS  31          3HZ       LYS  31 -10.866 -21.076 -21.076
  227   3HZ   LYS  31          2HZ       LYS  31 -11.596 -21.648 -21.648
  228    H    GLY  32           H        GLY  32  -4.578 -21.691 -21.691
  229   1HA   GLY  32          2HA       GLY  32  -4.332 -18.902 -18.902
  230   2HA   GLY  32          1HA       GLY  32  -4.204 -19.545 -19.545
  231    H    ASP  33           H        ASP  33  -2.450 -17.624 -17.624
  232    HA   ASP  33           HA       ASP  33   0.043 -19.137 -19.137
  233   1HB   ASP  33          2HB       ASP  33  -0.502 -16.222 -16.222
  234   2HB   ASP  33          1HB       ASP  33   0.993 -17.091 -17.091
  235    H    ASP  34           H        ASP  34  -1.279 -18.728 -18.728
  236    HA   ASP  34           HA       ASP  34   0.207 -16.697 -16.697
  237   1HB   ASP  34          2HB       ASP  34  -0.905 -17.632 -17.632
  238   2HB   ASP  34          1HB       ASP  34  -2.043 -17.209 -17.209
  239    H    LEU  35           H        LEU  35   2.358 -17.407 -17.407
  240    HA   LEU  35           HA       LEU  35   3.337 -19.953 -19.953
  241   1HB   LEU  35          2HB       LEU  35   4.313 -17.710 -17.710
  242   2HB   LEU  35          1HB       LEU  35   5.421 -17.979 -17.979
  243    HG   LEU  35           HG       LEU  35   6.206 -19.151 -19.151
  244   1HD1  LEU  35          1HD1      LEU  35   6.480 -20.184 -20.184
  245   2HD1  LEU  35          3HD1      LEU  35   5.051 -21.163 -21.163
  246   3HD1  LEU  35          2HD1      LEU  35   6.492 -21.338 -21.338
  247   1HD2  LEU  35          1HD2      LEU  35   3.795 -19.372 -19.372
  248   2HD2  LEU  35          3HD2      LEU  35   4.963 -20.643 -20.643
  249   3HD2  LEU  35          2HD2      LEU  35   3.765 -20.881 -20.881
  250    H    LEU  36           H        LEU  36   4.795 -20.430 -20.430
  251    HA   LEU  36           HA       LEU  36   5.483 -20.433 -20.433
  252   1HB   LEU  36          2HB       LEU  36   5.144 -17.442 -17.442
  253   2HB   LEU  36          1HB       LEU  36   6.219 -18.391 -18.391
  254    HG   LEU  36           HG       LEU  36   6.502 -18.147 -18.147
  255   1HD1  LEU  36          1HD1      LEU  36   7.560 -16.496 -16.496
  256   2HD1  LEU  36          3HD1      LEU  36   8.582 -16.787 -16.787
  257   3HD1  LEU  36          2HD1      LEU  36   7.012 -16.007 -16.007
  258   1HD2  LEU  36          1HD2      LEU  36   7.925 -19.618 -19.618
  259   2HD2  LEU  36          3HD2      LEU  36   7.710 -20.013 -20.013
  260   3HD2  LEU  36          2HD2      LEU  36   8.925 -18.830 -18.830
  261    HA   PRO  37           HA       PRO  37   1.786 -20.468 -20.468
  262   1HB   PRO  37          2HB       PRO  37   2.805 -20.548 -20.548
  263   2HB   PRO  37          1HB       PRO  37   2.862 -21.930 -21.930
  264   1HG   PRO  37          2HG       PRO  37   4.998 -19.933 -19.933
  265   2HG   PRO  37          1HG       PRO  37   5.126 -21.693 -21.693
  266   1HD   PRO  37          2HD       PRO  37   5.856 -19.982 -19.982
  267   2HD   PRO  37          1HD       PRO  37   5.193 -21.595 -21.595
  268    H    ALA  38           H        ALA  38   0.818 -18.483 -18.483
  269    HA   ALA  38           HA       ALA  38   1.755 -16.039 -16.039
  270   1HB   ALA  38          1HB       ALA  38  -0.621 -16.970 -16.970
  271   2HB   ALA  38          3HB       ALA  38  -0.902 -15.595 -15.595
  272   3HB   ALA  38          2HB       ALA  38   0.323 -15.493 -15.493
  273    H    GLY  39           H        GLY  39   2.131 -16.124 -16.124
  274   1HA   GLY  39          2HA       GLY  39  -0.198 -16.725 -16.725
  275   2HA   GLY  39          1HA       GLY  39   1.476 -16.929 -16.929
  276    H    THR  40           H        THR  40  -1.071 -14.612 -14.612
  277    HA   THR  40           HA       THR  40   0.522 -12.552 -12.552
  278    HB   THR  40           HB       THR  40  -1.268 -11.012 -11.012
  279    HG1  THR  40           HG1      THR  40  -2.582 -12.475 -12.475
  280   1HG2  THR  40          2HG2      THR  40   1.264 -11.345 -11.345
  281   2HG2  THR  40          1HG2      THR  40   0.624 -12.154 -12.154
  282   3HG2  THR  40          3HG2      THR  40   0.201 -10.474 -10.474
  283    H    GLU  41           H        GLU  41  -0.306 -13.761 -13.761
  284    HA   GLU  41           HA       GLU  41  -2.858 -12.564 -12.564
  285   1HB   GLU  41          2HB       GLU  41  -2.013 -15.435 -15.435
  286   2HB   GLU  41          1HB       GLU  41  -3.285 -14.706 -14.706
  287   1HG   GLU  41          2HG       GLU  41  -4.640 -15.453 -15.453
  288   2HG   GLU  41          1HG       GLU  41  -4.088 -14.039 -14.039
  289    H    ASP  42           H        ASP  42   0.393 -12.894 -12.894
  290    HA   ASP  42           HA       ASP  42   0.073 -12.608 -12.608
  291   1HB   ASP  42          2HB       ASP  42   2.152 -13.719 -13.719
  292   2HB   ASP  42          1HB       ASP  42   2.789 -12.649 -12.649
  293    H    TYR  43           H        TYR  43  -0.749 -10.441 -10.441
  294    HA   TYR  43           HA       TYR  43   1.365  -8.468  -8.468
  295   1HB   TYR  43          2HB       TYR  43  -1.617  -8.229  -8.229
  296   2HB   TYR  43          1HB       TYR  43  -0.480  -6.894  -6.894
  297    HD1  TYR  43           HD1      TYR  43   1.458  -7.240  -7.240
  298    HD2  TYR  43           HD2      TYR  43  -2.113  -9.544  -9.544
  299    HE1  TYR  43           HE1      TYR  43   1.870  -7.859  -7.859
  300    HE2  TYR  43           HE2      TYR  43  -1.712 -10.181 -10.181
  301    HH   TYR  43           HH       TYR  43  -0.002  -8.717  -8.717
  302    H    ILE  44           H        ILE  44   1.070  -6.385  -6.385
  303    HA   ILE  44           HA       ILE  44  -0.187  -6.730  -6.730
  304    HB   ILE  44           HB       ILE  44   2.535  -5.547  -5.547
  305   1HG1  ILE  44          2HG1      ILE  44   2.390  -8.030  -8.030
  306   2HG1  ILE  44          1HG1      ILE  44   3.376  -7.326  -7.326
  307   1HG2  ILE  44          1HG2      ILE  44   0.709  -5.286  -5.286
  308   2HG2  ILE  44          3HG2      ILE  44   2.432  -5.486  -5.486
  309   3HG2  ILE  44          2HG2      ILE  44   1.872  -4.135  -4.135
  310   1HD1  ILE  44          3HD1      ILE  44   0.896  -7.436  -7.436
  311   2HD1  ILE  44          2HD1      ILE  44   0.938  -8.898  -8.898
  312   3HD1  ILE  44          1HD1      ILE  44   2.193  -8.610  -8.610
  313    H    HIS  45           H        HIS  45  -1.927  -5.604  -5.604
  314    HA   HIS  45           HA       HIS  45  -1.748  -3.084  -3.084
  315   1HB   HIS  45          2HB       HIS  45  -3.824  -4.870  -4.870
  316   2HB   HIS  45          1HB       HIS  45  -4.246  -3.194  -3.194
  317    HD1  HIS  45           HD1      HIS  45  -2.890  -5.150  -5.150
  318    HD2  HIS  45           HD2      HIS  45  -5.525  -2.071  -2.071
  319    HE1  HIS  45           HE1      HIS  45  -3.926  -4.487  -4.487
  320    HE2  HIS  45           HE2      HIS  45  -5.583  -2.678  -2.678
  321    H    ILE  46           H        ILE  46  -2.399  -1.055  -1.055
  322    HA   ILE  46           HA       ILE  46  -2.525  -0.507  -0.507
  323    HB   ILE  46           HB       ILE  46  -0.247   0.359   0.359
  324   1HG1  ILE  46          2HG1      ILE  46   0.739   0.239   0.239
  325   2HG1  ILE  46          1HG1      ILE  46  -0.691  -0.743  -0.743
  326   1HG2  ILE  46          1HG2      ILE  46  -1.689   2.041   2.041
  327   2HG2  ILE  46          3HG2      ILE  46   0.074   2.135   2.135
  328   3HG2  ILE  46          2HG2      ILE  46  -0.876   2.508   2.508
  329   1HD1  ILE  46          2HD1      ILE  46   0.618  -1.586  -1.586
  330   2HD1  ILE  46          1HD1      ILE  46   1.764  -1.543  -1.543
  331   3HD1  ILE  46          3HD1      ILE  46   0.280  -2.489  -2.489
  332    H    ARG  47           H        ARG  47  -4.512   0.388   0.388
  333    HA   ARG  47           HA       ARG  47  -4.875   2.610   2.610
  334   1HB   ARG  47          2HB       ARG  47  -6.592   0.307   0.307
  335   2HB   ARG  47          1HB       ARG  47  -7.423   1.852   1.852
  336   1HG   ARG  47          2HG       ARG  47  -6.193   2.114   2.114
  337   2HG   ARG  47          1HG       ARG  47  -5.914   0.376   0.376
  338   1HD   ARG  47          2HD       ARG  47  -8.609   0.696   0.696
  339   2HD   ARG  47          1HD       ARG  47  -8.315   1.821   1.821
  340    HE   ARG  47           HE       ARG  47  -7.183  -0.738  -0.738
  341   1HH1  ARG  47          2HH1      ARG  47 -10.187   1.037   1.037
  342   2HH1  ARG  47          1HH1      ARG  47 -10.917   0.036   0.036
  343   1HH2  ARG  47          1HH2      ARG  47  -8.142  -2.057  -2.057
  344   2HH2  ARG  47          2HH2      ARG  47  -9.756  -1.720  -1.720
  345    H    ILE  48           H        ILE  48  -5.669   4.488   4.488
  346    HA   ILE  48           HA       ILE  48  -5.822   4.894   4.894
  347    HB   ILE  48           HB       ILE  48  -5.882   6.806   6.806
  348   1HG1  ILE  48          2HG1      ILE  48  -3.864   6.516   6.516
  349   2HG1  ILE  48          1HG1      ILE  48  -3.701   5.749   5.749
  350   1HG2  ILE  48          2HG2      ILE  48  -6.108   7.432   7.432
  351   2HG2  ILE  48          1HG2      ILE  48  -5.775   8.621   8.621
  352   3HG2  ILE  48          3HG2      ILE  48  -7.309   7.750   7.750
  353   1HD1  ILE  48          3HD1      ILE  48  -4.007   8.715   8.715
  354   2HD1  ILE  48          2HD1      ILE  48  -2.442   7.897   7.897
  355   3HD1  ILE  48          1HD1      ILE  48  -3.506   7.836   7.836
  356    H    GLN  49           H        GLN  49  -7.589   6.072   6.072
  357    HA   GLN  49           HA       GLN  49 -10.129   5.992   5.992
  358   1HB   GLN  49          2HB       GLN  49 -11.281   4.941   4.941
  359   2HB   GLN  49          1HB       GLN  49 -10.012   3.889   3.889
  360   1HG   GLN  49          2HG       GLN  49  -9.133   3.754   3.754
  361   2HG   GLN  49          1HG       GLN  49  -8.907   5.502   5.502
  362   1HE2  GLN  49          2HE2      GLN  49 -11.936   3.734   3.734
  363   2HE2  GLN  49          1HE2      GLN  49 -10.964   2.856   2.856
  364    H    GLN  50           H        GLN  50  -9.836   8.268   8.268
  365    HA   GLN  50           HA       GLN  50  -9.753   9.738   9.738
  366   1HB   GLN  50          2HB       GLN  50  -8.802  10.264  10.264
  367   2HB   GLN  50          1HB       GLN  50 -10.242  11.270  11.270
  368   1HG   GLN  50          2HG       GLN  50  -9.434  12.391  12.391
  369   2HG   GLN  50          1HG       GLN  50  -8.064  11.289  11.289
  370   1HE2  GLN  50          2HE2      GLN  50  -6.227  13.786  13.786
  371   2HE2  GLN  50          1HE2      GLN  50  -6.541  12.900  12.900
  372    H    ARG  51           H        ARG  51 -11.648   9.567   9.567
  373    HA   ARG  51           HA       ARG  51 -14.191   9.753   9.753
  374   1HB   ARG  51          2HB       ARG  51 -13.467   9.812   9.812
  375   2HB   ARG  51          1HB       ARG  51 -15.109   9.743   9.743
  376   1HG   ARG  51          2HG       ARG  51 -14.835   7.569   7.569
  377   2HG   ARG  51          1HG       ARG  51 -13.075   7.663   7.663
  378   1HD   ARG  51          2HD       ARG  51 -13.289   6.568   6.568
  379   2HD   ARG  51          1HD       ARG  51 -13.825   8.113   8.113
  380    HE   ARG  51           HE       ARG  51 -16.010   6.732   6.732
  381   1HH1  ARG  51          2HH1      ARG  51 -13.892   6.664   6.664
  382   2HH1  ARG  51          1HH1      ARG  51 -15.058   5.907   5.907
  383   1HH2  ARG  51          1HH2      ARG  51 -17.547   5.736   5.736
  384   2HH2  ARG  51          2HH2      ARG  51 -17.134   5.380   5.380
  385    H    ASN  52           H        ASN  52 -15.109  11.582  11.582
  386    HA   ASN  52           HA       ASN  52 -15.803  13.753  13.753
  387   1HB   ASN  52          2HB       ASN  52 -15.905  13.321  13.321
  388   2HB   ASN  52          1HB       ASN  52 -14.488  14.368  14.368
  389   1HD2  ASN  52          2HD2      ASN  52 -17.238  16.633  16.633
  390   2HD2  ASN  52          1HD2      ASN  52 -16.334  15.422  15.422
  391    H    GLY  53           H        GLY  53 -13.044  12.748  12.748
  392   1HA   GLY  53          2HA       GLY  53 -11.184  13.637  13.637
  393   2HA   GLY  53          1HA       GLY  53 -12.013  15.185  15.185
  394    H    ARG  54           H        ARG  54 -11.387  13.421  13.421
  395    HA   ARG  54           HA       ARG  54  -9.056  15.088  15.088
  396   1HB   ARG  54          2HB       ARG  54 -11.434  14.949  14.949
  397   2HB   ARG  54          1HB       ARG  54  -9.947  15.848  15.848
  398   1HG   ARG  54          2HG       ARG  54 -10.837  16.810  16.810
  399   2HG   ARG  54          1HG       ARG  54 -12.323  16.576  16.576
  400   1HD   ARG  54          2HD       ARG  54 -11.080  17.790  17.790
  401   2HD   ARG  54          1HD       ARG  54  -9.958  18.305  18.305
  402    HE   ARG  54           HE       ARG  54 -12.691  18.832  18.832
  403   1HH1  ARG  54          2HH1      ARG  54  -9.921  20.030  20.030
  404   2HH1  ARG  54          1HH1      ARG  54 -10.443  21.681  21.681
  405   1HH2  ARG  54          1HH2      ARG  54 -13.379  21.003  21.003
  406   2HH2  ARG  54          2HH2      ARG  54 -12.407  22.233  22.233
  407    H    LYS  55           H        LYS  55 -11.254  12.864  12.864
  408    HA   LYS  55           HA       LYS  55  -9.244  11.708  11.708
  409   1HB   LYS  55          2HB       LYS  55 -11.887  11.611  11.611
  410   2HB   LYS  55          1HB       LYS  55 -11.648  10.112  10.112
  411   1HG   LYS  55          2HG       LYS  55 -11.790   9.627   9.627
  412   2HG   LYS  55          1HG       LYS  55 -10.139   9.333   9.333
  413   1HD   LYS  55          2HD       LYS  55 -10.201  10.495  10.495
  414   2HD   LYS  55          1HD       LYS  55  -9.431  11.472  11.472
  415   1HE   LYS  55          2HE       LYS  55 -11.232  12.929  12.929
  416   2HE   LYS  55          1HE       LYS  55 -12.354  11.771  11.771
  417   1HZ   LYS  55          1HZ       LYS  55 -10.382  12.285  12.285
  418   2HZ   LYS  55          3HZ       LYS  55 -10.862  13.785  13.785
  419   3HZ   LYS  55          2HZ       LYS  55 -12.011  12.739  12.739
  420    H    THR  56           H        THR  56  -7.574  11.389  11.389
  421    HA   THR  56           HA       THR  56  -7.922   9.349   9.349
  422    HB   THR  56           HB       THR  56  -5.171  10.074  10.074
  423    HG1  THR  56           HG1      THR  56  -5.665  12.067  12.067
  424   1HG2  THR  56          2HG2      THR  56  -6.835   9.746   9.746
  425   2HG2  THR  56          1HG2      THR  56  -5.730  11.115  11.115
  426   3HG2  THR  56          3HG2      THR  56  -5.100   9.498   9.498
  427    H    LEU  57           H        LEU  57  -7.527   7.235   7.235
  428    HA   LEU  57           HA       LEU  57  -5.825   6.275   6.275
  429   1HB   LEU  57          2HB       LEU  57  -8.697   5.966   5.966
  430   2HB   LEU  57          1HB       LEU  57  -7.898   4.406   4.406
  431    HG   LEU  57           HG       LEU  57  -7.224   6.491   6.491
  432   1HD1  LEU  57          2HD1      LEU  57  -9.779   5.338   5.338
  433   2HD1  LEU  57          1HD1      LEU  57  -9.032   4.550   4.550
  434   3HD1  LEU  57          3HD1      LEU  57  -9.189   6.307   6.307
  435   1HD2  LEU  57          3HD2      LEU  57  -6.255   3.939   3.939
  436   2HD2  LEU  57          2HD2      LEU  57  -5.937   4.893   4.893
  437   3HD2  LEU  57          1HD2      LEU  57  -7.266   3.734   3.734
  438    H    THR  58           H        THR  58  -4.245   5.297   5.297
  439    HA   THR  58           HA       THR  58  -4.703   4.027   4.027
  440    HB   THR  58           HB       THR  58  -2.187   3.479   3.479
  441    HG1  THR  58           HG1      THR  58  -3.071   6.081   6.081
  442   1HG2  THR  58          3HG2      THR  58  -2.602   3.024   3.024
  443   2HG2  THR  58          2HG2      THR  58  -2.550   4.772   4.772
  444   3HG2  THR  58          1HG2      THR  58  -1.139   3.923   3.923
  445    H    THR  59           H        THR  59  -5.031   1.921   1.921
  446    HA   THR  59           HA       THR  59  -4.840   0.010   0.010
  447    HB   THR  59           HB       THR  59  -6.685  -1.094  -1.094
  448    HG1  THR  59           HG1      THR  59  -7.566   0.486   0.486
  449   1HG2  THR  59          3HG2      THR  59  -6.683  -0.017  -0.017
  450   2HG2  THR  59          2HG2      THR  59  -8.223   0.272   0.272
  451   3HG2  THR  59          1HG2      THR  59  -7.593  -1.370  -1.370
  452    H    VAL  60           H        VAL  60  -3.659  -1.765  -1.765
  453    HA   VAL  60           HA       VAL  60  -2.485  -2.160  -2.160
  454    HB   VAL  60           HB       VAL  60  -1.701  -3.406  -3.406
  455   1HG1  VAL  60          1HG1      VAL  60  -0.540  -3.539  -3.539
  456   2HG1  VAL  60          3HG1      VAL  60   0.452  -3.822  -3.822
  457   3HG1  VAL  60          2HG1      VAL  60  -0.935  -4.859  -4.859
  458   1HG2  VAL  60          1HG2      VAL  60  -1.030  -0.848  -0.848
  459   2HG2  VAL  60          3HG2      VAL  60  -0.944  -1.329  -1.329
  460   3HG2  VAL  60          2HG2      VAL  60   0.352  -1.777  -1.777
  461    H    GLN  61           H        GLN  61  -3.038  -3.812  -3.812
  462    HA   GLN  61           HA       GLN  61  -4.704  -5.958  -5.958
  463   1HB   GLN  61          2HB       GLN  61  -4.937  -4.334  -4.334
  464   2HB   GLN  61          1HB       GLN  61  -5.080  -6.055  -6.055
  465   1HG   GLN  61          2HG       GLN  61  -7.206  -5.877  -5.877
  466   2HG   GLN  61          1HG       GLN  61  -6.667  -5.643  -5.643
  467   1HE2  GLN  61          2HE2      GLN  61  -6.721  -1.958  -1.958
  468   2HE2  GLN  61          1HE2      GLN  61  -5.456  -3.109  -3.109
  469    H    GLY  62           H        GLY  62  -2.776  -7.153  -7.153
  470   1HA   GLY  62          2HA       GLY  62  -2.134  -9.202  -9.202
  471   2HA   GLY  62          1HA       GLY  62  -0.925  -7.968  -7.968
  472    H    ILE  63           H        ILE  63  -0.848  -7.025  -7.025
  473    HA   ILE  63           HA       ILE  63   1.227  -8.554  -8.554
  474    HB   ILE  63           HB       ILE  63  -0.663  -6.721  -6.721
  475   1HG1  ILE  63          2HG1      ILE  63   0.659  -5.747  -5.747
  476   2HG1  ILE  63          1HG1      ILE  63   1.068  -5.052  -5.052
  477   1HG2  ILE  63          3HG2      ILE  63   1.317  -8.471  -8.471
  478   2HG2  ILE  63          2HG2      ILE  63   1.854  -6.805  -6.805
  479   3HG2  ILE  63          1HG2      ILE  63   0.290  -7.313  -7.313
  480   1HD1  ILE  63          2HD1      ILE  63   2.633  -7.174  -7.174
  481   2HD1  ILE  63          1HD1      ILE  63   3.035  -5.459  -5.459
  482   3HD1  ILE  63          3HD1      ILE  63   3.057  -6.427  -6.427
  483    H    ALA  64           H        ALA  64   1.423 -10.182 -10.182
  484    HA   ALA  64           HA       ALA  64  -0.918 -11.840 -11.840
  485   1HB   ALA  64          2HB       ALA  64   1.402 -12.650 -12.650
  486   2HB   ALA  64          1HB       ALA  64   1.845 -12.482 -12.482
  487   3HB   ALA  64          3HB       ALA  64   0.550 -13.583 -13.583
  488    H    ASP  65           H        ASP  65  -1.863 -12.327 -12.327
  489    HA   ASP  65           HA       ASP  65  -1.719 -10.487 -10.487
  490   1HB   ASP  65          2HB       ASP  65  -3.042 -12.268 -12.268
  491   2HB   ASP  65          1HB       ASP  65  -3.744 -11.691 -11.691
  492    H    ASP  66           H        ASP  66   0.184 -13.256 -13.256
  493    HA   ASP  66           HA       ASP  66   1.027 -13.969 -13.969
  494   1HB   ASP  66          2HB       ASP  66   1.355 -15.338 -15.338
  495   2HB   ASP  66          1HB       ASP  66   2.628 -14.217 -14.217
  496    H    TYR  67           H        TYR  67   1.978 -11.422 -11.422
  497    HA   TYR  67           HA       TYR  67   4.485 -10.737 -10.737
  498   1HB   TYR  67          2HB       TYR  67   2.219  -8.928  -8.928
  499   2HB   TYR  67          1HB       TYR  67   3.880  -8.393  -8.393
  500    HD1  TYR  67           HD2      TYR  67   3.648 -11.715 -11.715
  501    HD2  TYR  67           HD1      TYR  67   3.526  -7.589  -7.589
  502    HE1  TYR  67           HE2      TYR  67   4.124 -12.286 -12.286
  503    HE2  TYR  67           HE1      TYR  67   3.998  -8.144  -8.144
  504    HH   TYR  67           HH       TYR  67   3.882 -11.367 -11.367
  505    H    ASP  68           H        ASP  68   5.302  -9.537  -9.537
  506    HA   ASP  68           HA       ASP  68   3.951  -9.601  -9.601
  507   1HB   ASP  68          2HB       ASP  68   6.400  -8.130  -8.130
  508   2HB   ASP  68          1HB       ASP  68   5.796  -7.936  -7.936
  509    H    LYS  69           H        LYS  69   2.034  -8.570  -8.570
  510    HA   LYS  69           HA       LYS  69   1.075  -6.358  -6.358
  511   1HB   LYS  69          2HB       LYS  69   0.655  -7.065  -7.065
  512   2HB   LYS  69          1HB       LYS  69  -0.370  -5.989  -5.989
  513   1HG   LYS  69          2HG       LYS  69  -1.489  -7.685  -7.685
  514   2HG   LYS  69          1HG       LYS  69  -0.011  -8.583  -8.583
  515   1HD   LYS  69          2HD       LYS  69  -0.190  -9.834  -9.834
  516   2HD   LYS  69          1HD       LYS  69  -0.707  -8.464  -8.464
  517   1HE   LYS  69          2HE       LYS  69  -2.682  -9.542  -9.542
  518   2HE   LYS  69          1HE       LYS  69  -2.884  -8.796  -8.796
  519   1HZ   LYS  69          3HZ       LYS  69  -1.525 -11.044 -11.044
  520   2HZ   LYS  69          2HZ       LYS  69  -2.495 -11.568 -11.568
  521   3HZ   LYS  69          1HZ       LYS  69  -3.208 -10.885 -10.885
  522    H    LYS  70           H        LYS  70   3.117  -6.353  -6.353
  523    HA   LYS  70           HA       LYS  70   3.070  -3.533  -3.533
  524   1HB   LYS  70          2HB       LYS  70   4.933  -3.896  -3.896
  525   2HB   LYS  70          1HB       LYS  70   3.622  -5.030  -5.030
  526   1HG   LYS  70          2HG       LYS  70   4.945  -6.663  -6.663
  527   2HG   LYS  70          1HG       LYS  70   6.296  -5.545  -5.545
  528   1HD   LYS  70          2HD       LYS  70   6.418  -7.299  -7.299
  529   2HD   LYS  70          1HD       LYS  70   6.085  -5.749  -5.749
  530   1HE   LYS  70          2HE       LYS  70   4.739  -7.725  -7.725
  531   2HE   LYS  70          1HE       LYS  70   3.818  -6.299  -6.299
  532   1HZ   LYS  70          3HZ       LYS  70   4.302  -8.501  -8.501
  533   2HZ   LYS  70          2HZ       LYS  70   3.021  -8.574  -8.574
  534   3HZ   LYS  70          1HZ       LYS  70   3.090  -7.321  -7.321
  535    H    LYS  71           H        LYS  71   5.277  -5.769  -5.769
  536    HA   LYS  71           HA       LYS  71   7.227  -3.819  -3.819
  537   1HB   LYS  71          2HB       LYS  71   7.407  -6.407  -6.407
  538   2HB   LYS  71          1HB       LYS  71   6.787  -6.319  -6.319
  539   1HG   LYS  71          2HG       LYS  71   8.729  -5.569  -5.569
  540   2HG   LYS  71          1HG       LYS  71   9.030  -4.516  -4.516
  541   1HD   LYS  71          2HD       LYS  71   9.202  -7.377  -7.377
  542   2HD   LYS  71          1HD       LYS  71  10.399  -6.814  -6.814
  543   1HE   LYS  71          2HE       LYS  71  11.205  -6.691  -6.691
  544   2HE   LYS  71          1HE       LYS  71  11.164  -5.117  -5.117
  545   1HZ   LYS  71          3HZ       LYS  71   9.007  -4.721  -4.721
  546   2HZ   LYS  71          2HZ       LYS  71   9.194  -6.172  -6.172
  547   3HZ   LYS  71          1HZ       LYS  71  10.288  -4.905  -4.905
  548    H    LEU  72           H        LEU  72   4.103  -4.106  -4.106
  549    HA   LEU  72           HA       LEU  72   4.781  -3.119  -3.119
  550   1HB   LEU  72          2HB       LEU  72   2.297  -4.361  -4.361
  551   2HB   LEU  72          1HB       LEU  72   2.267  -3.488  -3.488
  552    HG   LEU  72           HG       LEU  72   3.235  -5.176  -5.176
  553   1HD1  LEU  72          2HD1      LEU  72   4.883  -5.839  -5.839
  554   2HD1  LEU  72          1HD1      LEU  72   5.041  -6.596  -6.596
  555   3HD1  LEU  72          3HD1      LEU  72   5.408  -4.882  -4.882
  556   1HD2  LEU  72          1HD2      LEU  72   1.568  -6.137  -6.137
  557   2HD2  LEU  72          3HD2      LEU  72   2.031  -6.965  -6.965
  558   3HD2  LEU  72          2HD2      LEU  72   2.950  -7.232  -7.232
  559    H    VAL  73           H        VAL  73   2.051  -2.496  -2.496
  560    HA   VAL  73           HA       VAL  73   1.890   0.219   0.219
  561    HB   VAL  73           HB       VAL  73   0.073   0.466   0.466
  562   1HG1  VAL  73          3HG1      VAL  73  -0.378  -0.353  -0.353
  563   2HG1  VAL  73          2HG1      VAL  73  -0.163  -2.009  -2.009
  564   3HG1  VAL  73          1HG1      VAL  73  -1.497  -1.034  -1.034
  565   1HG2  VAL  73          1HG2      VAL  73   0.933  -1.036  -1.036
  566   2HG2  VAL  73          3HG2      VAL  73  -0.702  -1.493  -1.493
  567   3HG2  VAL  73          2HG2      VAL  73   0.678  -2.416  -2.416
  568    H    LYS  74           H        LYS  74   2.939  -1.372  -1.372
  569    HA   LYS  74           HA       LYS  74   3.399   1.015   1.015
  570   1HB   LYS  74          2HB       LYS  74   3.534  -1.663  -1.663
  571   2HB   LYS  74          1HB       LYS  74   5.228  -1.196  -1.196
  572   1HG   LYS  74          2HG       LYS  74   3.356   0.576   0.576
  573   2HG   LYS  74          1HG       LYS  74   3.631  -1.023  -1.023
  574   1HD   LYS  74          2HD       LYS  74   5.888   0.786   0.786
  575   2HD   LYS  74          1HD       LYS  74   5.164   0.850   0.850
  576   1HE   LYS  74          2HE       LYS  74   5.972  -1.214  -1.214
  577   2HE   LYS  74          1HE       LYS  74   6.042  -1.787  -1.787
  578   1HZ   LYS  74          1HZ       LYS  74   7.870   0.246   0.246
  579   2HZ   LYS  74          3HZ       LYS  74   8.247  -1.394  -1.394
  580   3HZ   LYS  74          2HZ       LYS  74   7.973  -0.436  -0.436
  581    H    ALA  75           H        ALA  75   5.523  -1.029  -1.029
  582    HA   ALA  75           HA       ALA  75   7.867   0.498   0.498
  583   1HB   ALA  75          3HB       ALA  75   6.937  -1.431  -1.431
  584   2HB   ALA  75          2HB       ALA  75   8.473  -0.579  -0.579
  585   3HB   ALA  75          1HB       ALA  75   8.191  -1.643  -1.643
  586    H    PHE  76           H        PHE  76   5.282   0.574   0.574
  587    HA   PHE  76           HA       PHE  76   6.192   2.434   2.434
  588   1HB   PHE  76          2HB       PHE  76   3.860   1.219   1.219
  589   2HB   PHE  76          1HB       PHE  76   3.391   2.738   2.738
  590    HD1  PHE  76           HD2      PHE  76   5.173   1.529   1.529
  591    HD2  PHE  76           HD1      PHE  76   2.466   4.338   4.338
  592    HE1  PHE  76           HE2      PHE  76   4.813   2.513   2.513
  593    HE2  PHE  76           HE1      PHE  76   2.101   5.327   5.327
  594    HZ   PHE  76           HZ       PHE  76   3.273   4.416   4.416
  595    H    LYS  77           H        LYS  77   4.361   3.210   3.210
  596    HA   LYS  77           HA       LYS  77   4.525   5.978   5.978
  597   1HB   LYS  77          2HB       LYS  77   4.473   4.262   4.262
  598   2HB   LYS  77          1HB       LYS  77   4.101   5.980   5.980
  599   1HG   LYS  77          2HG       LYS  77   2.072   5.650   5.650
  600   2HG   LYS  77          1HG       LYS  77   2.564   4.133   4.133
  601   1HD   LYS  77          2HD       LYS  77   1.350   3.172   3.172
  602   2HD   LYS  77          1HD       LYS  77   2.748   3.516   3.516
  603   1HE   LYS  77          2HE       LYS  77   0.301   5.245   5.245
  604   2HE   LYS  77          1HE       LYS  77   0.709   4.272   4.272
  605   1HZ   LYS  77          2HZ       LYS  77   2.743   5.644   5.644
  606   2HZ   LYS  77          1HZ       LYS  77   2.177   6.641   6.641
  607   3HZ   LYS  77          3HZ       LYS  77   1.311   6.522   6.522
  608    H    LYS  78           H        LYS  78   6.961   3.680   3.680
  609    HA   LYS  78           HA       LYS  78   8.655   5.528   5.528
  610   1HB   LYS  78          2HB       LYS  78   8.571   2.934   2.934
  611   2HB   LYS  78          1HB       LYS  78   9.599   2.970   2.970
  612   1HG   LYS  78          2HG       LYS  78  11.397   3.738   3.738
  613   2HG   LYS  78          1HG       LYS  78  10.417   4.667   4.667
  614   1HD   LYS  78          2HD       LYS  78  10.172   1.719   1.719
  615   2HD   LYS  78          1HD       LYS  78  11.698   2.415   2.415
  616   1HE   LYS  78          2HE       LYS  78   9.017   3.393   3.393
  617   2HE   LYS  78          1HE       LYS  78   9.902   2.097   2.097
  618   1HZ   LYS  78          3HZ       LYS  78  11.801   3.925   3.925
  619   2HZ   LYS  78          2HZ       LYS  78  10.461   4.955   4.955
  620   3HZ   LYS  78          1HZ       LYS  78  10.707   3.840   3.840
  621    H    LYS  79           H        LYS  79   7.990   4.794   4.794
  622    HA   LYS  79           HA       LYS  79  10.487   6.074   6.074
  623   1HB   LYS  79          2HB       LYS  79  10.145   3.855   3.855
  624   2HB   LYS  79          1HB       LYS  79   8.565   4.331   4.331
  625   1HG   LYS  79          2HG       LYS  79   9.530   5.812   5.812
  626   2HG   LYS  79          1HG       LYS  79  11.127   5.656   5.656
  627   1HD   LYS  79          2HD       LYS  79  11.187   3.294   3.294
  628   2HD   LYS  79          1HD       LYS  79   9.589   3.454   3.454
  629   1HE   LYS  79          2HE       LYS  79  10.939   3.707   3.707
  630   2HE   LYS  79          1HE       LYS  79  10.727   5.386   5.386
  631   1HZ   LYS  79          1HZ       LYS  79  12.882   4.773   4.773
  632   2HZ   LYS  79          3HZ       LYS  79  13.103   3.705   3.705
  633   3HZ   LYS  79          2HZ       LYS  79  12.963   5.366   5.366
  634    H    PHE  80           H        PHE  80   6.977   6.106   6.106
  635    HA   PHE  80           HA       PHE  80   7.271   8.758   8.758
  636   1HB   PHE  80          2HB       PHE  80   4.799   7.103   7.103
  637   2HB   PHE  80          1HB       PHE  80   5.474   8.329   8.329
  638    HD1  PHE  80           HD1      PHE  80   5.937   4.868   4.868
  639    HD2  PHE  80           HD2      PHE  80   6.907   7.746   7.746
  640    HE1  PHE  80           HE1      PHE  80   6.987   3.104   3.104
  641    HE2  PHE  80           HE2      PHE  80   7.960   5.985   5.985
  642    HZ   PHE  80           HZ       PHE  80   8.000   3.663   3.663
  643    H    ALA  81           H        ALA  81   5.991   7.064   7.064
  644    HA   ALA  81           HA       ALA  81   4.833   7.764   7.764
  645   1HB   ALA  81          1HB       ALA  81   6.346   9.843   9.843
  646   2HB   ALA  81          3HB       ALA  81   4.818  10.589  10.589
  647   3HB   ALA  81          2HB       ALA  81   5.025   9.956   9.956
  648    H    CYS  82           H        CYS  82   3.478   6.946   6.946
  649    HA   CYS  82           HA       CYS  82   1.053   8.597   8.597
  650   1HB   CYS  82          2HB       CYS  82   1.837   6.349   6.349
  651   2HB   CYS  82          1HB       CYS  82   0.406   7.363   7.363
  652    HG   CYS  82           HG       CYS  82   3.002   8.950   8.950
  653    H    ASN  83           H        ASN  83  -0.953   7.761   7.761
  654    HA   ASN  83           HA       ASN  83  -0.998   5.689   5.689
  655   1HB   ASN  83          2HB       ASN  83  -2.954   7.526   7.526
  656   2HB   ASN  83          1HB       ASN  83  -3.623   6.001   6.001
  657   1HD2  ASN  83          2HD2      ASN  83  -2.422   6.692   6.692
  658   2HD2  ASN  83          1HD2      ASN  83  -2.200   5.460   5.460
  659    H    GLY  84           H        GLY  84  -0.392   3.718   3.718
  660   1HA   GLY  84          2HA       GLY  84  -1.743   2.654   2.654
  661   2HA   GLY  84          1HA       GLY  84  -0.287   1.997   1.997
  662    H    THR  85           H        THR  85  -3.050   0.909   0.909
  663    HA   THR  85           HA       THR  85  -3.386  -0.558  -0.558
  664    HB   THR  85           HB       THR  85  -5.843  -0.419  -0.419
  665    HG1  THR  85           HG1      THR  85  -5.252   1.383   1.383
  666   1HG2  THR  85          1HG2      THR  85  -4.437   2.231   2.231
  667   2HG2  THR  85          3HG2      THR  85  -6.141   1.991   1.991
  668   3HG2  THR  85          2HG2      THR  85  -4.900   1.174   1.174
  669    H    VAL  86           H        VAL  86  -4.176  -2.667  -2.667
  670    HA   VAL  86           HA       VAL  86  -4.090  -3.700  -3.700
  671    HB   VAL  86           HB       VAL  86  -2.324  -4.607  -4.607
  672   1HG1  VAL  86          3HG1      VAL  86  -4.243  -4.529  -4.529
  673   2HG1  VAL  86          2HG1      VAL  86  -3.944  -6.245  -6.245
  674   3HG1  VAL  86          1HG1      VAL  86  -2.604  -5.168  -5.168
  675   1HG2  VAL  86          2HG2      VAL  86  -4.510  -6.566  -6.566
  676   2HG2  VAL  86          1HG2      VAL  86  -3.151  -6.076  -6.076
  677   3HG2  VAL  86          3HG2      VAL  86  -2.867  -7.033  -7.033
  678    H    ILE  87           H        ILE  87  -6.243  -3.540  -3.540
  679    HA   ILE  87           HA       ILE  87  -8.185  -4.934  -4.934
  680    HB   ILE  87           HB       ILE  87  -9.937  -3.718  -3.718
  681   1HG1  ILE  87          2HG1      ILE  87  -8.116  -1.784  -1.784
  682   2HG1  ILE  87          1HG1      ILE  87  -8.064  -3.385  -3.385
  683   1HG2  ILE  87          2HG2      ILE  87  -7.779  -1.929  -1.929
  684   2HG2  ILE  87          1HG2      ILE  87  -9.472  -1.482  -1.482
  685   3HG2  ILE  87          3HG2      ILE  87  -9.035  -2.751  -2.751
  686   1HD1  ILE  87          2HD1      ILE  87 -10.702  -2.105  -2.105
  687   2HD1  ILE  87          1HD1      ILE  87  -9.727  -1.582  -1.582
  688   3HD1  ILE  87          3HD1      ILE  87 -10.230  -3.267  -3.267
  689    H    GLU  88           H        GLU  88  -9.694  -6.365  -6.365
  690    HA   GLU  88           HA       GLU  88  -8.739  -7.662  -7.662
  691   1HB   GLU  88          2HB       GLU  88  -9.228  -8.851  -8.851
  692   2HB   GLU  88          1HB       GLU  88 -10.891  -8.811  -8.811
  693   1HG   GLU  88          2HG       GLU  88 -10.244 -10.030 -10.030
  694   2HG   GLU  88          1HG       GLU  88  -8.570 -10.057 -10.057
  695    H    HIS  89           H        HIS  89  -9.667  -5.850  -5.850
  696    HA   HIS  89           HA       HIS  89 -12.308  -5.098  -5.098
  697   1HB   HIS  89          2HB       HIS  89 -10.156  -4.342  -4.342
  698   2HB   HIS  89          1HB       HIS  89 -10.887  -5.368  -5.368
  699    HD1  HIS  89           HD1      HIS  89 -12.604  -4.295  -4.295
  700    HD2  HIS  89           HD2      HIS  89 -12.025  -2.245  -2.245
  701    HE1  HIS  89           HE1      HIS  89 -14.046  -2.243  -2.243
  702    HE2  HIS  89           HE2      HIS  89 -13.753  -1.064  -1.064
  703    HA   PRO  90           HA       PRO  90 -14.387  -8.690  -8.690
  704   1HB   PRO  90          2HB       PRO  90 -16.816  -7.635  -7.635
  705   2HB   PRO  90          1HB       PRO  90 -16.164  -7.858  -7.858
  706   1HG   PRO  90          2HG       PRO  90 -16.311  -5.373  -5.373
  707   2HG   PRO  90          1HG       PRO  90 -16.626  -5.584  -5.584
  708   1HD   PRO  90          2HD       PRO  90 -14.269  -4.616  -4.616
  709   2HD   PRO  90          1HD       PRO  90 -14.412  -5.402  -5.402
  710    H    GLU  91           H        GLU  91 -14.211  -5.687  -5.687
  711    HA   GLU  91           HA       GLU  91 -15.239  -6.854  -6.854
  712   1HB   GLU  91          2HB       GLU  91 -14.110  -4.150  -4.150
  713   2HB   GLU  91          1HB       GLU  91 -14.493  -4.609  -4.609
  714   1HG   GLU  91          2HG       GLU  91 -16.822  -5.188  -5.188
  715   2HG   GLU  91          1HG       GLU  91 -16.330  -4.184  -4.184
  716    H    TYR  92           H        TYR  92 -12.150  -6.309  -6.309
  717    HA   TYR  92           HA       TYR  92 -10.812  -7.206  -7.206
  718   1HB   TYR  92          2HB       TYR  92  -9.349  -5.946  -5.946
  719   2HB   TYR  92          1HB       TYR  92  -8.892  -6.017  -6.017
  720    HD1  TYR  92           HD1      TYR  92 -11.700  -5.089  -5.089
  721    HD2  TYR  92           HD2      TYR  92  -8.986  -3.582  -3.582
  722    HE1  TYR  92           HE1      TYR  92 -12.614  -2.834  -2.834
  723    HE2  TYR  92           HE2      TYR  92  -9.887  -1.319  -1.319
  724    HH   TYR  92           HH       TYR  92 -11.100  -0.071  -0.071
  725    H    GLY  93           H        GLY  93 -10.623  -7.474  -7.474
  726   1HA   GLY  93          2HA       GLY  93 -10.516  -9.541  -9.541
  727   2HA   GLY  93          1HA       GLY  93  -9.958 -10.310 -10.310
  728    H    GLU  94           H        GLU  94  -9.050  -8.656  -8.656
  729    HA   GLU  94           HA       GLU  94  -7.059  -8.435  -8.435
  730   1HB   GLU  94          2HB       GLU  94  -6.846 -10.821 -10.821
  731   2HB   GLU  94          1HB       GLU  94  -5.370  -9.954  -9.954
  732   1HG   GLU  94          2HG       GLU  94  -4.502 -10.247 -10.247
  733   2HG   GLU  94          1HG       GLU  94  -6.026  -9.877  -9.877
  734    H    VAL  95           H        VAL  95  -6.787  -6.260  -6.260
  735    HA   VAL  95           HA       VAL  95  -4.685  -5.655  -5.655
  736    HB   VAL  95           HB       VAL  95  -5.886  -3.619  -3.619
  737   1HG1  VAL  95          2HG1      VAL  95  -5.920  -5.847  -5.847
  738   2HG1  VAL  95          1HG1      VAL  95  -7.546  -6.061  -6.061
  739   3HG1  VAL  95          3HG1      VAL  95  -7.194  -4.703  -4.703
  740   1HG2  VAL  95          1HG2      VAL  95  -8.075  -4.790  -4.790
  741   2HG2  VAL  95          3HG2      VAL  95  -7.431  -3.149  -3.149
  742   3HG2  VAL  95          2HG2      VAL  95  -8.424  -3.701  -3.701
  743    H    ILE  96           H        ILE  96  -3.451  -3.813  -3.813
  744    HA   ILE  96           HA       ILE  96  -3.637  -3.038  -3.038
  745    HB   ILE  96           HB       ILE  96  -1.462  -3.166  -3.166
  746   1HG1  ILE  96          2HG1      ILE  96  -1.910  -4.583  -4.583
  747   2HG1  ILE  96          1HG1      ILE  96  -0.257  -4.059  -4.059
  748   1HG2  ILE  96          1HG2      ILE  96  -1.633  -0.879  -0.879
  749   2HG2  ILE  96          3HG2      ILE  96  -0.096  -1.479  -1.479
  750   3HG2  ILE  96          2HG2      ILE  96  -1.302  -0.823  -0.823
  751   1HD1  ILE  96          1HD1      ILE  96  -2.157  -2.666  -2.666
  752   2HD1  ILE  96          3HD1      ILE  96  -0.953  -3.858  -3.858
  753   3HD1  ILE  96          2HD1      ILE  96  -0.441  -2.330  -2.330
  754    H    GLN  97           H        GLN  97  -4.672  -1.265  -1.265
  755    HA   GLN  97           HA       GLN  97  -5.167   0.795   0.795
  756   1HB   GLN  97          2HB       GLN  97  -6.806  -0.378  -0.378
  757   2HB   GLN  97          1HB       GLN  97  -6.409   1.159   1.159
  758   1HG   GLN  97          2HG       GLN  97  -7.048   2.175   2.175
  759   2HG   GLN  97          1HG       GLN  97  -7.852   0.630   0.630
  760   1HE2  GLN  97          2HE2      GLN  97 -10.437   2.766   2.766
  761   2HE2  GLN  97          1HE2      GLN  97  -9.525   2.563   2.563
  762    H    LEU  98           H        LEU  98  -3.732   2.365   2.365
  763    HA   LEU  98           HA       LEU  98  -2.470   3.346   3.346
  764   1HB   LEU  98          2HB       LEU  98  -1.656   3.733   3.733
  765   2HB   LEU  98          1HB       LEU  98  -0.807   4.384   4.384
  766    HG   LEU  98           HG       LEU  98  -1.232   1.438   1.438
  767   1HD1  LEU  98          3HD1      LEU  98  -0.334   2.477   2.477
  768   2HD1  LEU  98          2HD1      LEU  98   1.172   2.570   2.570
  769   3HD1  LEU  98          1HD1      LEU  98   0.376   1.014   1.014
  770   1HD2  LEU  98          3HD2      LEU  98   0.262   3.300   3.300
  771   2HD2  LEU  98          2HD2      LEU  98   0.093   1.556   1.556
  772   3HD2  LEU  98          1HD2      LEU  98   1.379   2.200   2.200
  773    H    GLN  99           H        GLN  99  -2.241   5.667   5.667
  774    HA   GLN  99           HA       GLN  99  -4.635   7.037   7.037
  775   1HB   GLN  99          2HB       GLN  99  -3.007   7.143   7.143
  776   2HB   GLN  99          1HB       GLN  99  -3.145   8.752   8.752
  777   1HG   GLN  99          2HG       GLN  99  -5.651   7.225   7.225
  778   2HG   GLN  99          1HG       GLN  99  -4.925   7.682   7.682
  779   1HE2  GLN  99          2HE2      GLN  99  -7.215  10.374  10.374
  780   2HE2  GLN  99          1HE2      GLN  99  -7.334   8.694   8.694
  781    H    GLY 100           H        GLY 100  -4.675   8.895   8.895
  782   1HA   GLY 100          2HA       GLY 100  -3.884  10.656  10.656
  783   2HA   GLY 100          1HA       GLY 100  -2.260  10.296  10.296
  784    H    ASP 101           H        ASP 101  -2.292  10.982  10.982
  785    HA   ASP 101           HA       ASP 101  -2.783   8.789   8.789
  786   1HB   ASP 101          2HB       ASP 101  -1.748  10.263  10.263
  787   2HB   ASP 101          1HB       ASP 101  -3.029  11.074  11.074
  788    H    GLN 102           H        GLN 102  -1.466   7.248   7.248
  789    HA   GLN 102           HA       GLN 102   1.417   7.589   7.589
  790   1HB   GLN 102          2HB       GLN 102  -0.432   5.872   5.872
  791   2HB   GLN 102          1HB       GLN 102   1.079   5.111   5.111
  792   1HG   GLN 102          2HG       GLN 102   0.943   6.279   6.279
  793   2HG   GLN 102          1HG       GLN 102   2.359   6.565   6.565
  794   1HE2  GLN 102          2HE2      GLN 102  -0.418   9.567   9.567
  795   2HE2  GLN 102          1HE2      GLN 102  -0.894   7.918   7.918
  796    H    ARG 103           H        ARG 103  -0.777   6.715   6.715
  797    HA   ARG 103           HA       ARG 103  -0.261   4.236   4.236
  798   1HB   ARG 103          2HB       ARG 103  -0.795   5.092   5.092
  799   2HB   ARG 103          1HB       ARG 103  -1.843   5.829   5.829
  800   1HG   ARG 103          2HG       ARG 103  -0.776   7.893   7.893
  801   2HG   ARG 103          1HG       ARG 103   0.655   7.198   7.198
  802   1HD   ARG 103          2HD       ARG 103  -0.202   7.535   7.535
  803   2HD   ARG 103          1HD       ARG 103  -1.661   6.642   6.642
  804    HE   ARG 103           HE       ARG 103  -2.000   9.095   9.095
  805   1HH1  ARG 103          2HH1      ARG 103  -1.358   7.964   7.964
  806   2HH1  ARG 103          1HH1      ARG 103  -2.181   9.284   9.284
  807   1HH2  ARG 103          1HH2      ARG 103  -3.082  10.832  10.832
  808   2HH2  ARG 103          2HH2      ARG 103  -3.158  10.915  10.915
  809    H    LYS 104           H        LYS 104   1.859   7.005   7.005
  810    HA   LYS 104           HA       LYS 104   3.812   5.559   5.559
  811   1HB   LYS 104          2HB       LYS 104   3.218   8.374   8.374
  812   2HB   LYS 104          1HB       LYS 104   4.935   8.003   8.003
  813   1HG   LYS 104          2HG       LYS 104   4.929   8.279   8.279
  814   2HG   LYS 104          1HG       LYS 104   4.140   6.703   6.703
  815   1HD   LYS 104          2HD       LYS 104   2.573   7.848   7.848
  816   2HD   LYS 104          1HD       LYS 104   2.003   8.278   8.278
  817   1HE   LYS 104          2HE       LYS 104   3.122  10.377  10.377
  818   2HE   LYS 104          1HE       LYS 104   3.996   9.927   9.927
  819   1HZ   LYS 104          1HZ       LYS 104   1.065   9.946   9.946
  820   2HZ   LYS 104          3HZ       LYS 104   1.878  11.429  11.429
  821   3HZ   LYS 104          2HZ       LYS 104   2.174  10.273  10.273
  822    H    ASN 105           H        ASN 105   3.174   6.546   6.546
  823    HA   ASN 105           HA       ASN 105   5.895   6.229   6.229
  824   1HB   ASN 105          2HB       ASN 105   3.283   6.887   6.887
  825   2HB   ASN 105          1HB       ASN 105   4.605   6.312   6.312
  826   1HD2  ASN 105          2HD2      ASN 105   4.483  10.106  10.106
  827   2HD2  ASN 105          1HD2      ASN 105   3.181   8.983   8.983
  828    H    ILE 106           H        ILE 106   2.892   4.337   4.337
  829    HA   ILE 106           HA       ILE 106   3.970   2.295   2.295
  830    HB   ILE 106           HB       ILE 106   1.538   2.658   2.658
  831   1HG1  ILE 106          2HG1      ILE 106   0.925   0.323   0.323
  832   2HG1  ILE 106          1HG1      ILE 106   2.378  -0.131  -0.131
  833   1HG2  ILE 106          3HG2      ILE 106   1.524   3.068   3.068
  834   2HG2  ILE 106          2HG2      ILE 106   1.929   1.378   1.378
  835   3HG2  ILE 106          1HG2      ILE 106   0.385   1.802   1.802
  836   1HD1  ILE 106          2HD1      ILE 106   2.647   1.274   1.274
  837   2HD1  ILE 106          1HD1      ILE 106   2.241  -0.442  -0.442
  838   3HD1  ILE 106          3HD1      ILE 106   3.733   0.125   0.125
  839    H    CYS 107           H        CYS 107   3.518   2.512   2.512
  840    HA   CYS 107           HA       CYS 107   4.521   0.005   0.005
  841   1HB   CYS 107          2HB       CYS 107   4.984   0.935   0.935
  842   2HB   CYS 107          1HB       CYS 107   3.470   1.606   1.606
  843    HG   CYS 107           HG       CYS 107   4.932   3.508   3.508
  844    H    GLN 108           H        GLN 108   6.096   2.953   2.953
  845    HA   GLN 108           HA       GLN 108   8.766   2.240   2.240
  846   1HB   GLN 108          2HB       GLN 108   7.443   4.314   4.314
  847   2HB   GLN 108          1HB       GLN 108   9.126   3.966   3.966
  848   1HG   GLN 108          2HG       GLN 108   8.429   4.422   4.422
  849   2HG   GLN 108          1HG       GLN 108   8.352   5.810   5.810
  850   1HE2  GLN 108          2HE2      GLN 108  11.994   3.964   3.964
  851   2HE2  GLN 108          1HE2      GLN 108  10.545   3.060   3.060
  852    H    PHE 109           H        PHE 109   6.974   2.250   2.250
  853    HA   PHE 109           HA       PHE 109   8.896   1.119   1.119
  854   1HB   PHE 109          2HB       PHE 109   6.746   2.154   2.154
  855   2HB   PHE 109          1HB       PHE 109   5.902   0.719   0.719
  856    HD1  PHE 109           HD1      PHE 109   8.657   1.732   1.732
  857    HD2  PHE 109           HD2      PHE 109   5.490  -0.991  -0.991
  858    HE1  PHE 109           HE1      PHE 109   9.008   0.683   0.683
  859    HE2  PHE 109           HE2      PHE 109   5.835  -2.048  -2.048
  860    HZ   PHE 109           HZ       PHE 109   7.596  -1.207  -1.207
  861    H    LEU 110           H        LEU 110   6.338  -0.459  -0.459
  862    HA   LEU 110           HA       LEU 110   6.770  -3.084  -3.084
  863   1HB   LEU 110          2HB       LEU 110   5.622  -1.755  -1.755
  864   2HB   LEU 110          1HB       LEU 110   6.003  -3.458  -3.458
  865    HG   LEU 110           HG       LEU 110   4.438  -4.061  -4.061
  866   1HD1  LEU 110          2HD1      LEU 110   4.617  -1.195  -1.195
  867   2HD1  LEU 110          1HD1      LEU 110   3.140  -2.093  -2.093
  868   3HD1  LEU 110          3HD1      LEU 110   4.685  -2.647  -2.647
  869   1HD2  LEU 110          3HD2      LEU 110   3.656  -2.517  -2.517
  870   2HD2  LEU 110          2HD2      LEU 110   2.748  -3.779  -3.779
  871   3HD2  LEU 110          1HD2      LEU 110   2.583  -2.097  -2.097
  872    H    VAL 111           H        VAL 111   8.543  -1.078  -1.078
  873    HA   VAL 111           HA       VAL 111  10.155  -3.335  -3.335
  874    HB   VAL 111           HB       VAL 111  10.256  -0.424  -0.424
  875   1HG1  VAL 111          1HG1      VAL 111  11.693  -2.848  -2.848
  876   2HG1  VAL 111          3HG1      VAL 111  11.579  -1.318  -1.318
  877   3HG1  VAL 111          2HG1      VAL 111  12.403  -1.389  -1.389
  878   1HG2  VAL 111          3HG2      VAL 111   8.171  -1.708  -1.708
  879   2HG2  VAL 111          2HG2      VAL 111   9.057  -1.025  -1.025
  880   3HG2  VAL 111          1HG2      VAL 111   9.189  -2.745  -2.745
  881    H    GLU 112           H        GLU 112  10.283  -0.632  -0.632
  882    HA   GLU 112           HA       GLU 112  13.136  -0.587  -0.587
  883   1HB   GLU 112          2HB       GLU 112  10.923   0.624   0.624
  884   2HB   GLU 112          1HB       GLU 112  12.631   0.852   0.852
  885   1HG   GLU 112          2HG       GLU 112  11.896   1.455   1.455
  886   2HG   GLU 112          1HG       GLU 112  11.109   2.479   2.479
  887    H    ILE 113           H        ILE 113  10.457  -2.005  -2.005
  888    HA   ILE 113           HA       ILE 113  12.312  -3.152  -3.152
  889    HB   ILE 113           HB       ILE 113  10.434  -3.846  -3.846
  890   1HG1  ILE 113          2HG1      ILE 113   8.702  -3.185  -3.185
  891   2HG1  ILE 113          1HG1      ILE 113   9.098  -4.805  -4.805
  892   1HG2  ILE 113          3HG2      ILE 113  10.928  -1.270  -1.270
  893   2HG2  ILE 113          2HG2      ILE 113   9.255  -1.334  -1.334
  894   3HG2  ILE 113          1HG2      ILE 113   9.657  -1.814  -1.814
  895   1HD1  ILE 113          2HD1      ILE 113   7.956  -3.207  -3.207
  896   2HD1  ILE 113          1HD1      ILE 113   6.895  -3.295  -3.295
  897   3HD1  ILE 113          3HD1      ILE 113   7.456  -4.774  -4.774
  898    H    GLY 114           H        GLY 114  10.596  -4.065  -4.065
  899   1HA   GLY 114          2HA       GLY 114  11.196  -5.986  -5.986
  900   2HA   GLY 114          1HA       GLY 114  11.742  -6.757  -6.757
  901    H    LEU 115           H        LEU 115   8.700  -5.076  -5.076
  902    HA   LEU 115           HA       LEU 115   7.275  -7.434  -7.434
  903   1HB   LEU 115          2HB       LEU 115   6.906  -4.698  -4.698
  904   2HB   LEU 115          1HB       LEU 115   5.634  -5.179  -5.179
  905    HG   LEU 115           HG       LEU 115   4.685  -6.660  -6.660
  906   1HD1  LEU 115          1HD1      LEU 115   7.329  -6.730  -6.730
  907   2HD1  LEU 115          3HD1      LEU 115   6.176  -6.319  -6.319
  908   3HD1  LEU 115          2HD1      LEU 115   5.961  -7.794  -7.794
  909   1HD2  LEU 115          3HD2      LEU 115   5.165  -3.892  -3.892
  910   2HD2  LEU 115          2HD2      LEU 115   3.697  -4.853  -4.853
  911   3HD2  LEU 115          1HD2      LEU 115   4.917  -4.852  -4.852
  912    H    ALA 116           H        ALA 116   6.455  -5.163  -5.163
  913    HA   ALA 116           HA       ALA 116   5.249  -7.325  -7.325
  914   1HB   ALA 116          3HB       ALA 116   4.317  -4.956  -4.956
  915   2HB   ALA 116          2HB       ALA 116   5.566  -4.494  -4.494
  916   3HB   ALA 116          1HB       ALA 116   4.341  -5.678  -5.678
  917    H    LYS 117           H        LYS 117   5.758  -6.607  -6.607
  918    HA   LYS 117           HA       LYS 117   8.680  -6.823  -6.823
  919   1HB   LYS 117          2HB       LYS 117   6.780  -8.865  -8.865
  920   2HB   LYS 117          1HB       LYS 117   7.432  -8.307  -8.307
  921   1HG   LYS 117          2HG       LYS 117   8.753 -10.140 -10.140
  922   2HG   LYS 117          1HG       LYS 117   9.715  -8.667  -8.667
  923   1HD   LYS 117          2HD       LYS 117   8.235  -9.136  -9.136
  924   2HD   LYS 117          1HD       LYS 117   9.195 -10.554 -10.554
  925   1HE   LYS 117          2HE       LYS 117  10.965  -8.536  -8.536
  926   2HE   LYS 117          1HE       LYS 117  10.045  -7.896  -7.896
  927   1HZ   LYS 117          1HZ       LYS 117  10.498 -10.413 -10.413
  928   2HZ   LYS 117          3HZ       LYS 117  11.907 -10.107 -10.107
  929   3HZ   LYS 117          2HZ       LYS 117  11.485  -9.101  -9.101
  930    H    ASP 118           H        ASP 118   9.540  -6.033  -6.033
  931    HA   ASP 118           HA       ASP 118   8.256  -3.734  -3.734
  932   1HB   ASP 118          2HB       ASP 118  10.034  -3.951  -3.951
  933   2HB   ASP 118          1HB       ASP 118  10.567  -3.656  -3.656
  934    H    ASP 119           H        ASP 119   8.179  -7.051  -7.051
  935    HA   ASP 119           HA       ASP 119   6.939  -6.496  -6.496
  936   1HB   ASP 119          2HB       ASP 119   8.391  -8.543  -8.543
  937   2HB   ASP 119          1HB       ASP 119   6.964  -9.164  -9.164
  938    H    GLN 120           H        GLN 120   5.969  -6.712  -6.712
  939    HA   GLN 120           HA       GLN 120   3.164  -7.136  -7.136
  940   1HB   GLN 120          2HB       GLN 120   4.269  -7.334  -7.334
  941   2HB   GLN 120          1HB       GLN 120   2.737  -7.946  -7.946
  942   1HG   GLN 120          2HG       GLN 120   4.074  -9.496  -9.496
  943   2HG   GLN 120          1HG       GLN 120   5.492  -9.004  -9.004
  944   1HE2  GLN 120          2HE2      GLN 120   3.831 -10.361 -10.361
  945   2HE2  GLN 120          1HE2      GLN 120   4.245  -8.777  -8.777
  946    H    LEU 121           H        LEU 121   5.263  -4.695  -4.695
  947    HA   LEU 121           HA       LEU 121   3.921  -3.075  -3.075
  948   1HB   LEU 121          2HB       LEU 121   5.976  -2.627  -2.627
  949   2HB   LEU 121          1HB       LEU 121   5.158  -1.223  -1.223
  950    HG   LEU 121           HG       LEU 121   6.626  -3.257  -3.257
  951   1HD1  LEU 121          1HD1      LEU 121   7.725  -1.336  -1.336
  952   2HD1  LEU 121          3HD1      LEU 121   7.867  -0.669  -0.669
  953   3HD1  LEU 121          2HD1      LEU 121   8.554  -2.253  -2.253
  954   1HD2  LEU 121          1HD2      LEU 121   4.731  -1.395  -1.395
  955   2HD2  LEU 121          3HD2      LEU 121   5.933  -2.125  -2.125
  956   3HD2  LEU 121          2HD2      LEU 121   6.255  -0.565  -0.565
  957    H    LYS 122           H        LYS 122   1.702  -3.455  -3.455
  958    HA   LYS 122           HA       LYS 122   0.911  -2.058  -2.058
  959   1HB   LYS 122          2HB       LYS 122  -0.426  -3.981  -3.981
  960   2HB   LYS 122          1HB       LYS 122  -1.420  -2.929  -2.929
  961   1HG   LYS 122          2HG       LYS 122   0.758  -4.648  -4.648
  962   2HG   LYS 122          1HG       LYS 122  -0.899  -5.222  -5.222
  963   1HD   LYS 122          2HD       LYS 122  -1.682  -3.970  -3.970
  964   2HD   LYS 122          1HD       LYS 122  -0.599  -2.622  -2.622
  965   1HE   LYS 122          2HE       LYS 122   1.240  -3.752  -3.752
  966   2HE   LYS 122          1HE       LYS 122   0.277  -5.214  -5.214
  967   1HZ   LYS 122          2HZ       LYS 122  -1.254  -3.505  -3.505
  968   2HZ   LYS 122          1HZ       LYS 122   0.224  -2.715  -2.715
  969   3HZ   LYS 122          3HZ       LYS 122   0.025  -4.307  -4.307
  970    H    VAL 123           H        VAL 123   1.486   0.054   0.054
  971    HA   VAL 123           HA       VAL 123  -0.080   1.091   1.091
  972    HB   VAL 123           HB       VAL 123   2.271   1.759   1.759
  973   1HG1  VAL 123          2HG1      VAL 123   1.711   1.979   1.979
  974   2HG1  VAL 123          1HG1      VAL 123   1.891   3.653   3.653
  975   3HG1  VAL 123          3HG1      VAL 123   3.193   2.497   2.497
  976   1HG2  VAL 123          1HG2      VAL 123   0.628   3.242   3.242
  977   2HG2  VAL 123          3HG2      VAL 123   1.973   4.124   4.124
  978   3HG2  VAL 123          2HG2      VAL 123   0.404   4.090   4.090
  979    H    HIS 124           H        HIS 124  -2.021   1.971   1.971
  980    HA   HIS 124           HA       HIS 124  -2.646   3.340   3.340
  981   1HB   HIS 124          2HB       HIS 124  -4.578   1.594   1.594
  982   2HB   HIS 124          1HB       HIS 124  -4.888   2.419   2.419
  983    HD1  HIS 124           HD1      HIS 124  -3.842   1.390   1.390
  984    HD2  HIS 124           HD2      HIS 124  -3.142  -0.792  -0.792
  985    HE1  HIS 124           HE1      HIS 124  -2.978  -0.841  -0.841
  986    HE2  HIS 124           HE2      HIS 124  -2.630  -2.169  -2.169
  987    H    GLY 125           H        GLY 125  -3.713   5.250   5.250
  988   1HA   GLY 125          2HA       GLY 125  -4.218   6.203   6.203
  989   2HA   GLY 125          1HA       GLY 125  -3.871   7.228   7.228
  990    H    PHE 126           HN       PHE 126  -6.226   6.555   6.555
  991    HA   PHE 126           HA       PHE 126  -8.501   5.850   5.850
  992   1HB   PHE 126          2HB       PHE 126  -9.633   6.566   6.566
  993   2HB   PHE 126          1HB       PHE 126  -8.009   6.673   6.673
  994    HD1  PHE 126           HD1      PHE 126  -6.816   8.983   8.983
  995    HD2  PHE 126           HD2      PHE 126 -11.026   8.385   8.385
  996    HE1  PHE 126           HE1      PHE 126  -7.173  11.372  11.372
  997    HE2  PHE 126           HE2      PHE 126 -11.392  10.772  10.772
  998    HZ   PHE 126           HZ       PHE 126  -9.465  12.269  12.269

  Start of MODEL   20
    1   1H    MET   1          2H        MET   1  -7.948  33.398  33.398
    2   2H    MET   1          1H        MET   1  -7.245  32.163  32.163
    3   3H    MET   1          3H        MET   1  -7.033  32.149  32.149
    4    HA   MET   1           HA       MET   1  -5.059  32.898  32.898
    5   1HB   MET   1          2HB       MET   1  -6.984  34.642  34.642
    6   2HB   MET   1          1HB       MET   1  -5.313  35.151  35.151
    7   1HG   MET   1          2HG       MET   1  -4.792  32.755  32.755
    8   2HG   MET   1          1HG       MET   1  -6.427  32.875  32.875
    9   1HE   MET   1          3HE       MET   1  -6.683  35.954  35.954
   10   2HE   MET   1          2HE       MET   1  -6.122  36.135  36.135
   11   3HE   MET   1          1HE       MET   1  -7.183  34.793  34.793
   12    H    ARG   2           H        ARG   2  -5.062  33.127  33.127
   13    HA   ARG   2           HA       ARG   2  -4.729  34.310  34.310
   14   1HB   ARG   2          2HB       ARG   2  -3.540  35.765  35.765
   15   2HB   ARG   2          1HB       ARG   2  -4.638  36.954  36.954
   16   1HG   ARG   2          2HG       ARG   2  -2.536  35.395  35.395
   17   2HG   ARG   2          1HG       ARG   2  -2.465  37.101  37.101
   18   1HD   ARG   2          2HD       ARG   2  -4.731  37.203  37.203
   19   2HD   ARG   2          1HD       ARG   2  -4.104  35.741  35.741
   20    HE   ARG   2           HE       ARG   2  -2.226  37.915  37.915
   21   1HH1  ARG   2          2HH1      ARG   2  -4.885  36.466  36.466
   22   2HH1  ARG   2          1HH1      ARG   2  -4.438  37.165  37.165
   23   1HH2  ARG   2          1HH2      ARG   2  -1.637  38.836  38.836
   24   2HH2  ARG   2          2HH2      ARG   2  -2.595  38.511  38.511
   25    H    GLY   3           H        GLY   3  -7.307  33.730  33.730
   26   1HA   GLY   3          2HA       GLY   3  -8.924  34.849  34.849
   27   2HA   GLY   3          1HA       GLY   3  -8.777  36.230  36.230
   28    H    SER   4           H        SER   4  -9.579  32.763  32.763
   29    HA   SER   4           HA       SER   4 -11.418  33.295  33.295
   30   1HB   SER   4          2HB       SER   4 -11.429  30.882  30.882
   31   2HB   SER   4          1HB       SER   4  -9.768  31.470  31.470
   32    HG   SER   4           HG       SER   4  -9.894  30.842  30.842
   33    H    HIS   5           H        HIS   5 -12.130  34.178  34.178
   34    HA   HIS   5           HA       HIS   5 -14.504  32.502  32.502
   35   1HB   HIS   5          2HB       HIS   5 -14.244  33.284  33.284
   36   2HB   HIS   5          1HB       HIS   5 -13.290  31.925  31.925
   37    HD1  HIS   5           HD1      HIS   5 -12.971  35.083  35.083
   38    HD2  HIS   5           HD2      HIS   5 -10.549  32.776  32.776
   39    HE1  HIS   5           HE1      HIS   5 -10.632  35.925  35.925
   40    HE2  HIS   5           HE2      HIS   5  -9.175  34.472  34.472
   41    H    HIS   6           H        HIS   6 -13.098  35.632  35.632
   42    HA   HIS   6           HA       HIS   6 -13.922  37.751  37.751
   43   1HB   HIS   6          2HB       HIS   6 -14.930  36.609  36.609
   44   2HB   HIS   6          1HB       HIS   6 -16.388  37.184  37.184
   45    HD1  HIS   6           HD1      HIS   6 -13.174  38.416  38.416
   46    HD2  HIS   6           HD2      HIS   6 -16.731  39.936  39.936
   47    HE1  HIS   6           HE1      HIS   6 -13.183  40.853  40.853
   48    HE2  HIS   6           HE2      HIS   6 -15.308  41.769  41.769
   49    H    HIS   7           H        HIS   7 -15.155  35.355  35.355
   50    HA   HIS   7           HA       HIS   7 -16.457  36.814  36.814
   51   1HB   HIS   7          2HB       HIS   7 -18.176  36.329  36.329
   52   2HB   HIS   7          1HB       HIS   7 -18.875  35.723  35.723
   53    HD1  HIS   7           HD1      HIS   7 -17.820  37.983  37.983
   54    HD2  HIS   7           HD2      HIS   7 -19.696  38.592  38.592
   55    HE1  HIS   7           HE1      HIS   7 -18.771  40.308  40.308
   56    HE2  HIS   7           HE2      HIS   7 -19.968  40.626  40.626
   57    H    HIS   8           H        HIS   8 -17.882  33.948  33.948
   58    HA   HIS   8           HA       HIS   8 -16.563  32.116  32.116
   59   1HB   HIS   8          2HB       HIS   8 -18.328  33.159  33.159
   60   2HB   HIS   8          1HB       HIS   8 -19.540  32.482  32.482
   61    HD1  HIS   8           HD1      HIS   8 -17.108  31.541  31.541
   62    HD2  HIS   8           HD2      HIS   8 -19.916  29.705  29.705
   63    HE1  HIS   8           HE1      HIS   8 -17.424  29.234  29.234
   64    HE2  HIS   8           HE2      HIS   8 -19.054  28.109  28.109
   65    H    HIS   9           H        HIS   9 -16.642  32.213  32.213
   66    HA   HIS   9           HA       HIS   9 -18.679  30.697  30.697
   67   1HB   HIS   9          2HB       HIS   9 -16.430  32.045  32.045
   68   2HB   HIS   9          1HB       HIS   9 -16.044  30.365  30.365
   69    HD1  HIS   9           HD1      HIS   9 -18.788  29.340  29.340
   70    HD2  HIS   9           HD2      HIS   9 -17.183  32.979  32.979
   71    HE1  HIS   9           HE1      HIS   9 -19.954  29.910  29.910
   72    HE2  HIS   9           HE2      HIS   9 -19.028  32.156  32.156
   73    H    HIS  10           H        HIS  10 -19.005  28.555  28.555
   74    HA   HIS  10           HA       HIS  10 -17.257  26.773  26.773
   75   1HB   HIS  10          2HB       HIS  10 -19.906  26.951  26.951
   76   2HB   HIS  10          1HB       HIS  10 -19.808  25.820  25.820
   77    HD1  HIS  10           HD1      HIS  10 -19.256  26.093  26.093
   78    HD2  HIS  10           HD2      HIS  10 -18.810  23.265  23.265
   79    HE1  HIS  10           HE1      HIS  10 -18.892  23.905  23.905
   80    HE2  HIS  10           HE2      HIS  10 -18.546  22.221  22.221
   81    H    THR  11           H        THR  11 -15.617  26.901  26.901
   82    HA   THR  11           HA       THR  11 -16.277  25.287  25.287
   83    HB   THR  11           HB       THR  11 -14.089  26.189  26.189
   84    HG1  THR  11           HG1      THR  11 -12.930  27.027  27.027
   85   1HG2  THR  11          3HG2      THR  11 -16.298  28.100  28.100
   86   2HG2  THR  11          2HG2      THR  11 -14.914  28.548  28.548
   87   3HG2  THR  11          1HG2      THR  11 -16.004  27.263  27.263
   88    H    ASP  12           H        ASP  12 -14.495  23.837  23.837
   89    HA   ASP  12           HA       ASP  12 -13.172  22.007  22.007
   90   1HB   ASP  12          2HB       ASP  12 -12.161  23.534  23.534
   91   2HB   ASP  12          1HB       ASP  12 -11.354  22.184  22.184
   92    HA   PRO  13           HA       PRO  13 -16.015  20.031  20.031
   93   1HB   PRO  13          2HB       PRO  13 -16.077  17.658  17.658
   94   2HB   PRO  13          1HB       PRO  13 -17.077  19.033  19.033
   95   1HG   PRO  13          2HG       PRO  13 -14.492  18.071  18.071
   96   2HG   PRO  13          1HG       PRO  13 -15.959  18.618  18.618
   97   1HD   PRO  13          2HD       PRO  13 -13.794  20.206  20.206
   98   2HD   PRO  13          1HD       PRO  13 -15.450  20.846  20.846
   99    H    MET  14           H        MET  14 -12.740  19.654  19.654
  100    HA   MET  14           HA       MET  14 -11.034  18.475  18.475
  101   1HB   MET  14          2HB       MET  14 -12.612  19.421  19.421
  102   2HB   MET  14          1HB       MET  14 -12.610  17.695  17.695
  103   1HG   MET  14          2HG       MET  14 -10.461  17.688  17.688
  104   2HG   MET  14          1HG       MET  14  -9.978  18.851  18.851
  105   1HE   MET  14          1HE       MET  14  -9.330  18.289  18.289
  106   2HE   MET  14          3HE       MET  14  -8.368  19.676  19.676
  107   3HE   MET  14          2HE       MET  14  -9.399  19.794  19.794
  108    H    SER  15           H        SER  15 -12.751  17.147  17.147
  109    HA   SER  15           HA       SER  15 -13.396  15.063  15.063
  110   1HB   SER  15          2HB       SER  15 -10.930  14.683  14.683
  111   2HB   SER  15          1HB       SER  15 -11.338  14.065  14.065
  112    HG   SER  15           HG       SER  15 -11.116  12.469  12.469
  113    H    ALA  16           H        ALA  16 -14.691  16.336  16.336
  114    HA   ALA  16           HA       ALA  16 -16.330  15.941  15.941
  115   1HB   ALA  16          3HB       ALA  16 -16.236  13.287  13.287
  116   2HB   ALA  16          2HB       ALA  16 -17.329  13.584  13.584
  117   3HB   ALA  16          1HB       ALA  16 -17.449  14.563  14.563
  118    H    ILE  17           H        ILE  17 -13.591  15.762  15.762
  119    HA   ILE  17           HA       ILE  17 -13.158  13.604  13.604
  120    HB   ILE  17           HB       ILE  17 -11.718  16.161  16.161
  121   1HG1  ILE  17          2HG1      ILE  17 -10.493  13.437  13.437
  122   2HG1  ILE  17          1HG1      ILE  17 -11.589  13.846  13.846
  123   1HG2  ILE  17          1HG2      ILE  17 -11.443  14.524  14.524
  124   2HG2  ILE  17          3HG2      ILE  17  -9.956  15.051  15.051
  125   3HG2  ILE  17          2HG2      ILE  17 -11.142  16.243  16.243
  126   1HD1  ILE  17          1HD1      ILE  17 -10.072  15.963  15.963
  127   2HD1  ILE  17          3HD1      ILE  17  -8.907  14.957  14.957
  128   3HD1  ILE  17          2HD1      ILE  17  -9.561  14.419  14.419
  129    H    GLN  18           H        GLN  18 -14.893  13.616  13.616
  130    HA   GLN  18           HA       GLN  18 -15.181  15.995  15.995
  131   1HB   GLN  18          2HB       GLN  18 -17.115  14.553  14.553
  132   2HB   GLN  18          1HB       GLN  18 -17.074  13.749  13.749
  133   1HG   GLN  18          2HG       GLN  18 -17.065  16.436  16.436
  134   2HG   GLN  18          1HG       GLN  18 -18.160  16.330  16.330
  135   1HE2  GLN  18          1HE2      GLN  18 -17.433  14.494  14.494
  136   2HE2  GLN  18          2HE2      GLN  18 -19.080  14.247  14.247
  137    H    ASN  19           H        ASN  19 -14.213  15.978  15.978
  138    HA   ASN  19           HA       ASN  19 -13.279  15.287  15.287
  139   1HB   ASN  19          2HB       ASN  19 -15.374  13.212  13.212
  140   2HB   ASN  19          1HB       ASN  19 -14.203  12.941  12.941
  141   1HD2  ASN  19          2HD2      ASN  19 -16.642  16.220  16.220
  142   2HD2  ASN  19          1HD2      ASN  19 -16.023  15.735  15.735
  143    H    LEU  20           H        LEU  20 -11.217  14.729  14.729
  144    HA   LEU  20           HA       LEU  20 -10.061  12.834  12.834
  145   1HB   LEU  20          2HB       LEU  20  -9.060  14.614  14.614
  146   2HB   LEU  20          1HB       LEU  20  -8.047  13.272  13.272
  147    HG   LEU  20           HG       LEU  20  -7.349  15.218  15.218
  148   1HD1  LEU  20          3HD1      LEU  20  -7.756  12.908  12.908
  149   2HD1  LEU  20          2HD1      LEU  20  -8.962  13.826  13.826
  150   3HD1  LEU  20          1HD1      LEU  20  -7.271  14.326  14.326
  151   1HD2  LEU  20          1HD2      LEU  20 -10.220  15.484  15.484
  152   2HD2  LEU  20          3HD2      LEU  20  -9.369  16.550  16.550
  153   3HD2  LEU  20          2HD2      LEU  20  -8.874  16.469  16.469
  154    H    HIS  21           H        HIS  21  -9.225  10.810  10.810
  155    HA   HIS  21           HA       HIS  21  -9.254   9.693   9.693
  156   1HB   HIS  21          2HB       HIS  21 -11.671   9.589   9.589
  157   2HB   HIS  21          1HB       HIS  21 -10.975   8.161   8.161
  158    HD1  HIS  21           HD1      HIS  21 -10.364   6.166   6.166
  159    HD2  HIS  21           HD2      HIS  21 -12.254   9.336   9.336
  160    HE1  HIS  21           HE1      HIS  21 -11.078   5.273   5.273
  161    HE2  HIS  21           HE2      HIS  21 -12.291   7.186   7.186
  162    H    SER  22           H        SER  22  -7.710   8.196   8.196
  163    HA   SER  22           HA       SER  22  -6.657   7.027   7.027
  164   1HB   SER  22          2HB       SER  22  -4.469   7.108   7.108
  165   2HB   SER  22          1HB       SER  22  -5.180   8.656   8.656
  166    HG   SER  22           HG       SER  22  -4.557   8.071   8.071
  167    H    PHE  23           H        PHE  23  -6.392   4.856   4.856
  168    HA   PHE  23           HA       PHE  23  -6.891   3.260   3.260
  169   1HB   PHE  23          2HB       PHE  23  -8.313   1.738   1.738
  170   2HB   PHE  23          1HB       PHE  23  -8.955   3.372   3.372
  171    HD1  PHE  23           HD2      PHE  23  -8.068   4.713   4.713
  172    HD2  PHE  23           HD1      PHE  23  -8.208   0.473   0.473
  173    HE1  PHE  23           HE2      PHE  23  -8.065   4.527   4.527
  174    HE2  PHE  23           HE1      PHE  23  -8.204   0.278   0.278
  175    HZ   PHE  23           HZ       PHE  23  -8.132   2.307   2.307
  176    H    ASP  24           H        ASP  24  -5.289   1.886   1.886
  177    HA   ASP  24           HA       ASP  24  -3.757   0.864   0.864
  178   1HB   ASP  24          2HB       ASP  24  -2.826   2.077   2.077
  179   2HB   ASP  24          1HB       ASP  24  -1.900   0.719   0.719
  180    HA   PRO  25           HA       PRO  25  -4.879  -3.184  -3.184
  181   1HB   PRO  25          2HB       PRO  25  -2.215  -4.036  -4.036
  182   2HB   PRO  25          1HB       PRO  25  -3.820  -4.603  -4.603
  183   1HG   PRO  25          2HG       PRO  25  -2.358  -3.049  -3.049
  184   2HG   PRO  25          1HG       PRO  25  -4.123  -2.899  -2.899
  185   1HD   PRO  25          2HD       PRO  25  -2.006  -1.161  -1.161
  186   2HD   PRO  25          1HD       PRO  25  -3.571  -0.714  -0.714
  187    H    PHE  26           H        PHE  26  -1.937  -1.605  -1.605
  188    HA   PHE  26           HA       PHE  26  -1.268  -3.587  -3.587
  189   1HB   PHE  26          2HB       PHE  26   0.068  -0.938  -0.938
  190   2HB   PHE  26          1HB       PHE  26   0.759  -2.549  -2.549
  191    HD1  PHE  26           HD1      PHE  26  -0.209  -3.808  -3.808
  192    HD2  PHE  26           HD2      PHE  26   1.347   0.090   0.090
  193    HE1  PHE  26           HE1      PHE  26   0.543  -3.686  -3.686
  194    HE2  PHE  26           HE2      PHE  26   2.102   0.218   0.218
  195    HZ   PHE  26           HZ       PHE  26   1.700  -1.672  -1.672
  196    H    ALA  27           H        ALA  27  -2.656  -0.355  -0.355
  197    HA   ALA  27           HA       ALA  27  -2.989  -0.331  -0.331
  198   1HB   ALA  27          2HB       ALA  27  -3.121   1.796   1.796
  199   2HB   ALA  27          1HB       ALA  27  -3.819   2.054   2.054
  200   3HB   ALA  27          3HB       ALA  27  -2.097   1.710   1.710
  201    H    ASP  28           H        ASP  28  -4.555  -2.183  -2.183
  202    HA   ASP  28           HA       ASP  28  -7.237  -1.036  -1.036
  203   1HB   ASP  28          2HB       ASP  28  -6.265  -1.826  -1.826
  204   2HB   ASP  28          1HB       ASP  28  -7.105  -3.273  -3.273
  205    H    ALA  29           H        ALA  29  -5.389  -4.070  -4.070
  206    HA   ALA  29           HA       ALA  29  -6.541  -5.019  -5.019
  207   1HB   ALA  29          3HB       ALA  29  -7.525  -6.008  -6.008
  208   2HB   ALA  29          2HB       ALA  29  -7.261  -7.199  -7.199
  209   3HB   ALA  29          1HB       ALA  29  -8.365  -5.849  -5.849
  210    H    SER  30           H        SER  30  -4.489  -5.320  -5.320
  211    HA   SER  30           HA       SER  30  -3.121  -7.693  -7.693
  212   1HB   SER  30          2HB       SER  30  -0.904  -6.389  -6.389
  213   2HB   SER  30          1HB       SER  30  -2.020  -6.281  -6.281
  214    HG   SER  30           HG       SER  30  -2.752  -4.285  -4.285
  215    H    LYS  31           H        LYS  31  -3.083  -8.653  -8.653
  216    HA   LYS  31           HA       LYS  31  -1.345  -7.661  -7.661
  217   1HB   LYS  31          2HB       LYS  31  -3.108  -7.598  -7.598
  218   2HB   LYS  31          1HB       LYS  31  -3.172  -6.273  -6.273
  219   1HG   LYS  31          2HG       LYS  31  -5.113  -7.037  -7.037
  220   2HG   LYS  31          1HG       LYS  31  -4.849  -8.699  -8.699
  221   1HD   LYS  31          2HD       LYS  31  -5.028  -7.148  -7.148
  222   2HD   LYS  31          1HD       LYS  31  -6.324  -6.588  -6.588
  223   1HE   LYS  31          2HE       LYS  31  -5.913  -9.518  -9.518
  224   2HE   LYS  31          1HE       LYS  31  -6.657  -8.632  -8.632
  225   1HZ   LYS  31          3HZ       LYS  31  -8.279  -7.755  -7.755
  226   2HZ   LYS  31          2HZ       LYS  31  -7.628  -8.808  -8.808
  227   3HZ   LYS  31          1HZ       LYS  31  -8.375  -9.429  -9.429
  228    H    GLY  32           H        GLY  32  -0.921  -9.208  -9.208
  229   1HA   GLY  32          2HA       GLY  32  -2.255 -11.807 -11.807
  230   2HA   GLY  32          1HA       GLY  32  -0.512 -11.736 -11.736
  231    H    ASP  33           H        ASP  33  -0.309 -13.204 -13.204
  232    HA   ASP  33           HA       ASP  33  -1.051 -12.187 -12.187
  233   1HB   ASP  33          2HB       ASP  33  -0.245 -14.429 -14.429
  234   2HB   ASP  33          1HB       ASP  33  -1.576 -14.505 -14.505
  235    H    ASP  34           H        ASP  34   0.335 -10.809 -10.809
  236    HA   ASP  34           HA       ASP  34   3.201 -11.470 -11.470
  237   1HB   ASP  34          2HB       ASP  34   1.956  -8.727  -8.727
  238   2HB   ASP  34          1HB       ASP  34   3.679  -9.020  -9.020
  239    H    LEU  35           H        LEU  35   1.567 -12.306 -12.306
  240    HA   LEU  35           HA       LEU  35   2.334 -10.511 -10.511
  241   1HB   LEU  35          2HB       LEU  35  -0.218 -11.652 -11.652
  242   2HB   LEU  35          1HB       LEU  35   0.295 -12.243 -12.243
  243    HG   LEU  35           HG       LEU  35  -1.083 -10.261 -10.261
  244   1HD1  LEU  35          2HD1      LEU  35   0.738 -10.645 -10.645
  245   2HD1  LEU  35          1HD1      LEU  35   1.807  -9.657  -9.657
  246   3HD1  LEU  35          3HD1      LEU  35   0.401  -8.928  -8.928
  247   1HD2  LEU  35          3HD2      LEU  35   0.806  -9.167  -9.167
  248   2HD2  LEU  35          2HD2      LEU  35  -0.938  -8.953  -8.953
  249   3HD2  LEU  35          1HD2      LEU  35   0.155  -8.069  -8.069
  250    H    LEU  36           H        LEU  36   2.590 -11.691 -11.691
  251    HA   LEU  36           HA       LEU  36   3.769 -14.357 -14.357
  252   1HB   LEU  36          2HB       LEU  36   4.844 -11.996 -11.996
  253   2HB   LEU  36          1HB       LEU  36   5.320 -13.622 -13.622
  254    HG   LEU  36           HG       LEU  36   6.988 -12.637 -12.637
  255   1HD1  LEU  36          1HD1      LEU  36   5.976 -15.111 -15.111
  256   2HD1  LEU  36          3HD1      LEU  36   5.728 -14.508 -14.508
  257   3HD1  LEU  36          2HD1      LEU  36   7.346 -14.515 -14.515
  258   1HD2  LEU  36          3HD2      LEU  36   5.083 -11.220 -11.220
  259   2HD2  LEU  36          2HD2      LEU  36   6.581 -11.614 -11.614
  260   3HD2  LEU  36          1HD2      LEU  36   5.121 -12.552 -12.552
  261    HA   PRO  37           HA       PRO  37   1.341 -16.049 -16.049
  262   1HB   PRO  37          2HB       PRO  37   3.879 -16.945 -16.945
  263   2HB   PRO  37          1HB       PRO  37   2.445 -17.882 -17.882
  264   1HG   PRO  37          2HG       PRO  37   4.660 -18.043 -18.043
  265   2HG   PRO  37          1HG       PRO  37   3.061 -18.037 -18.037
  266   1HD   PRO  37          2HD       PRO  37   5.082 -15.848 -15.848
  267   2HD   PRO  37          1HD       PRO  37   3.978 -16.255 -16.255
  268    H    ALA  38           H        ALA  38   0.460 -14.506 -14.506
  269    HA   ALA  38           HA       ALA  38   2.166 -13.248 -13.248
  270   1HB   ALA  38          2HB       ALA  38   1.007 -11.774 -11.774
  271   2HB   ALA  38          1HB       ALA  38  -0.510 -12.228 -12.228
  272   3HB   ALA  38          3HB       ALA  38   0.730 -11.372 -11.372
  273    H    GLY  39           H        GLY  39   1.663 -13.432 -13.432
  274   1HA   GLY  39          2HA       GLY  39  -0.721 -15.054 -15.054
  275   2HA   GLY  39          1HA       GLY  39   0.797 -15.160 -15.160
  276    H    THR  40           H        THR  40   0.471 -14.406 -14.406
  277    HA   THR  40           HA       THR  40  -0.880 -11.803 -11.803
  278    HB   THR  40           HB       THR  40  -1.502 -12.799 -12.799
  279    HG1  THR  40           HG1      THR  40  -1.514 -14.917 -14.917
  280   1HG2  THR  40          2HG2      THR  40  -2.901 -13.321 -13.321
  281   2HG2  THR  40          1HG2      THR  40  -3.559 -13.915 -13.915
  282   3HG2  THR  40          3HG2      THR  40  -3.312 -12.187 -12.187
  283    H    GLU  41           H        GLU  41   1.458 -14.081 -14.081
  284    HA   GLU  41           HA       GLU  41   3.388 -13.758 -13.758
  285   1HB   GLU  41          2HB       GLU  41   3.084 -11.389 -11.389
  286   2HB   GLU  41          1HB       GLU  41   3.773 -10.959 -10.959
  287   1HG   GLU  41          2HG       GLU  41   4.855 -13.066 -13.066
  288   2HG   GLU  41          1HG       GLU  41   5.480 -11.426 -11.426
  289    H    ASP  42           H        ASP  42   0.529 -13.048 -13.048
  290    HA   ASP  42           HA       ASP  42  -0.405 -12.382 -12.382
  291   1HB   ASP  42          2HB       ASP  42   1.594 -14.150 -14.150
  292   2HB   ASP  42          1HB       ASP  42   2.073 -12.779 -12.779
  293    H    TYR  43           H        TYR  43   0.088 -10.205 -10.205
  294    HA   TYR  43           HA       TYR  43   1.971  -8.405  -8.405
  295   1HB   TYR  43          2HB       TYR  43  -0.736  -7.768  -7.768
  296   2HB   TYR  43          1HB       TYR  43   0.611  -6.647  -6.647
  297    HD1  TYR  43           HD1      TYR  43   2.755  -8.757  -8.757
  298    HD2  TYR  43           HD2      TYR  43  -0.935  -7.513  -7.513
  299    HE1  TYR  43           HE1      TYR  43   3.579  -9.400  -9.400
  300    HE2  TYR  43           HE2      TYR  43  -0.120  -8.160  -8.160
  301    HH   TYR  43           HH       TYR  43   2.536  -8.399  -8.399
  302    H    ILE  44           H        ILE  44   1.434  -6.386  -6.386
  303    HA   ILE  44           HA       ILE  44  -0.421  -6.977  -6.977
  304    HB   ILE  44           HB       ILE  44   2.137  -5.370  -5.370
  305   1HG1  ILE  44          2HG1      ILE  44   2.577  -7.761  -7.761
  306   2HG1  ILE  44          1HG1      ILE  44   2.923  -7.196  -7.196
  307   1HG2  ILE  44          1HG2      ILE  44   0.084  -6.025  -6.025
  308   2HG2  ILE  44          3HG2      ILE  44   1.691  -5.394  -5.394
  309   3HG2  ILE  44          2HG2      ILE  44   0.555  -4.428  -4.428
  310   1HD1  ILE  44          1HD1      ILE  44   0.371  -7.959  -7.959
  311   2HD1  ILE  44          3HD1      ILE  44   0.883  -9.077  -9.077
  312   3HD1  ILE  44          2HD1      ILE  44   1.754  -9.020  -9.020
  313    H    HIS  45           H        HIS  45  -2.200  -5.862  -5.862
  314    HA   HIS  45           HA       HIS  45  -2.313  -3.470  -3.470
  315   1HB   HIS  45          2HB       HIS  45  -4.151  -5.271  -5.271
  316   2HB   HIS  45          1HB       HIS  45  -4.606  -3.617  -3.617
  317    HD1  HIS  45           HD1      HIS  45  -3.622  -5.537  -5.537
  318    HD2  HIS  45           HD2      HIS  45  -6.226  -2.563  -2.563
  319    HE1  HIS  45           HE1      HIS  45  -4.993  -4.936  -4.936
  320    HE2  HIS  45           HE2      HIS  45  -6.498  -3.067  -3.067
  321    H    ILE  46           H        ILE  46  -2.466  -1.389  -1.389
  322    HA   ILE  46           HA       ILE  46  -2.429  -0.550  -0.550
  323    HB   ILE  46           HB       ILE  46  -0.363   0.093   0.093
  324   1HG1  ILE  46          2HG1      ILE  46   1.034   0.083   0.083
  325   2HG1  ILE  46          1HG1      ILE  46  -0.404  -0.542  -0.542
  326   1HG2  ILE  46          3HG2      ILE  46  -1.528   1.984   1.984
  327   2HG2  ILE  46          2HG2      ILE  46   0.219   2.025   2.025
  328   3HG2  ILE  46          1HG2      ILE  46  -0.893   2.293   2.293
  329   1HD1  ILE  46          2HD1      ILE  46   0.361  -1.979  -1.979
  330   2HD1  ILE  46          1HD1      ILE  46   1.543  -2.052  -2.052
  331   3HD1  ILE  46          3HD1      ILE  46  -0.115  -2.587  -2.587
  332    H    ARG  47           H        ARG  47  -4.377   0.434   0.434
  333    HA   ARG  47           HA       ARG  47  -4.903   2.454   2.454
  334   1HB   ARG  47          2HB       ARG  47  -6.331   0.447   0.447
  335   2HB   ARG  47          1HB       ARG  47  -6.963   0.724   0.724
  336   1HG   ARG  47          2HG       ARG  47  -7.684   3.013   3.013
  337   2HG   ARG  47          1HG       ARG  47  -7.365   2.373   2.373
  338   1HD   ARG  47          2HD       ARG  47  -8.895   0.461   0.461
  339   2HD   ARG  47          1HD       ARG  47  -9.334   1.346   1.346
  340    HE   ARG  47           HE       ARG  47  -9.775   3.140   3.140
  341   1HH1  ARG  47          2HH1      ARG  47 -10.819  -0.146  -0.146
  342   2HH1  ARG  47          1HH1      ARG  47 -12.321   0.061   0.061
  343   1HH2  ARG  47          1HH2      ARG  47 -11.752   3.415   3.415
  344   2HH2  ARG  47          2HH2      ARG  47 -12.851   2.082   2.082
  345    H    ILE  48           H        ILE  48  -5.842   4.345   4.345
  346    HA   ILE  48           HA       ILE  48  -5.749   5.034   5.034
  347    HB   ILE  48           HB       ILE  48  -5.548   6.605   6.605
  348   1HG1  ILE  48          2HG1      ILE  48  -4.038   6.709   6.709
  349   2HG1  ILE  48          1HG1      ILE  48  -3.514   5.867   5.867
  350   1HG2  ILE  48          2HG2      ILE  48  -6.649   7.634   7.634
  351   2HG2  ILE  48          1HG2      ILE  48  -5.708   8.690   8.690
  352   3HG2  ILE  48          3HG2      ILE  48  -7.190   7.941   7.941
  353   1HD1  ILE  48          3HD1      ILE  48  -3.406   8.006   8.006
  354   2HD1  ILE  48          2HD1      ILE  48  -3.901   8.836   8.836
  355   3HD1  ILE  48          1HD1      ILE  48  -2.360   7.978   7.978
  356    H    GLN  49           H        GLN  49  -7.490   6.116   6.116
  357    HA   GLN  49           HA       GLN  49 -10.018   6.235   6.235
  358   1HB   GLN  49          2HB       GLN  49 -11.249   5.068   5.068
  359   2HB   GLN  49          1HB       GLN  49  -9.952   4.036   4.036
  360   1HG   GLN  49          2HG       GLN  49  -8.675   5.109   5.109
  361   2HG   GLN  49          1HG       GLN  49 -10.321   5.322   5.322
  362   1HE2  GLN  49          2HE2      GLN  49 -10.239   2.124   2.124
  363   2HE2  GLN  49          1HE2      GLN  49 -10.524   3.815   3.815
  364    H    GLN  50           H        GLN  50  -9.856   8.473   8.473
  365    HA   GLN  50           HA       GLN  50  -9.733   9.784   9.784
  366   1HB   GLN  50          2HB       GLN  50  -8.845  10.477  10.477
  367   2HB   GLN  50          1HB       GLN  50 -10.187  11.565  11.565
  368   1HG   GLN  50          2HG       GLN  50  -9.128  12.505  12.505
  369   2HG   GLN  50          1HG       GLN  50  -7.987  11.169  11.169
  370   1HE2  GLN  50          2HE2      GLN  50  -5.847  13.635  13.635
  371   2HE2  GLN  50          1HE2      GLN  50  -6.475  13.007  13.007
  372    H    ARG  51           H        ARG  51 -11.676   9.405   9.405
  373    HA   ARG  51           HA       ARG  51 -14.193   9.401   9.401
  374   1HB   ARG  51          2HB       ARG  51 -13.606  10.349  10.349
  375   2HB   ARG  51          1HB       ARG  51 -15.100   9.637   9.637
  376   1HG   ARG  51          2HG       ARG  51 -13.175   7.729   7.729
  377   2HG   ARG  51          1HG       ARG  51 -12.712   8.358   8.358
  378   1HD   ARG  51          2HD       ARG  51 -14.183   6.537   6.537
  379   2HD   ARG  51          1HD       ARG  51 -15.094   8.010   8.010
  380    HE   ARG  51           HE       ARG  51 -15.501   7.253   7.253
  381   1HH1  ARG  51          2HH1      ARG  51 -16.310   6.226   6.226
  382   2HH1  ARG  51          1HH1      ARG  51 -17.788   5.462   5.462
  383   1HH2  ARG  51          1HH2      ARG  51 -17.444   6.249   6.249
  384   2HH2  ARG  51          2HH2      ARG  51 -18.433   5.475   5.475
  385    H    ASN  52           H        ASN  52 -12.253  12.059  12.059
  386    HA   ASN  52           HA       ASN  52 -14.190  13.935  13.935
  387   1HB   ASN  52          2HB       ASN  52 -13.814  13.753  13.753
  388   2HB   ASN  52          1HB       ASN  52 -12.543  14.903  14.903
  389   1HD2  ASN  52          2HD2      ASN  52 -15.102  17.238  17.238
  390   2HD2  ASN  52          1HD2      ASN  52 -13.755  16.406  16.406
  391    H    GLY  53           H        GLY  53 -12.400  16.197  16.197
  392   1HA   GLY  53          2HA       GLY  53 -10.580  15.878  15.878
  393   2HA   GLY  53          1HA       GLY  53 -10.965  17.382  17.382
  394    H    ARG  54           H        ARG  54  -9.922  14.389  14.389
  395    HA   ARG  54           HA       ARG  54  -7.209  14.793  14.793
  396   1HB   ARG  54          2HB       ARG  54  -7.075  15.737  15.737
  397   2HB   ARG  54          1HB       ARG  54  -7.410  16.871  16.871
  398   1HG   ARG  54          2HG       ARG  54  -9.860  16.592  16.592
  399   2HG   ARG  54          1HG       ARG  54  -9.320  15.759  15.759
  400   1HD   ARG  54          2HD       ARG  54  -9.784  18.165  18.165
  401   2HD   ARG  54          1HD       ARG  54  -8.123  17.711  17.711
  402    HE   ARG  54           HE       ARG  54  -8.463  18.680  18.680
  403   1HH1  ARG  54          2HH1      ARG  54  -7.936  19.614  19.614
  404   2HH1  ARG  54          1HH1      ARG  54  -7.196  21.124  21.124
  405   1HH2  ARG  54          1HH2      ARG  54  -7.489  20.665  20.665
  406   2HH2  ARG  54          2HH2      ARG  54  -6.941  21.721  21.721
  407    H    LYS  55           H        LYS  55 -10.135  13.669  13.669
  408    HA   LYS  55           HA       LYS  55  -8.944  11.943  11.943
  409   1HB   LYS  55          2HB       LYS  55 -11.387  12.773  12.773
  410   2HB   LYS  55          1HB       LYS  55 -11.618  11.440  11.440
  411   1HG   LYS  55          2HG       LYS  55 -12.311  10.770  10.770
  412   2HG   LYS  55          1HG       LYS  55 -10.861   9.874   9.874
  413   1HD   LYS  55          2HD       LYS  55 -10.778  10.662  10.662
  414   2HD   LYS  55          1HD       LYS  55  -9.490  11.359  11.359
  415   1HE   LYS  55          2HE       LYS  55 -10.436  13.460  13.460
  416   2HE   LYS  55          1HE       LYS  55 -12.062  12.841  12.841
  417   1HZ   LYS  55          2HZ       LYS  55 -10.084  12.414  12.414
  418   2HZ   LYS  55          1HZ       LYS  55 -10.642  13.995  13.995
  419   3HZ   LYS  55          3HZ       LYS  55 -11.738  12.752  12.752
  420    H    THR  56           H        THR  56  -7.267  11.271  11.271
  421    HA   THR  56           HA       THR  56  -8.111   9.213   9.213
  422    HB   THR  56           HB       THR  56  -5.240   9.487   9.487
  423    HG1  THR  56           HG1      THR  56  -5.201  11.563  11.563
  424   1HG2  THR  56          3HG2      THR  56  -7.072   9.243   9.243
  425   2HG2  THR  56          2HG2      THR  56  -5.735  10.356  10.356
  426   3HG2  THR  56          1HG2      THR  56  -5.406   8.688   8.688
  427    H    LEU  57           H        LEU  57  -7.398   7.041   7.041
  428    HA   LEU  57           HA       LEU  57  -6.160   6.046   6.046
  429   1HB   LEU  57          2HB       LEU  57  -9.022   5.819   5.819
  430   2HB   LEU  57          1HB       LEU  57  -8.255   4.289   4.289
  431    HG   LEU  57           HG       LEU  57  -8.085   6.724   6.724
  432   1HD1  LEU  57          1HD1      LEU  57 -10.392   5.442   5.442
  433   2HD1  LEU  57          3HD1      LEU  57  -9.723   4.399   4.399
  434   3HD1  LEU  57          2HD1      LEU  57  -9.959   6.118   6.118
  435   1HD2  LEU  57          2HD2      LEU  57  -7.214   3.867   3.867
  436   2HD2  LEU  57          1HD2      LEU  57  -6.291   5.340   5.340
  437   3HD2  LEU  57          3HD2      LEU  57  -7.546   4.842   4.842
  438    H    THR  58           H        THR  58  -4.596   5.684   5.684
  439    HA   THR  58           HA       THR  58  -4.989   4.007   4.007
  440    HB   THR  58           HB       THR  58  -2.513   4.266   4.266
  441    HG1  THR  58           HG1      THR  58  -3.567   6.154   6.154
  442   1HG2  THR  58          3HG2      THR  58  -2.989   2.882   2.882
  443   2HG2  THR  58          2HG2      THR  58  -1.524   3.854   3.854
  444   3HG2  THR  58          1HG2      THR  58  -1.821   2.545   2.545
  445    H    THR  59           H        THR  59  -4.920   1.821   1.821
  446    HA   THR  59           HA       THR  59  -4.814   0.094   0.094
  447    HB   THR  59           HB       THR  59  -6.362  -1.324  -1.324
  448    HG1  THR  59           HG1      THR  59  -7.309  -0.010  -0.010
  449   1HG2  THR  59          2HG2      THR  59  -6.692  -0.593  -0.593
  450   2HG2  THR  59          1HG2      THR  59  -7.791   0.574   0.574
  451   3HG2  THR  59          3HG2      THR  59  -8.040  -1.154  -1.154
  452    H    VAL  60           H        VAL  60  -4.133  -2.107  -2.107
  453    HA   VAL  60           HA       VAL  60  -2.550  -2.461  -2.461
  454    HB   VAL  60           HB       VAL  60  -1.625  -3.217  -3.217
  455   1HG1  VAL  60          2HG1      VAL  60  -0.937  -4.683  -4.683
  456   2HG1  VAL  60          1HG1      VAL  60  -0.004  -3.293  -3.293
  457   3HG1  VAL  60          3HG1      VAL  60   0.354  -4.034  -4.034
  458   1HG2  VAL  60          1HG2      VAL  60  -1.067  -0.891  -0.891
  459   2HG2  VAL  60          3HG2      VAL  60  -1.295  -0.944  -0.944
  460   3HG2  VAL  60          2HG2      VAL  60   0.219  -1.510  -1.510
  461    H    GLN  61           H        GLN  61  -3.127  -4.222  -4.222
  462    HA   GLN  61           HA       GLN  61  -4.241  -6.484  -6.484
  463   1HB   GLN  61          2HB       GLN  61  -4.979  -6.459  -6.459
  464   2HB   GLN  61          1HB       GLN  61  -5.995  -6.636  -6.636
  465   1HG   GLN  61          2HG       GLN  61  -6.304  -4.331  -4.331
  466   2HG   GLN  61          1HG       GLN  61  -4.951  -3.968  -3.968
  467   1HE2  GLN  61          2HE2      GLN  61  -8.048  -5.618  -5.618
  468   2HE2  GLN  61          1HE2      GLN  61  -7.296  -6.444  -6.444
  469    H    GLY  62           H        GLY  62  -3.490  -8.507  -8.507
  470   1HA   GLY  62          2HA       GLY  62  -2.434 -10.029 -10.029
  471   2HA   GLY  62          1HA       GLY  62  -1.390  -8.689  -8.689
  472    H    ILE  63           H        ILE  63  -1.057  -7.831  -7.831
  473    HA   ILE  63           HA       ILE  63   1.310  -9.145  -9.145
  474    HB   ILE  63           HB       ILE  63  -0.527  -7.520  -7.520
  475   1HG1  ILE  63          2HG1      ILE  63   0.297  -6.103  -6.103
  476   2HG1  ILE  63          1HG1      ILE  63   1.426  -5.856  -5.856
  477   1HG2  ILE  63          1HG2      ILE  63   1.871  -9.018  -9.018
  478   2HG2  ILE  63          3HG2      ILE  63   1.976  -7.309  -7.309
  479   3HG2  ILE  63          2HG2      ILE  63   0.650  -8.294  -8.294
  480   1HD1  ILE  63          3HD1      ILE  63   2.879  -7.605  -7.605
  481   2HD1  ILE  63          2HD1      ILE  63   1.830  -7.371  -7.371
  482   3HD1  ILE  63          1HD1      ILE  63   2.755  -6.015  -6.015
  483    H    ALA  64           H        ALA  64   1.884 -10.702 -10.702
  484    HA   ALA  64           HA       ALA  64  -0.127 -12.705 -12.705
  485   1HB   ALA  64          1HB       ALA  64   2.377 -12.998 -12.998
  486   2HB   ALA  64          3HB       ALA  64   2.661 -12.934 -12.934
  487   3HB   ALA  64          2HB       ALA  64   1.602 -14.172 -14.172
  488    H    ASP  65           H        ASP  65  -1.083 -13.181 -13.181
  489    HA   ASP  65           HA       ASP  65  -1.056 -11.358 -11.358
  490   1HB   ASP  65          2HB       ASP  65  -2.275 -14.005 -14.005
  491   2HB   ASP  65          1HB       ASP  65  -2.108 -13.560 -13.560
  492    H    ASP  66           H        ASP  66   1.037 -13.945 -13.945
  493    HA   ASP  66           HA       ASP  66   1.907 -14.675 -14.675
  494   1HB   ASP  66          2HB       ASP  66   2.285 -15.927 -15.927
  495   2HB   ASP  66          1HB       ASP  66   3.606 -14.797 -14.797
  496    H    TYR  67           H        TYR  67   2.619 -12.000 -12.000
  497    HA   TYR  67           HA       TYR  67   5.114 -11.174 -11.174
  498   1HB   TYR  67          2HB       TYR  67   2.638  -9.560  -9.560
  499   2HB   TYR  67          1HB       TYR  67   4.208  -8.818  -8.818
  500    HD1  TYR  67           HD2      TYR  67   4.388 -12.007 -12.007
  501    HD2  TYR  67           HD1      TYR  67   3.782  -7.843  -7.843
  502    HE1  TYR  67           HE2      TYR  67   4.934 -12.289 -12.289
  503    HE2  TYR  67           HE1      TYR  67   4.323  -8.110  -8.110
  504    HH   TYR  67           HH       TYR  67   4.154 -10.472 -10.472
  505    H    ASP  68           H        ASP  68   5.620  -9.273  -9.273
  506    HA   ASP  68           HA       ASP  68   4.628  -9.872  -9.872
  507   1HB   ASP  68          2HB       ASP  68   6.939  -8.436  -8.436
  508   2HB   ASP  68          1HB       ASP  68   6.323  -7.775  -7.775
  509    H    LYS  69           H        LYS  69   2.454  -9.141  -9.141
  510    HA   LYS  69           HA       LYS  69   1.408  -6.842  -6.842
  511   1HB   LYS  69          2HB       LYS  69   0.733  -8.650  -8.650
  512   2HB   LYS  69          1HB       LYS  69   0.054  -7.036  -7.036
  513   1HG   LYS  69          2HG       LYS  69  -0.439  -7.717  -7.717
  514   2HG   LYS  69          1HG       LYS  69  -0.725  -9.208  -9.208
  515   1HD   LYS  69          2HD       LYS  69  -1.964  -6.518  -6.518
  516   2HD   LYS  69          1HD       LYS  69  -2.770  -7.887  -7.887
  517   1HE   LYS  69          2HE       LYS  69  -3.390  -8.554  -8.554
  518   2HE   LYS  69          1HE       LYS  69  -1.696  -8.910  -8.910
  519   1HZ   LYS  69          1HZ       LYS  69  -3.012  -6.292  -6.292
  520   2HZ   LYS  69          3HZ       LYS  69  -2.698  -7.457  -7.457
  521   3HZ   LYS  69          2HZ       LYS  69  -1.416  -6.696  -6.696
  522    H    LYS  70           H        LYS  70   3.080  -7.179  -7.179
  523    HA   LYS  70           HA       LYS  70   2.642  -4.553  -4.553
  524   1HB   LYS  70          2HB       LYS  70   4.572  -6.732  -6.732
  525   2HB   LYS  70          1HB       LYS  70   4.917  -5.112  -5.112
  526   1HG   LYS  70          2HG       LYS  70   3.738  -5.944  -5.944
  527   2HG   LYS  70          1HG       LYS  70   2.423  -5.236  -5.236
  528   1HD   LYS  70          2HD       LYS  70   2.217  -7.550  -7.550
  529   2HD   LYS  70          1HD       LYS  70   3.212  -8.123  -8.123
  530   1HE   LYS  70          2HE       LYS  70   1.104  -8.462  -8.462
  531   2HE   LYS  70          1HE       LYS  70   1.454  -6.846  -6.846
  532   1HZ   LYS  70          3HZ       LYS  70   0.192  -6.966  -6.966
  533   2HZ   LYS  70          2HZ       LYS  70  -0.768  -7.470  -7.470
  534   3HZ   LYS  70          1HZ       LYS  70  -0.097  -5.917  -5.917
  535    H    LYS  71           H        LYS  71   5.736  -5.883  -5.883
  536    HA   LYS  71           HA       LYS  71   6.954  -3.408  -3.408
  537   1HB   LYS  71          2HB       LYS  71   7.523  -6.208  -6.208
  538   2HB   LYS  71          1HB       LYS  71   8.172  -5.101  -5.101
  539   1HG   LYS  71          2HG       LYS  71   9.885  -5.398  -5.398
  540   2HG   LYS  71          1HG       LYS  71   9.189  -3.817  -3.817
  541   1HD   LYS  71          2HD       LYS  71   7.800  -4.906  -4.906
  542   2HD   LYS  71          1HD       LYS  71   8.673  -6.409  -6.409
  543   1HE   LYS  71          2HE       LYS  71  10.774  -4.862  -4.862
  544   2HE   LYS  71          1HE       LYS  71   9.609  -3.887  -3.887
  545   1HZ   LYS  71          2HZ       LYS  71   9.046  -6.180  -6.180
  546   2HZ   LYS  71          1HZ       LYS  71  10.612  -6.583  -6.583
  547   3HZ   LYS  71          3HZ       LYS  71  10.366  -5.277  -5.277
  548    H    LEU  72           H        LEU  72   4.571  -5.037  -5.037
  549    HA   LEU  72           HA       LEU  72   5.185  -4.050  -4.050
  550   1HB   LEU  72          2HB       LEU  72   3.514  -5.896  -5.896
  551   2HB   LEU  72          1HB       LEU  72   2.375  -4.568  -4.568
  552    HG   LEU  72           HG       LEU  72   3.842  -5.428  -5.428
  553   1HD1  LEU  72          1HD1      LEU  72   1.759  -6.697  -6.697
  554   2HD1  LEU  72          3HD1      LEU  72   0.895  -5.446  -5.446
  555   3HD1  LEU  72          2HD1      LEU  72   1.986  -6.541  -6.541
  556   1HD2  LEU  72          1HD2      LEU  72   1.924  -3.171  -3.171
  557   2HD2  LEU  72          3HD2      LEU  72   3.561  -3.074  -3.074
  558   3HD2  LEU  72          2HD2      LEU  72   2.269  -3.784  -3.784
  559    H    VAL  73           H        VAL  73   2.458  -2.993  -2.993
  560    HA   VAL  73           HA       VAL  73   2.388  -0.458  -0.458
  561    HB   VAL  73           HB       VAL  73   0.543   0.004   0.004
  562   1HG1  VAL  73          1HG1      VAL  73   0.340  -1.890  -1.890
  563   2HG1  VAL  73          3HG1      VAL  73  -1.076  -1.346  -1.346
  564   3HG1  VAL  73          2HG1      VAL  73  -0.061  -0.174  -0.174
  565   1HG2  VAL  73          1HG2      VAL  73   1.247  -2.047  -2.047
  566   2HG2  VAL  73          3HG2      VAL  73  -0.478  -1.873  -1.873
  567   3HG2  VAL  73          2HG2      VAL  73   0.489  -3.002  -3.002
  568    H    LYS  74           H        LYS  74   3.179  -1.602  -1.602
  569    HA   LYS  74           HA       LYS  74   3.427   0.793   0.793
  570   1HB   LYS  74          2HB       LYS  74   3.777  -1.606  -1.606
  571   2HB   LYS  74          1HB       LYS  74   5.446  -1.411  -1.411
  572   1HG   LYS  74          2HG       LYS  74   5.507  -0.853  -0.853
  573   2HG   LYS  74          1HG       LYS  74   5.431   0.715   0.715
  574   1HD   LYS  74          2HD       LYS  74   3.541   1.218   1.218
  575   2HD   LYS  74          1HD       LYS  74   2.774  -0.257  -0.257
  576   1HE   LYS  74          2HE       LYS  74   4.698  -0.487  -0.487
  577   2HE   LYS  74          1HE       LYS  74   3.117   0.219   0.219
  578   1HZ   LYS  74          1HZ       LYS  74   2.344  -1.899  -1.899
  579   2HZ   LYS  74          3HZ       LYS  74   3.810  -2.516  -2.516
  580   3HZ   LYS  74          2HZ       LYS  74   2.639  -1.960  -1.960
  581    H    ALA  75           H        ALA  75   5.768  -0.768  -0.768
  582    HA   ALA  75           HA       ALA  75   7.862   1.091   1.091
  583   1HB   ALA  75          3HB       ALA  75   7.262  -0.826  -0.826
  584   2HB   ALA  75          2HB       ALA  75   8.697   0.199   0.199
  585   3HB   ALA  75          1HB       ALA  75   8.447  -0.994  -0.994
  586    H    PHE  76           H        PHE  76   5.075   1.031   1.031
  587    HA   PHE  76           HA       PHE  76   5.814   3.035   3.035
  588   1HB   PHE  76          2HB       PHE  76   3.745   1.439   1.439
  589   2HB   PHE  76          1HB       PHE  76   2.981   2.735   2.735
  590    HD1  PHE  76           HD2      PHE  76   4.497   1.836   1.836
  591    HD2  PHE  76           HD1      PHE  76   2.274   4.738   4.738
  592    HE1  PHE  76           HE2      PHE  76   3.969   3.000   3.000
  593    HE2  PHE  76           HE1      PHE  76   1.738   5.906   5.906
  594    HZ   PHE  76           HZ       PHE  76   2.588   5.036   5.036
  595    H    LYS  77           H        LYS  77   4.062   3.240   3.240
  596    HA   LYS  77           HA       LYS  77   3.695   6.034   6.034
  597   1HB   LYS  77          2HB       LYS  77   3.900   4.226   4.226
  598   2HB   LYS  77          1HB       LYS  77   3.129   5.805   5.805
  599   1HG   LYS  77          2HG       LYS  77   1.216   4.915   4.915
  600   2HG   LYS  77          1HG       LYS  77   2.013   4.067   4.067
  601   1HD   LYS  77          2HD       LYS  77   1.576   2.163   2.163
  602   2HD   LYS  77          1HD       LYS  77   2.743   2.662   2.662
  603   1HE   LYS  77          2HE       LYS  77   0.534   4.059   4.059
  604   2HE   LYS  77          1HE       LYS  77  -0.190   2.592   2.592
  605   1HZ   LYS  77          2HZ       LYS  77   1.966   2.608   2.608
  606   2HZ   LYS  77          1HZ       LYS  77   0.320   2.478   2.478
  607   3HZ   LYS  77          3HZ       LYS  77   1.085   1.269   1.269
  608    H    LYS  78           H        LYS  78   6.503   4.181   4.181
  609    HA   LYS  78           HA       LYS  78   7.828   6.291   6.291
  610   1HB   LYS  78          2HB       LYS  78   8.677   3.480   3.480
  611   2HB   LYS  78          1HB       LYS  78   9.702   4.628   4.628
  612   1HG   LYS  78          2HG       LYS  78   7.629   4.769   4.769
  613   2HG   LYS  78          1HG       LYS  78   7.289   3.174   3.174
  614   1HD   LYS  78          2HD       LYS  78   8.606   2.593   2.593
  615   2HD   LYS  78          1HD       LYS  78   9.835   2.770   2.770
  616   1HE   LYS  78          2HE       LYS  78   9.100   5.161   5.161
  617   2HE   LYS  78          1HE       LYS  78  10.093   3.915   3.915
  618   1HZ   LYS  78          2HZ       LYS  78  11.463   4.151   4.151
  619   2HZ   LYS  78          1HZ       LYS  78  10.725   5.671   5.671
  620   3HZ   LYS  78          3HZ       LYS  78  11.673   5.265   5.265
  621    H    LYS  79           H        LYS  79   7.567   5.026   5.026
  622    HA   LYS  79           HA       LYS  79  10.067   6.279   6.279
  623   1HB   LYS  79          2HB       LYS  79   8.990   3.930   3.930
  624   2HB   LYS  79          1HB       LYS  79   8.296   4.969   4.969
  625   1HG   LYS  79          2HG       LYS  79  10.799   5.793   5.793
  626   2HG   LYS  79          1HG       LYS  79  11.119   4.192   4.192
  627   1HD   LYS  79          2HD       LYS  79  10.409   3.122   3.122
  628   2HD   LYS  79          1HD       LYS  79   9.174   4.334   4.334
  629   1HE   LYS  79          2HE       LYS  79  12.136   4.529   4.529
  630   2HE   LYS  79          1HE       LYS  79  10.842   4.444   4.444
  631   1HZ   LYS  79          1HZ       LYS  79  10.092   6.594   6.594
  632   2HZ   LYS  79          3HZ       LYS  79  11.765   6.705   6.705
  633   3HZ   LYS  79          2HZ       LYS  79  11.125   6.666   6.666
  634    H    PHE  80           H        PHE  80   6.583   6.610   6.610
  635    HA   PHE  80           HA       PHE  80   7.063   9.084   9.084
  636   1HB   PHE  80          2HB       PHE  80   4.505   7.503   7.503
  637   2HB   PHE  80          1HB       PHE  80   5.088   8.735   8.735
  638    HD1  PHE  80           HD2      PHE  80   6.774   8.213   8.213
  639    HD2  PHE  80           HD1      PHE  80   5.307   5.237   5.237
  640    HE1  PHE  80           HE2      PHE  80   7.749   6.461   6.461
  641    HE2  PHE  80           HE1      PHE  80   6.278   3.480   3.480
  642    HZ   PHE  80           HZ       PHE  80   7.501   4.092   4.092
  643    H    ALA  81           H        ALA  81   5.694   7.733   7.733
  644    HA   ALA  81           HA       ALA  81   4.772   8.752   8.752
  645   1HB   ALA  81          1HB       ALA  81   6.184  10.765  10.765
  646   2HB   ALA  81          3HB       ALA  81   4.577  11.412  11.412
  647   3HB   ALA  81          2HB       ALA  81   5.035  10.993  10.993
  648    H    CYS  82           H        CYS  82   3.267   7.582   7.582
  649    HA   CYS  82           HA       CYS  82   0.774   9.143   9.143
  650   1HB   CYS  82          2HB       CYS  82   1.858   7.169   7.169
  651   2HB   CYS  82          1HB       CYS  82   0.126   7.469   7.469
  652    HG   CYS  82           HG       CYS  82   2.229   9.430   9.430
  653    H    ASN  83           H        ASN  83  -1.141   7.342   7.342
  654    HA   ASN  83           HA       ASN  83  -0.896   5.537   5.537
  655   1HB   ASN  83          2HB       ASN  83  -2.705   6.793   6.793
  656   2HB   ASN  83          1HB       ASN  83  -3.090   7.219   7.219
  657   1HD2  ASN  83          2HD2      ASN  83  -5.195   4.438   4.438
  658   2HD2  ASN  83          1HD2      ASN  83  -4.108   5.540   5.540
  659    H    GLY  84           H        GLY  84  -0.821   3.425   3.425
  660   1HA   GLY  84          2HA       GLY  84  -1.886   2.425   2.425
  661   2HA   GLY  84          1HA       GLY  84  -0.413   1.803   1.803
  662    H    THR  85           H        THR  85  -3.577   1.140   1.140
  663    HA   THR  85           HA       THR  85  -3.758  -0.505  -0.505
  664    HB   THR  85           HB       THR  85  -6.191  -0.385  -0.385
  665    HG1  THR  85           HG1      THR  85  -5.633   1.231   1.231
  666   1HG2  THR  85          1HG2      THR  85  -4.570   1.771   1.771
  667   2HG2  THR  85          3HG2      THR  85  -5.872   2.450   2.450
  668   3HG2  THR  85          2HG2      THR  85  -6.250   1.488   1.488
  669    H    VAL  86           H        VAL  86  -4.979  -2.542  -2.542
  670    HA   VAL  86           HA       VAL  86  -4.486  -3.729  -3.729
  671    HB   VAL  86           HB       VAL  86  -3.078  -4.693  -4.693
  672   1HG1  VAL  86          1HG1      VAL  86  -5.285  -4.363  -4.363
  673   2HG1  VAL  86          3HG1      VAL  86  -5.159  -6.111  -6.111
  674   3HG1  VAL  86          2HG1      VAL  86  -3.786  -5.191  -5.191
  675   1HG2  VAL  86          1HG2      VAL  86  -4.558  -6.062  -6.062
  676   2HG2  VAL  86          3HG2      VAL  86  -3.237  -6.740  -6.740
  677   3HG2  VAL  86          2HG2      VAL  86  -4.906  -6.946  -6.946
  678    H    ILE  87           H        ILE  87  -6.707  -2.743  -2.743
  679    HA   ILE  87           HA       ILE  87  -8.968  -3.977  -3.977
  680    HB   ILE  87           HB       ILE  87 -10.332  -2.763  -2.763
  681   1HG1  ILE  87          2HG1      ILE  87  -8.476  -1.224  -1.224
  682   2HG1  ILE  87          1HG1      ILE  87  -7.954  -2.898  -2.898
  683   1HG2  ILE  87          3HG2      ILE  87  -8.017  -1.162  -1.162
  684   2HG2  ILE  87          2HG2      ILE  87  -9.499  -0.453  -0.453
  685   3HG2  ILE  87          1HG2      ILE  87  -9.563  -1.481  -1.481
  686   1HD1  ILE  87          2HD1      ILE  87 -10.289  -3.462  -3.462
  687   2HD1  ILE  87          1HD1      ILE  87 -10.622  -1.731  -1.731
  688   3HD1  ILE  87          3HD1      ILE  87  -9.405  -2.422  -2.422
  689    H    GLU  88           H        GLU  88 -10.535  -5.322  -5.322
  690    HA   GLU  88           HA       GLU  88  -9.378  -7.078  -7.078
  691   1HB   GLU  88          2HB       GLU  88 -10.027  -8.027  -8.027
  692   2HB   GLU  88          1HB       GLU  88 -11.699  -7.725  -7.725
  693   1HG   GLU  88          2HG       GLU  88 -11.640  -9.301  -9.301
  694   2HG   GLU  88          1HG       GLU  88  -9.879  -9.352  -9.352
  695    H    HIS  89           H        HIS  89 -10.075  -5.310  -5.310
  696    HA   HIS  89           HA       HIS  89 -12.678  -4.544  -4.544
  697   1HB   HIS  89          2HB       HIS  89 -10.344  -3.934  -3.934
  698   2HB   HIS  89          1HB       HIS  89 -10.939  -5.055  -5.055
  699    HD1  HIS  89           HD1      HIS  89 -12.512  -4.126  -4.126
  700    HD2  HIS  89           HD2      HIS  89 -12.182  -1.691  -1.691
  701    HE1  HIS  89           HE1      HIS  89 -13.832  -2.058  -2.058
  702    HE2  HIS  89           HE2      HIS  89 -13.684  -0.630  -0.630
  703    HA   PRO  90           HA       PRO  90 -14.536  -8.360  -8.360
  704   1HB   PRO  90          2HB       PRO  90 -16.940  -7.385  -7.385
  705   2HB   PRO  90          1HB       PRO  90 -16.461  -7.538  -7.538
  706   1HG   PRO  90          2HG       PRO  90 -16.449  -5.116  -5.116
  707   2HG   PRO  90          1HG       PRO  90 -16.982  -5.272  -5.272
  708   1HD   PRO  90          2HD       PRO  90 -14.550  -4.267  -4.267
  709   2HD   PRO  90          1HD       PRO  90 -14.842  -5.113  -5.113
  710    H    GLU  91           H        GLU  91 -13.954  -5.590  -5.590
  711    HA   GLU  91           HA       GLU  91 -14.892  -6.799  -6.799
  712   1HB   GLU  91          2HB       GLU  91 -14.264  -4.177  -4.177
  713   2HB   GLU  91          1HB       GLU  91 -13.228  -4.534  -4.534
  714   1HG   GLU  91          2HG       GLU  91 -15.321  -3.436  -3.436
  715   2HG   GLU  91          1HG       GLU  91 -15.139  -5.032  -5.032
  716    H    TYR  92           H        TYR  92 -11.951  -6.563  -6.563
  717    HA   TYR  92           HA       TYR  92 -10.494  -7.827  -7.827
  718   1HB   TYR  92          2HB       TYR  92  -9.066  -6.387  -6.387
  719   2HB   TYR  92          1HB       TYR  92  -8.550  -6.679  -6.679
  720    HD1  TYR  92           HD1      TYR  92 -10.880  -5.673  -5.673
  721    HD2  TYR  92           HD2      TYR  92  -8.922  -4.069  -4.069
  722    HE1  TYR  92           HE1      TYR  92 -11.638  -3.422  -3.422
  723    HE2  TYR  92           HE2      TYR  92  -9.673  -1.812  -1.812
  724    HH   TYR  92           HH       TYR  92 -10.510  -0.841  -0.841
  725    H    GLY  93           H        GLY  93 -10.530  -7.565  -7.565
  726   1HA   GLY  93          2HA       GLY  93 -10.773  -9.505  -9.505
  727   2HA   GLY  93          1HA       GLY  93 -10.029 -10.463 -10.463
  728    H    GLU  94           H        GLU  94  -9.515  -8.541  -8.541
  729    HA   GLU  94           HA       GLU  94  -7.697  -8.178  -8.178
  730   1HB   GLU  94          2HB       GLU  94  -7.432 -10.617 -10.617
  731   2HB   GLU  94          1HB       GLU  94  -6.476 -10.401 -10.401
  732   1HG   GLU  94          2HG       GLU  94  -5.538  -8.948  -8.948
  733   2HG   GLU  94          1HG       GLU  94  -5.422 -10.706 -10.706
  734    H    VAL  95           H        VAL  95  -7.371  -6.088  -6.088
  735    HA   VAL  95           HA       VAL  95  -4.954  -5.870  -5.870
  736    HB   VAL  95           HB       VAL  95  -5.917  -3.862  -3.862
  737   1HG1  VAL  95          3HG1      VAL  95  -6.041  -6.256  -6.256
  738   2HG1  VAL  95          2HG1      VAL  95  -7.751  -6.183  -6.183
  739   3HG1  VAL  95          1HG1      VAL  95  -7.080  -5.036  -5.036
  740   1HG2  VAL  95          3HG2      VAL  95  -8.445  -4.737  -4.737
  741   2HG2  VAL  95          2HG2      VAL  95  -7.565  -3.230  -3.230
  742   3HG2  VAL  95          1HG2      VAL  95  -8.370  -3.535  -3.535
  743    H    ILE  96           H        ILE  96  -3.593  -4.137  -4.137
  744    HA   ILE  96           HA       ILE  96  -3.932  -3.069  -3.069
  745    HB   ILE  96           HB       ILE  96  -1.678  -3.333  -3.333
  746   1HG1  ILE  96          2HG1      ILE  96  -2.169  -4.773  -4.773
  747   2HG1  ILE  96          1HG1      ILE  96  -0.534  -4.121  -4.121
  748   1HG2  ILE  96          2HG2      ILE  96  -1.952  -0.977  -0.977
  749   2HG2  ILE  96          1HG2      ILE  96  -0.366  -1.660  -1.660
  750   3HG2  ILE  96          3HG2      ILE  96  -1.374  -1.035  -1.035
  751   1HD1  ILE  96          3HD1      ILE  96  -1.970  -2.235  -2.235
  752   2HD1  ILE  96          2HD1      ILE  96  -2.562  -3.792  -3.792
  753   3HD1  ILE  96          1HD1      ILE  96  -0.840  -3.429  -3.429
  754    H    GLN  97           H        GLN  97  -4.830  -1.192  -1.192
  755    HA   GLN  97           HA       GLN  97  -5.265   0.697   0.697
  756   1HB   GLN  97          2HB       GLN  97  -6.877  -0.239  -0.239
  757   2HB   GLN  97          1HB       GLN  97  -6.580   1.465   1.465
  758   1HG   GLN  97          2HG       GLN  97  -7.382   1.993   1.993
  759   2HG   GLN  97          1HG       GLN  97  -7.736   0.285   0.285
  760   1HE2  GLN  97          2HE2      GLN  97  -9.963   2.210   2.210
  761   2HE2  GLN  97          1HE2      GLN  97  -8.262   2.490   2.490
  762    H    LEU  98           H        LEU  98  -3.813   2.256   2.256
  763    HA   LEU  98           HA       LEU  98  -2.488   3.309   3.309
  764   1HB   LEU  98          2HB       LEU  98  -1.822   3.845   3.845
  765   2HB   LEU  98          1HB       LEU  98  -0.858   4.274   4.274
  766    HG   LEU  98           HG       LEU  98  -1.453   1.396   1.396
  767   1HD1  LEU  98          1HD1      LEU  98  -0.874   2.509   2.509
  768   2HD1  LEU  98          3HD1      LEU  98   0.764   2.507   2.507
  769   3HD1  LEU  98          2HD1      LEU  98  -0.120   0.991   0.991
  770   1HD2  LEU  98          1HD2      LEU  98   0.076   2.760   2.760
  771   2HD2  LEU  98          3HD2      LEU  98   0.473   1.125   1.125
  772   3HD2  LEU  98          2HD2      LEU  98   1.260   2.510   2.510
  773    H    GLN  99           H        GLN  99  -2.247   5.640   5.640
  774    HA   GLN  99           HA       GLN  99  -4.681   7.004   7.004
  775   1HB   GLN  99          2HB       GLN  99  -2.982   7.118   7.118
  776   2HB   GLN  99          1HB       GLN  99  -3.203   8.723   8.723
  777   1HG   GLN  99          2HG       GLN  99  -5.546   6.927   6.927
  778   2HG   GLN  99          1HG       GLN  99  -4.851   7.880   7.880
  779   1HE2  GLN  99          2HE2      GLN  99  -7.629   9.654   9.654
  780   2HE2  GLN  99          1HE2      GLN  99  -7.479   8.025   8.025
  781    H    GLY 100           H        GLY 100  -4.719   8.649   8.649
  782   1HA   GLY 100          2HA       GLY 100  -3.910  10.443  10.443
  783   2HA   GLY 100          1HA       GLY 100  -2.297  10.117  10.117
  784    H    ASP 101           H        ASP 101  -2.679  10.730  10.730
  785    HA   ASP 101           HA       ASP 101  -3.009   8.480   8.480
  786   1HB   ASP 101          2HB       ASP 101  -1.911   9.897   9.897
  787   2HB   ASP 101          1HB       ASP 101  -3.237  10.709  10.709
  788    H    GLN 102           H        GLN 102  -1.732   6.878   6.878
  789    HA   GLN 102           HA       GLN 102   1.143   7.203   7.203
  790   1HB   GLN 102          2HB       GLN 102  -0.576   4.849   4.849
  791   2HB   GLN 102          1HB       GLN 102   1.163   4.957   4.957
  792   1HG   GLN 102          2HG       GLN 102  -1.007   6.502   6.502
  793   2HG   GLN 102          1HG       GLN 102   0.236   5.478   5.478
  794   1HE2  GLN 102          2HE2      GLN 102   0.990   9.360   9.360
  795   2HE2  GLN 102          1HE2      GLN 102  -0.419   8.543   8.543
  796    H    ARG 103           H        ARG 103  -0.991   6.451   6.451
  797    HA   ARG 103           HA       ARG 103  -0.274   4.153   4.153
  798   1HB   ARG 103          2HB       ARG 103  -0.802   5.206   5.206
  799   2HB   ARG 103          1HB       ARG 103  -1.926   5.747   5.747
  800   1HG   ARG 103          2HG       ARG 103  -1.484   7.763   7.763
  801   2HG   ARG 103          1HG       ARG 103  -0.098   7.694   7.694
  802   1HD   ARG 103          2HD       ARG 103   1.088   8.120   8.120
  803   2HD   ARG 103          1HD       ARG 103   0.889   6.394   6.394
  804    HE   ARG 103           HE       ARG 103  -0.522   6.886   6.886
  805   1HH1  ARG 103          2HH1      ARG 103  -0.060   9.752   9.752
  806   2HH1  ARG 103          1HH1      ARG 103  -0.863  10.794  10.794
  807   1HH2  ARG 103          1HH2      ARG 103  -1.581   8.255   8.255
  808   2HH2  ARG 103          2HH2      ARG 103  -1.727   9.945   9.945
  809    H    LYS 104           H        LYS 104   1.699   7.015   7.015
  810    HA   LYS 104           HA       LYS 104   3.768   5.831   5.831
  811   1HB   LYS 104          2HB       LYS 104   3.096   8.182   8.182
  812   2HB   LYS 104          1HB       LYS 104   3.634   8.605   8.605
  813   1HG   LYS 104          2HG       LYS 104   5.800   7.292   7.292
  814   2HG   LYS 104          1HG       LYS 104   5.152   8.355   8.355
  815   1HD   LYS 104          2HD       LYS 104   6.563   9.817   9.817
  816   2HD   LYS 104          1HD       LYS 104   5.105  10.085  10.085
  817   1HE   LYS 104          2HE       LYS 104   6.206   8.020   8.020
  818   2HE   LYS 104          1HE       LYS 104   7.658   8.814   8.814
  819   1HZ   LYS 104          3HZ       LYS 104   5.609  10.497  10.497
  820   2HZ   LYS 104          2HZ       LYS 104   6.527   9.516   9.516
  821   3HZ   LYS 104          1HZ       LYS 104   7.294  10.648  10.648
  822    H    ASN 105           H        ASN 105   2.987   6.533   6.533
  823    HA   ASN 105           HA       ASN 105   5.722   6.259   6.259
  824   1HB   ASN 105          2HB       ASN 105   3.127   6.522   6.522
  825   2HB   ASN 105          1HB       ASN 105   4.738   6.556   6.556
  826   1HD2  ASN 105          2HD2      ASN 105   4.504  10.015  10.015
  827   2HD2  ASN 105          1HD2      ASN 105   4.542   8.607   8.607
  828    H    ILE 106           H        ILE 106   2.707   4.388   4.388
  829    HA   ILE 106           HA       ILE 106   3.722   2.298   2.298
  830    HB   ILE 106           HB       ILE 106   1.293   2.741   2.741
  831   1HG1  ILE 106          2HG1      ILE 106   0.656   0.402   0.402
  832   2HG1  ILE 106          1HG1      ILE 106   2.192  -0.086  -0.086
  833   1HG2  ILE 106          3HG2      ILE 106   1.488   2.973   2.973
  834   2HG2  ILE 106          2HG2      ILE 106   1.718   1.231   1.231
  835   3HG2  ILE 106          1HG2      ILE 106   0.203   1.886   1.886
  836   1HD1  ILE 106          3HD1      ILE 106   2.475   1.536   1.536
  837   2HD1  ILE 106          2HD1      ILE 106   1.621   0.014   0.014
  838   3HD1  ILE 106          1HD1      ILE 106   3.239   0.010   0.010
  839    H    CYS 107           H        CYS 107   3.329   2.522   2.522
  840    HA   CYS 107           HA       CYS 107   4.424   0.024   0.024
  841   1HB   CYS 107          2HB       CYS 107   4.936   1.004   1.004
  842   2HB   CYS 107          1HB       CYS 107   3.310   1.420   1.420
  843    HG   CYS 107           HG       CYS 107   5.060   3.423   3.423
  844    H    GLN 108           H        GLN 108   5.845   3.110   3.110
  845    HA   GLN 108           HA       GLN 108   8.556   2.392   2.392
  846   1HB   GLN 108          2HB       GLN 108   8.294   4.677   4.677
  847   2HB   GLN 108          1HB       GLN 108   7.116   4.690   4.690
  848   1HG   GLN 108          2HG       GLN 108   8.787   5.649   5.649
  849   2HG   GLN 108          1HG       GLN 108   9.311   3.988   3.988
  850   1HE2  GLN 108          2HE2      GLN 108  12.139   4.220   4.220
  851   2HE2  GLN 108          1HE2      GLN 108  11.003   3.162   3.162
  852    H    PHE 109           H        PHE 109   6.406   2.236   2.236
  853    HA   PHE 109           HA       PHE 109   8.400   1.638   1.638
  854   1HB   PHE 109          2HB       PHE 109   6.260   2.595   2.595
  855   2HB   PHE 109          1HB       PHE 109   5.403   1.211   1.211
  856    HD1  PHE 109           HD1      PHE 109   8.023   2.043   2.043
  857    HD2  PHE 109           HD2      PHE 109   4.806  -0.513  -0.513
  858    HE1  PHE 109           HE1      PHE 109   8.175   0.916   0.916
  859    HE2  PHE 109           HE2      PHE 109   4.951  -1.647  -1.647
  860    HZ   PHE 109           HZ       PHE 109   6.637  -0.932  -0.932
  861    H    LEU 110           H        LEU 110   6.072  -0.284  -0.284
  862    HA   LEU 110           HA       LEU 110   6.613  -2.789  -2.789
  863   1HB   LEU 110          2HB       LEU 110   5.536  -1.806  -1.806
  864   2HB   LEU 110          1HB       LEU 110   5.999  -3.493  -3.493
  865    HG   LEU 110           HG       LEU 110   4.349  -3.972  -3.972
  866   1HD1  LEU 110          1HD1      LEU 110   4.801  -2.043  -2.043
  867   2HD1  LEU 110          3HD1      LEU 110   3.897  -1.013  -1.013
  868   3HD1  LEU 110          2HD1      LEU 110   3.077  -2.315  -2.315
  869   1HD2  LEU 110          1HD2      LEU 110   3.541  -2.315  -2.315
  870   2HD2  LEU 110          3HD2      LEU 110   3.006  -3.923  -3.923
  871   3HD2  LEU 110          2HD2      LEU 110   2.324  -2.495  -2.495
  872    H    VAL 111           H        VAL 111   8.379  -0.896  -0.896
  873    HA   VAL 111           HA       VAL 111  10.145  -3.121  -3.121
  874    HB   VAL 111           HB       VAL 111  10.206  -0.258  -0.258
  875   1HG1  VAL 111          1HG1      VAL 111  11.913  -2.632  -2.632
  876   2HG1  VAL 111          3HG1      VAL 111  11.551  -1.542  -1.542
  877   3HG1  VAL 111          2HG1      VAL 111  12.349  -0.927  -0.927
  878   1HG2  VAL 111          2HG2      VAL 111   8.210  -1.772  -1.772
  879   2HG2  VAL 111          1HG2      VAL 111   9.041  -0.921  -0.921
  880   3HG2  VAL 111          3HG2      VAL 111   9.362  -2.633  -2.633
  881    H    GLU 112           H        GLU 112  10.094  -0.193  -0.193
  882    HA   GLU 112           HA       GLU 112  12.891  -0.011  -0.011
  883   1HB   GLU 112          2HB       GLU 112  10.462   1.139   1.139
  884   2HB   GLU 112          1HB       GLU 112  12.048   1.331   1.331
  885   1HG   GLU 112          2HG       GLU 112  12.078   2.014   2.014
  886   2HG   GLU 112          1HG       GLU 112  10.890   2.959   2.959
  887    H    ILE 113           H        ILE 113  10.224  -1.509  -1.509
  888    HA   ILE 113           HA       ILE 113  12.022  -2.498  -2.498
  889    HB   ILE 113           HB       ILE 113  10.093  -3.271  -3.271
  890   1HG1  ILE 113          2HG1      ILE 113   8.601  -2.809  -2.809
  891   2HG1  ILE 113          1HG1      ILE 113   8.894  -4.352  -4.352
  892   1HG2  ILE 113          1HG2      ILE 113  10.530  -0.707  -0.707
  893   2HG2  ILE 113          3HG2      ILE 113   8.966  -0.797  -0.797
  894   3HG2  ILE 113          2HG2      ILE 113   9.108  -1.261  -1.261
  895   1HD1  ILE 113          2HD1      ILE 113   7.544  -2.602  -2.602
  896   2HD1  ILE 113          1HD1      ILE 113   6.677  -2.665  -2.665
  897   3HD1  ILE 113          3HD1      ILE 113   7.023  -4.153  -4.153
  898    H    GLY 114           H        GLY 114  10.342  -3.649  -3.649
  899   1HA   GLY 114          2HA       GLY 114  11.107  -5.560  -5.560
  900   2HA   GLY 114          1HA       GLY 114  11.713  -6.232  -6.232
  901    H    LEU 115           H        LEU 115   8.554  -4.781  -4.781
  902    HA   LEU 115           HA       LEU 115   7.287  -7.161  -7.161
  903   1HB   LEU 115          2HB       LEU 115   6.713  -4.515  -4.515
  904   2HB   LEU 115          1HB       LEU 115   5.612  -4.998  -4.998
  905    HG   LEU 115           HG       LEU 115   4.500  -6.550  -6.550
  906   1HD1  LEU 115          2HD1      LEU 115   6.799  -6.045  -6.045
  907   2HD1  LEU 115          1HD1      LEU 115   5.250  -6.621  -6.621
  908   3HD1  LEU 115          3HD1      LEU 115   6.143  -7.579  -7.579
  909   1HD2  LEU 115          3HD2      LEU 115   4.356  -3.885  -3.885
  910   2HD2  LEU 115          2HD2      LEU 115   3.335  -5.030  -5.030
  911   3HD2  LEU 115          1HD2      LEU 115   4.774  -4.363  -4.363
  912    H    ALA 116           H        ALA 116   6.441  -5.194  -5.194
  913    HA   ALA 116           HA       ALA 116   5.490  -7.606  -7.606
  914   1HB   ALA 116          3HB       ALA 116   4.077  -5.577  -5.577
  915   2HB   ALA 116          2HB       ALA 116   5.314  -4.737  -4.737
  916   3HB   ALA 116          1HB       ALA 116   4.472  -6.119  -6.119
  917    H    LYS 117           H        LYS 117   5.880  -7.090  -7.090
  918    HA   LYS 117           HA       LYS 117   8.816  -7.048  -7.048
  919   1HB   LYS 117          2HB       LYS 117   6.872  -8.951  -8.951
  920   2HB   LYS 117          1HB       LYS 117   7.665  -8.247  -8.247
  921   1HG   LYS 117          2HG       LYS 117   8.819 -10.248 -10.248
  922   2HG   LYS 117          1HG       LYS 117   9.846  -8.835  -8.835
  923   1HD   LYS 117          2HD       LYS 117   8.202  -9.470  -9.470
  924   2HD   LYS 117          1HD       LYS 117   9.284 -10.786 -10.786
  925   1HE   LYS 117          2HE       LYS 117  10.873  -8.531  -8.531
  926   2HE   LYS 117          1HE       LYS 117   9.881  -8.219  -8.219
  927   1HZ   LYS 117          1HZ       LYS 117  11.510 -10.660 -10.660
  928   2HZ   LYS 117          3HZ       LYS 117  11.931  -9.377  -9.377
  929   3HZ   LYS 117          2HZ       LYS 117  10.582 -10.333 -10.333
  930    H    ASP 118           H        ASP 118   9.742  -5.998  -5.998
  931    HA   ASP 118           HA       ASP 118   8.558  -3.573  -3.573
  932   1HB   ASP 118          2HB       ASP 118  10.661  -4.938  -4.938
  933   2HB   ASP 118          1HB       ASP 118  10.399  -3.211  -3.211
  934    H    ASP 119           H        ASP 119   8.404  -6.718  -6.718
  935    HA   ASP 119           HA       ASP 119   7.213  -5.769  -5.769
  936   1HB   ASP 119          2HB       ASP 119   6.905  -8.170  -8.170
  937   2HB   ASP 119          1HB       ASP 119   8.562  -7.805  -7.805
  938    H    GLN 120           H        GLN 120   6.165  -6.852  -6.852
  939    HA   GLN 120           HA       GLN 120   3.417  -7.239  -7.239
  940   1HB   GLN 120          2HB       GLN 120   4.618  -7.163  -7.163
  941   2HB   GLN 120          1HB       GLN 120   3.011  -7.735  -7.735
  942   1HG   GLN 120          2HG       GLN 120   4.141  -9.472  -9.472
  943   2HG   GLN 120          1HG       GLN 120   5.653  -8.987  -8.987
  944   1HE2  GLN 120          2HE2      GLN 120   4.059  -9.994  -9.994
  945   2HE2  GLN 120          1HE2      GLN 120   4.423  -8.460  -8.460
  946    H    LEU 121           H        LEU 121   5.281  -4.571  -4.571
  947    HA   LEU 121           HA       LEU 121   3.744  -2.925  -2.925
  948   1HB   LEU 121          2HB       LEU 121   5.572  -2.324  -2.324
  949   2HB   LEU 121          1HB       LEU 121   4.768  -1.049  -1.049
  950    HG   LEU 121           HG       LEU 121   6.549  -3.087  -3.087
  951   1HD1  LEU 121          2HD1      LEU 121   7.238  -0.449  -0.449
  952   2HD1  LEU 121          1HD1      LEU 121   8.215  -1.165  -1.165
  953   3HD1  LEU 121          3HD1      LEU 121   8.002  -2.020  -2.020
  954   1HD2  LEU 121          3HD2      LEU 121   4.765  -1.286  -1.286
  955   2HD2  LEU 121          2HD2      LEU 121   6.140  -1.996  -1.996
  956   3HD2  LEU 121          1HD2      LEU 121   6.297  -0.415  -0.415
  957    H    LYS 122           H        LYS 122   1.550  -3.281  -3.281
  958    HA   LYS 122           HA       LYS 122   0.590  -2.378  -2.378
  959   1HB   LYS 122          2HB       LYS 122  -0.409  -4.266  -4.266
  960   2HB   LYS 122          1HB       LYS 122  -1.639  -3.286  -3.286
  961   1HG   LYS 122          2HG       LYS 122   0.399  -4.914  -4.914
  962   2HG   LYS 122          1HG       LYS 122  -1.209  -5.501  -5.501
  963   1HD   LYS 122          2HD       LYS 122  -2.236  -4.216  -4.216
  964   2HD   LYS 122          1HD       LYS 122  -1.098  -2.882  -2.882
  965   1HE   LYS 122          2HE       LYS 122   0.581  -4.135  -4.135
  966   2HE   LYS 122          1HE       LYS 122  -0.563  -5.462  -5.462
  967   1HZ   LYS 122          2HZ       LYS 122  -2.000  -3.449  -3.449
  968   2HZ   LYS 122          1HZ       LYS 122  -0.455  -2.886  -2.886
  969   3HZ   LYS 122          3HZ       LYS 122  -0.980  -4.387  -4.387
  970    H    VAL 123           H        VAL 123   1.213  -0.160  -0.160
  971    HA   VAL 123           HA       VAL 123  -0.464   1.040   1.040
  972    HB   VAL 123           HB       VAL 123   1.821   1.855   1.855
  973   1HG1  VAL 123          1HG1      VAL 123   1.377   1.565   1.565
  974   2HG1  VAL 123          3HG1      VAL 123   1.134   3.304   3.304
  975   3HG1  VAL 123          2HG1      VAL 123   2.659   2.575   2.575
  976   1HG2  VAL 123          1HG2      VAL 123  -0.354   3.857   3.857
  977   2HG2  VAL 123          3HG2      VAL 123   0.265   3.391   3.391
  978   3HG2  VAL 123          2HG2      VAL 123   1.293   4.284   4.284
  979    H    HIS 124           H        HIS 124  -2.532   1.517   1.517
  980    HA   HIS 124           HA       HIS 124  -3.318   2.323   2.323
  981   1HB   HIS 124          2HB       HIS 124  -4.950   1.034   1.034
  982   2HB   HIS 124          1HB       HIS 124  -5.621   1.621   1.621
  983    HD1  HIS 124           HD1      HIS 124  -5.139   0.234   0.234
  984    HD2  HIS 124           HD2      HIS 124  -3.499  -1.358  -1.358
  985    HE1  HIS 124           HE1      HIS 124  -4.422  -2.098  -2.098
  986    HE2  HIS 124           HE2      HIS 124  -3.321  -2.994  -2.994
  987    H    GLY 125           H        GLY 125  -3.554   3.123   3.123
  988   1HA   GLY 125          2HA       GLY 125  -4.194   5.055   5.055
  989   2HA   GLY 125          1HA       GLY 125  -3.779   5.877   5.877
  990    H    PHE 126           HN       PHE 126  -5.375   6.909   6.909
  991    HA   PHE 126           HA       PHE 126  -7.949   5.896   5.896
  992   1HB   PHE 126          2HB       PHE 126  -9.322   7.047   7.047
  993   2HB   PHE 126          1HB       PHE 126  -8.028   6.367   6.367
  994    HD1  PHE 126           HD1      PHE 126  -5.979   8.553   8.553
  995    HD2  PHE 126           HD2      PHE 126  -9.904   8.679   8.679
  996    HE1  PHE 126           HE1      PHE 126  -5.515  10.784  10.784
  997    HE2  PHE 126           HE2      PHE 126  -9.447  10.912  10.912
  998    HZ   PHE 126           HZ       PHE 126  -7.251  11.967  11.967

  Start of MODEL   21
    1   1H    MET   1          2H        MET   1 -47.925  -0.424  -0.424
    2   2H    MET   1          1H        MET   1 -46.419  -0.817  -0.817
    3   3H    MET   1          3H        MET   1 -47.511   0.229   0.229
    4    HA   MET   1           HA       MET   1 -49.067  -1.505  -1.505
    5   1HB   MET   1          2HB       MET   1 -46.284  -2.397  -2.397
    6   2HB   MET   1          1HB       MET   1 -47.786  -2.843  -2.843
    7   1HG   MET   1          2HG       MET   1 -46.554  -0.101  -0.101
    8   2HG   MET   1          1HG       MET   1 -46.636  -1.169  -1.169
    9   1HE   MET   1          2HE       MET   1 -48.844  -2.341  -2.341
   10   2HE   MET   1          1HE       MET   1 -50.264  -1.970  -1.970
   11   3HE   MET   1          3HE       MET   1 -50.114  -1.302  -1.302
   12    H    ARG   2           H        ARG   2 -49.905  -2.568  -2.568
   13    HA   ARG   2           HA       ARG   2 -50.249  -4.262  -4.262
   14   1HB   ARG   2          2HB       ARG   2 -48.573  -5.482  -5.482
   15   2HB   ARG   2          1HB       ARG   2 -48.709  -6.379  -6.379
   16   1HG   ARG   2          2HG       ARG   2 -50.538  -7.252  -7.252
   17   2HG   ARG   2          1HG       ARG   2 -51.306  -5.734  -5.734
   18   1HD   ARG   2          2HD       ARG   2 -51.756  -5.367  -5.367
   19   2HD   ARG   2          1HD       ARG   2 -50.023  -5.224  -5.224
   20    HE   ARG   2           HE       ARG   2 -50.437  -7.893  -7.893
   21   1HH1  ARG   2          2HH1      ARG   2 -51.968  -5.202  -5.202
   22   2HH1  ARG   2          1HH1      ARG   2 -52.374  -6.118  -6.118
   23   1HH2  ARG   2          1HH2      ARG   2 -50.970  -9.098  -9.098
   24   2HH2  ARG   2          2HH2      ARG   2 -51.808  -8.329  -8.329
   25    H    GLY   3           H        GLY   3 -48.214  -2.271  -2.271
   26   1HA   GLY   3          2HA       GLY   3 -46.750  -3.799  -3.799
   27   2HA   GLY   3          1HA       GLY   3 -45.837  -2.753  -2.753
   28    H    SER   4           H        SER   4 -47.634  -2.948  -2.948
   29    HA   SER   4           HA       SER   4 -48.209  -0.118  -0.118
   30   1HB   SER   4          2HB       SER   4 -48.748  -2.525  -2.525
   31   2HB   SER   4          1HB       SER   4 -48.703  -0.961  -0.961
   32    HG   SER   4           HG       SER   4 -50.787  -1.290  -1.290
   33    H    HIS   5           H        HIS   5 -46.443  -2.299  -2.299
   34    HA   HIS   5           HA       HIS   5 -44.651  -0.065  -0.065
   35   1HB   HIS   5          2HB       HIS   5 -45.898  -1.197  -1.197
   36   2HB   HIS   5          1HB       HIS   5 -45.008  -2.671  -2.671
   37    HD1  HIS   5           HD1      HIS   5 -44.356   0.889   0.889
   38    HD2  HIS   5           HD2      HIS   5 -42.595  -2.873  -2.873
   39    HE1  HIS   5           HE1      HIS   5 -42.337   1.137   1.137
   40    HE2  HIS   5           HE2      HIS   5 -41.338  -1.172  -1.172
   41    H    HIS   6           H        HIS   6 -44.744  -3.287  -3.287
   42    HA   HIS   6           HA       HIS   6 -42.006  -3.914  -3.914
   43   1HB   HIS   6          2HB       HIS   6 -44.085  -5.372  -5.372
   44   2HB   HIS   6          1HB       HIS   6 -43.681  -4.840  -4.840
   45    HD1  HIS   6           HD1      HIS   6 -43.471  -7.812  -7.812
   46    HD2  HIS   6           HD2      HIS   6 -40.310  -5.118  -5.118
   47    HE1  HIS   6           HE1      HIS   6 -41.394  -9.219  -9.219
   48    HE2  HIS   6           HE2      HIS   6 -39.499  -7.563  -7.563
   49    H    HIS   7           H        HIS   7 -43.901  -2.239  -2.239
   50    HA   HIS   7           HA       HIS   7 -43.299  -0.918  -0.918
   51   1HB   HIS   7          2HB       HIS   7 -41.886   0.063   0.063
   52   2HB   HIS   7          1HB       HIS   7 -40.528  -0.675  -0.675
   53    HD1  HIS   7           HD1      HIS   7 -39.363   1.294   1.294
   54    HD2  HIS   7           HD2      HIS   7 -43.458   1.372   1.372
   55    HE1  HIS   7           HE1      HIS   7 -39.742   3.235   3.235
   56    HE2  HIS   7           HE2      HIS   7 -42.234   3.305   3.305
   57    H    HIS   8           H        HIS   8 -43.439  -2.961  -2.961
   58    HA   HIS   8           HA       HIS   8 -41.223  -4.546  -4.546
   59   1HB   HIS   8          2HB       HIS   8 -43.839  -3.993  -3.993
   60   2HB   HIS   8          1HB       HIS   8 -42.615  -4.959  -4.959
   61    HD1  HIS   8           HD1      HIS   8 -44.396  -4.957  -4.957
   62    HD2  HIS   8           HD2      HIS   8 -42.803  -7.592  -7.592
   63    HE1  HIS   8           HE1      HIS   8 -44.937  -7.256  -7.256
   64    HE2  HIS   8           HE2      HIS   8 -43.877  -8.834  -8.834
   65    H    HIS   9           H        HIS   9 -40.617  -4.703  -4.703
   66    HA   HIS   9           HA       HIS   9 -40.015  -2.041  -2.041
   67   1HB   HIS   9          2HB       HIS   9 -37.859  -4.140  -4.140
   68   2HB   HIS   9          1HB       HIS   9 -37.678  -2.451  -2.451
   69    HD1  HIS   9           HD1      HIS   9 -37.146  -0.835  -0.835
   70    HD2  HIS   9           HD2      HIS   9 -38.522  -4.474  -4.474
   71    HE1  HIS   9           HE1      HIS   9 -36.853  -0.712  -0.712
   72    HE2  HIS   9           HE2      HIS   9 -37.773  -2.891  -2.891
   73    H    HIS  10           H        HIS  10 -40.527  -1.971  -1.971
   74    HA   HIS  10           HA       HIS  10 -41.049  -4.411  -4.411
   75   1HB   HIS  10          2HB       HIS  10 -42.554  -2.450  -2.450
   76   2HB   HIS  10          1HB       HIS  10 -41.249  -1.535  -1.535
   77    HD1  HIS  10           HD1      HIS  10 -42.112  -5.106  -5.106
   78    HD2  HIS  10           HD2      HIS  10 -42.352  -1.295  -1.295
   79    HE1  HIS  10           HE1      HIS  10 -42.820  -5.444  -5.444
   80    HE2  HIS  10           HE2      HIS  10 -42.870  -3.131  -3.131
   81    H    THR  11           H        THR  11 -38.541  -2.021  -2.021
   82    HA   THR  11           HA       THR  11 -37.317  -2.286  -2.286
   83    HB   THR  11           HB       THR  11 -35.361  -1.372  -1.372
   84    HG1  THR  11           HG1      THR  11 -36.362  -2.432  -2.432
   85   1HG2  THR  11          3HG2      THR  11 -37.453   0.057   0.057
   86   2HG2  THR  11          2HG2      THR  11 -37.488  -0.365  -0.365
   87   3HG2  THR  11          1HG2      THR  11 -36.103   0.499   0.499
   88    H    ASP  12           H        ASP  12 -36.656  -4.067  -4.067
   89    HA   ASP  12           HA       ASP  12 -35.434  -6.203  -6.203
   90   1HB   ASP  12          2HB       ASP  12 -37.334  -6.309  -6.309
   91   2HB   ASP  12          1HB       ASP  12 -36.168  -7.614  -7.614
   92    HA   PRO  13           HA       PRO  13 -31.635  -5.509  -5.509
   93   1HB   PRO  13          2HB       PRO  13 -31.368  -8.471  -8.471
   94   2HB   PRO  13          1HB       PRO  13 -30.241  -7.214  -7.214
   95   1HG   PRO  13          2HG       PRO  13 -31.661  -8.587  -8.587
   96   2HG   PRO  13          1HG       PRO  13 -31.364  -6.851  -6.851
   97   1HD   PRO  13          2HD       PRO  13 -33.841  -8.255  -8.255
   98   2HD   PRO  13          1HD       PRO  13 -33.667  -6.813  -6.813
   99    H    MET  14           H        MET  14 -33.981  -7.878  -7.878
  100    HA   MET  14           HA       MET  14 -32.878  -8.634  -8.634
  101   1HB   MET  14          2HB       MET  14 -35.656  -8.491  -8.491
  102   2HB   MET  14          1HB       MET  14 -35.443  -8.785  -8.785
  103   1HG   MET  14          2HG       MET  14 -35.102 -10.925 -10.925
  104   2HG   MET  14          1HG       MET  14 -33.673 -10.511 -10.511
  105   1HE   MET  14          2HE       MET  14 -35.143 -13.046 -13.046
  106   2HE   MET  14          1HE       MET  14 -34.063 -12.734 -12.734
  107   3HE   MET  14          3HE       MET  14 -35.738 -13.199 -13.199
  108    H    SER  15           H        SER  15 -34.317  -5.642  -5.642
  109    HA   SER  15           HA       SER  15 -35.218  -4.613  -4.613
  110   1HB   SER  15          2HB       SER  15 -34.928  -2.410  -2.410
  111   2HB   SER  15          1HB       SER  15 -35.518  -3.526  -3.526
  112    HG   SER  15           HG       SER  15 -33.050  -2.269  -2.269
  113    H    ALA  16           H        ALA  16 -31.957  -4.998  -4.998
  114    HA   ALA  16           HA       ALA  16 -30.959  -4.031  -4.031
  115   1HB   ALA  16          2HB       ALA  16 -30.653  -2.503  -2.503
  116   2HB   ALA  16          1HB       ALA  16 -29.254  -3.554  -3.554
  117   3HB   ALA  16          3HB       ALA  16 -29.426  -2.613  -2.613
  118    H    ILE  17           H        ILE  17 -30.601  -6.077  -6.077
  119    HA   ILE  17           HA       ILE  17 -28.655  -7.727  -7.727
  120    HB   ILE  17           HB       ILE  17 -30.591  -8.714  -8.714
  121   1HG1  ILE  17          2HG1      ILE  17 -30.854  -9.172  -9.172
  122   2HG1  ILE  17          1HG1      ILE  17 -31.606  -7.784  -7.784
  123   1HG2  ILE  17          1HG2      ILE  17 -28.511  -9.960  -9.960
  124   2HG2  ILE  17          3HG2      ILE  17 -29.979 -10.883 -10.883
  125   3HG2  ILE  17          2HG2      ILE  17 -28.976 -10.320 -10.320
  126   1HD1  ILE  17          3HD1      ILE  17 -32.523  -9.704  -9.704
  127   2HD1  ILE  17          2HD1      ILE  17 -32.309 -10.647 -10.647
  128   3HD1  ILE  17          1HD1      ILE  17 -33.343  -9.218  -9.218
  129    H    GLN  18           H        GLN  18 -26.691  -7.718  -7.718
  130    HA   GLN  18           HA       GLN  18 -26.352  -7.029  -7.029
  131   1HB   GLN  18          2HB       GLN  18 -24.379  -7.159  -7.159
  132   2HB   GLN  18          1HB       GLN  18 -23.938  -6.782  -6.782
  133   1HG   GLN  18          2HG       GLN  18 -25.930  -5.189  -5.189
  134   2HG   GLN  18          1HG       GLN  18 -24.209  -4.813  -4.813
  135   1HE2  GLN  18          2HE2      GLN  18 -25.422  -2.632  -2.632
  136   2HE2  GLN  18          1HE2      GLN  18 -25.139  -2.761  -2.761
  137    H    ASN  19           H        ASN  19 -26.173  -8.636  -8.636
  138    HA   ASN  19           HA       ASN  19 -24.318 -10.761 -10.761
  139   1HB   ASN  19          2HB       ASN  19 -26.626 -11.315 -11.315
  140   2HB   ASN  19          1HB       ASN  19 -27.031 -11.907 -11.907
  141   1HD2  ASN  19          2HD2      ASN  19 -24.122 -13.742 -13.742
  142   2HD2  ASN  19          1HD2      ASN  19 -24.586 -12.112 -12.112
  143    H    LEU  20           H        LEU  20 -27.388 -10.079 -10.079
  144    HA   LEU  20           HA       LEU  20 -27.930 -10.015 -10.015
  145   1HB   LEU  20          2HB       LEU  20 -25.078  -9.225  -9.225
  146   2HB   LEU  20          1HB       LEU  20 -25.712  -9.727  -9.727
  147    HG   LEU  20           HG       LEU  20 -27.127  -7.642  -7.642
  148   1HD1  LEU  20          2HD1      LEU  20 -24.596  -7.392  -7.392
  149   2HD1  LEU  20          1HD1      LEU  20 -25.803  -6.129  -6.129
  150   3HD1  LEU  20          3HD1      LEU  20 -25.192  -6.472  -6.472
  151   1HD2  LEU  20          1HD2      LEU  20 -27.181  -8.647  -8.647
  152   2HD2  LEU  20          3HD2      LEU  20 -28.511  -8.194  -8.194
  153   3HD2  LEU  20          2HD2      LEU  20 -27.539  -6.944  -6.944
  154    H    HIS  21           H        HIS  21 -28.675 -12.063 -12.063
  155    HA   HIS  21           HA       HIS  21 -27.030 -14.354 -14.354
  156   1HB   HIS  21          2HB       HIS  21 -29.828 -13.979 -13.979
  157   2HB   HIS  21          1HB       HIS  21 -29.033 -15.509 -15.509
  158    HD1  HIS  21           HD1      HIS  21 -31.628 -15.150 -15.150
  159    HD2  HIS  21           HD2      HIS  21 -28.092 -13.686 -13.686
  160    HE1  HIS  21           HE1      HIS  21 -32.069 -14.901 -14.901
  161    HE2  HIS  21           HE2      HIS  21 -29.945 -13.930 -13.930
  162    H    SER  22           H        SER  22 -25.931 -15.161 -15.161
  163    HA   SER  22           HA       SER  22 -24.951 -15.318 -15.318
  164   1HB   SER  22          2HB       SER  22 -26.412 -15.578 -15.578
  165   2HB   SER  22          1HB       SER  22 -27.289 -16.181 -16.181
  166    HG   SER  22           HG       SER  22 -27.659 -13.789 -13.789
  167    H    PHE  23           H        PHE  23 -23.649 -13.448 -13.448
  168    HA   PHE  23           HA       PHE  23 -24.536 -10.905 -10.905
  169   1HB   PHE  23          2HB       PHE  23 -23.110 -11.179 -11.179
  170   2HB   PHE  23          1HB       PHE  23 -21.775 -11.570 -11.570
  171    HD1  PHE  23           HD2      PHE  23 -21.229  -9.836  -9.836
  172    HD2  PHE  23           HD1      PHE  23 -23.541  -8.979  -8.979
  173    HE1  PHE  23           HE2      PHE  23 -20.752  -7.437  -7.437
  174    HE2  PHE  23           HE1      PHE  23 -23.068  -6.579  -6.579
  175    HZ   PHE  23           HZ       PHE  23 -21.671  -5.807  -5.807
  176    H    ASP  24           H        ASP  24 -23.786  -9.925  -9.925
  177    HA   ASP  24           HA       ASP  24 -22.940  -9.741  -9.741
  178   1HB   ASP  24          2HB       ASP  24 -20.828 -11.298 -11.298
  179   2HB   ASP  24          1HB       ASP  24 -20.720 -11.152 -11.152
  180    HA   PRO  25           HA       PRO  25 -25.221 -13.253 -13.253
  181   1HB   PRO  25          2HB       PRO  25 -24.622 -11.737 -11.737
  182   2HB   PRO  25          1HB       PRO  25 -26.161 -12.379 -12.379
  183   1HG   PRO  25          2HG       PRO  25 -25.638  -9.771  -9.771
  184   2HG   PRO  25          1HG       PRO  25 -26.510 -10.594 -10.594
  185   1HD   PRO  25          2HD       PRO  25 -23.666  -9.687  -9.687
  186   2HD   PRO  25          1HD       PRO  25 -24.802  -9.684  -9.684
  187    H    PHE  26           H        PHE  26 -22.064 -12.076 -12.076
  188    HA   PHE  26           HA       PHE  26 -21.499 -14.495 -14.495
  189   1HB   PHE  26          2HB       PHE  26 -19.193 -12.823 -12.823
  190   2HB   PHE  26          1HB       PHE  26 -20.184 -13.179 -13.179
  191    HD1  PHE  26           HD2      PHE  26 -22.447 -11.785 -11.785
  192    HD2  PHE  26           HD1      PHE  26 -18.936 -10.634 -10.634
  193    HE1  PHE  26           HE2      PHE  26 -23.177  -9.437  -9.437
  194    HE2  PHE  26           HE1      PHE  26 -19.659  -8.284  -8.284
  195    HZ   PHE  26           HZ       PHE  26 -21.782  -7.682  -7.682
  196    H    ALA  27           H        ALA  27 -20.852 -12.999 -12.999
  197    HA   ALA  27           HA       ALA  27 -19.778 -13.725 -13.725
  198   1HB   ALA  27          3HB       ALA  27 -21.004 -15.906 -15.906
  199   2HB   ALA  27          2HB       ALA  27 -19.334 -16.452 -16.452
  200   3HB   ALA  27          1HB       ALA  27 -19.951 -15.933 -15.933
  201    H    ASP  28           H        ASP  28 -17.820 -12.900 -12.900
  202    HA   ASP  28           HA       ASP  28 -15.678 -13.375 -13.375
  203   1HB   ASP  28          2HB       ASP  28 -16.011 -11.681 -11.681
  204   2HB   ASP  28          1HB       ASP  28 -14.404 -11.967 -11.967
  205    H    ALA  29           H        ALA  29 -14.978 -15.457 -15.457
  206    HA   ALA  29           HA       ALA  29 -13.846 -16.310 -16.310
  207   1HB   ALA  29          3HB       ALA  29 -15.982 -17.516 -17.516
  208   2HB   ALA  29          2HB       ALA  29 -14.717 -18.406 -18.406
  209   3HB   ALA  29          1HB       ALA  29 -14.752 -18.385 -18.385
  210    H    SER  30           H        SER  30 -12.084 -17.920 -17.920
  211    HA   SER  30           HA       SER  30 -10.143 -17.000 -17.000
  212   1HB   SER  30          2HB       SER  30  -9.272 -17.722 -17.722
  213   2HB   SER  30          1HB       SER  30 -10.191 -19.227 -19.227
  214    HG   SER  30           HG       SER  30  -8.406 -20.018 -20.018
  215    H    LYS  31           H        LYS  31 -10.992 -20.411 -20.411
  216    HA   LYS  31           HA       LYS  31 -11.973 -20.909 -20.909
  217   1HB   LYS  31          2HB       LYS  31  -9.611 -20.316 -20.316
  218   2HB   LYS  31          1HB       LYS  31  -9.078 -21.705 -21.705
  219   1HG   LYS  31          2HG       LYS  31 -10.790 -22.963 -22.963
  220   2HG   LYS  31          1HG       LYS  31 -10.436 -21.594 -21.594
  221   1HD   LYS  31          2HD       LYS  31  -8.271 -23.237 -23.237
  222   2HD   LYS  31          1HD       LYS  31  -8.980 -23.664 -23.664
  223   1HE   LYS  31          2HE       LYS  31  -8.068 -21.852 -21.852
  224   2HE   LYS  31          1HE       LYS  31  -8.001 -20.883 -20.883
  225   1HZ   LYS  31          2HZ       LYS  31  -6.229 -22.531 -22.531
  226   2HZ   LYS  31          1HZ       LYS  31  -6.155 -23.016 -23.016
  227   3HZ   LYS  31          3HZ       LYS  31  -5.796 -21.417 -21.417
  228    H    GLY  32           H        GLY  32  -9.619 -22.592 -22.592
  229   1HA   GLY  32          2HA       GLY  32 -11.572 -24.330 -24.330
  230   2HA   GLY  32          1HA       GLY  32 -10.718 -25.126 -25.126
  231    H    ASP  33           H        ASP  33  -8.613 -25.782 -25.782
  232    HA   ASP  33           HA       ASP  33  -7.766 -26.162 -26.162
  233   1HB   ASP  33          2HB       ASP  33  -6.962 -27.105 -27.105
  234   2HB   ASP  33          1HB       ASP  33  -5.611 -26.886 -26.886
  235    H    ASP  34           H        ASP  34  -6.940 -24.529 -24.529
  236    HA   ASP  34           HA       ASP  34  -5.074 -22.688 -22.688
  237   1HB   ASP  34          2HB       ASP  34  -5.603 -21.110 -21.110
  238   2HB   ASP  34          1HB       ASP  34  -7.002 -21.518 -21.518
  239    H    LEU  35           H        LEU  35  -3.485 -24.468 -24.468
  240    HA   LEU  35           HA       LEU  35  -2.517 -24.621 -24.621
  241   1HB   LEU  35          2HB       LEU  35  -2.169 -26.337 -26.337
  242   2HB   LEU  35          1HB       LEU  35  -0.963 -26.391 -26.391
  243    HG   LEU  35           HG       LEU  35  -2.680 -28.177 -28.177
  244   1HD1  LEU  35          1HD1      LEU  35  -2.159 -26.193 -26.193
  245   2HD1  LEU  35          3HD1      LEU  35  -3.343 -27.463 -27.463
  246   3HD1  LEU  35          2HD1      LEU  35  -1.683 -27.886 -27.886
  247   1HD2  LEU  35          2HD2      LEU  35  -4.554 -26.736 -26.736
  248   2HD2  LEU  35          1HD2      LEU  35  -4.928 -27.683 -27.683
  249   3HD2  LEU  35          3HD2      LEU  35  -4.576 -25.960 -25.960
  250    H    LEU  36           H        LEU  36  -2.135 -22.222 -22.222
  251    HA   LEU  36           HA       LEU  36   0.571 -22.192 -22.192
  252   1HB   LEU  36          2HB       LEU  36  -1.628 -20.217 -20.217
  253   2HB   LEU  36          1HB       LEU  36   0.009 -19.591 -19.591
  254    HG   LEU  36           HG       LEU  36  -1.148 -19.621 -19.621
  255   1HD1  LEU  36          2HD1      LEU  36   1.311 -19.673 -19.673
  256   2HD1  LEU  36          1HD1      LEU  36   1.253 -21.435 -21.435
  257   3HD1  LEU  36          3HD1      LEU  36   0.722 -20.489 -20.489
  258   1HD2  LEU  36          1HD2      LEU  36  -1.089 -22.590 -22.590
  259   2HD2  LEU  36          3HD2      LEU  36  -2.485 -21.572 -21.572
  260   3HD2  LEU  36          2HD2      LEU  36  -1.280 -21.875 -21.875
  261    HA   PRO  37           HA       PRO  37   2.590 -21.349 -21.349
  262   1HB   PRO  37          2HB       PRO  37   4.827 -20.116 -20.116
  263   2HB   PRO  37          1HB       PRO  37   4.540 -21.842 -21.842
  264   1HG   PRO  37          2HG       PRO  37   4.160 -19.555 -19.555
  265   2HG   PRO  37          1HG       PRO  37   4.871 -21.151 -21.151
  266   1HD   PRO  37          2HD       PRO  37   2.314 -20.511 -20.511
  267   2HD   PRO  37          1HD       PRO  37   2.820 -22.156 -22.156
  268    H    ALA  38           H        ALA  38   3.948 -19.388 -19.388
  269    HA   ALA  38           HA       ALA  38   3.836 -17.320 -17.320
  270   1HB   ALA  38          2HB       ALA  38   4.114 -16.900 -16.900
  271   2HB   ALA  38          1HB       ALA  38   2.594 -16.053 -16.053
  272   3HB   ALA  38          3HB       ALA  38   4.040 -15.604 -15.604
  273    H    GLY  39           H        GLY  39   2.312 -15.470 -15.470
  274   1HA   GLY  39          2HA       GLY  39  -0.508 -15.973 -15.973
  275   2HA   GLY  39          1HA       GLY  39   0.074 -16.311 -16.311
  276    H    THR  40           H        THR  40   0.006 -14.690 -14.690
  277    HA   THR  40           HA       THR  40  -0.052 -11.939 -11.939
  278    HB   THR  40           HB       THR  40  -1.408 -11.469 -11.469
  279    HG1  THR  40           HG1      THR  40  -1.803 -14.267 -14.267
  280   1HG2  THR  40          1HG2      THR  40  -2.432 -11.383 -11.383
  281   2HG2  THR  40          3HG2      THR  40  -2.690 -13.128 -13.128
  282   3HG2  THR  40          2HG2      THR  40  -3.525 -12.079 -12.079
  283    H    GLU  41           H        GLU  41   1.749 -14.084 -14.084
  284    HA   GLU  41           HA       GLU  41   3.492 -13.906 -13.906
  285   1HB   GLU  41          2HB       GLU  41   3.547 -11.545 -11.545
  286   2HB   GLU  41          1HB       GLU  41   4.221 -11.206 -11.206
  287   1HG   GLU  41          2HG       GLU  41   5.627 -13.305 -13.305
  288   2HG   GLU  41          1HG       GLU  41   5.136 -13.210 -13.210
  289    H    ASP  42           H        ASP  42   0.665 -13.080 -13.080
  290    HA   ASP  42           HA       ASP  42  -0.412 -12.205 -12.205
  291   1HB   ASP  42          2HB       ASP  42   1.346 -14.050 -14.050
  292   2HB   ASP  42          1HB       ASP  42   1.970 -12.659 -12.659
  293    H    TYR  43           H        TYR  43   0.101 -10.079 -10.079
  294    HA   TYR  43           HA       TYR  43   2.040  -8.307  -8.307
  295   1HB   TYR  43          2HB       TYR  43  -0.564  -7.681  -7.681
  296   2HB   TYR  43          1HB       TYR  43   0.757  -6.546  -6.546
  297    HD1  TYR  43           HD1      TYR  43   2.866  -8.893  -8.893
  298    HD2  TYR  43           HD2      TYR  43  -0.456  -7.270  -7.270
  299    HE1  TYR  43           HE1      TYR  43   3.873  -9.605  -9.605
  300    HE2  TYR  43           HE2      TYR  43   0.544  -7.980  -7.980
  301    HH   TYR  43           HH       TYR  43   3.746  -8.940  -8.940
  302    H    ILE  44           H        ILE  44   1.589  -6.277  -6.277
  303    HA   ILE  44           HA       ILE  44  -0.418  -6.677  -6.677
  304    HB   ILE  44           HB       ILE  44   2.327  -5.453  -5.453
  305   1HG1  ILE  44          2HG1      ILE  44   2.825  -7.056  -7.056
  306   2HG1  ILE  44          1HG1      ILE  44   1.173  -7.142  -7.142
  307   1HG2  ILE  44          2HG2      ILE  44  -0.025  -4.568  -4.568
  308   2HG2  ILE  44          1HG2      ILE  44   1.343  -4.996  -4.996
  309   3HG2  ILE  44          3HG2      ILE  44   1.535  -3.779  -3.779
  310   1HD1  ILE  44          1HD1      ILE  44   2.095  -8.283  -8.283
  311   2HD1  ILE  44          3HD1      ILE  44   1.949  -9.199  -9.199
  312   3HD1  ILE  44          2HD1      ILE  44   0.516  -8.488  -8.488
  313    H    HIS  45           H        HIS  45  -2.141  -5.525  -5.525
  314    HA   HIS  45           HA       HIS  45  -2.075  -3.157  -3.157
  315   1HB   HIS  45          2HB       HIS  45  -4.050  -4.920  -4.920
  316   2HB   HIS  45          1HB       HIS  45  -4.502  -3.258  -3.258
  317    HD1  HIS  45           HD1      HIS  45  -3.354  -5.230  -5.230
  318    HD2  HIS  45           HD2      HIS  45  -5.909  -2.128  -2.128
  319    HE1  HIS  45           HE1      HIS  45  -4.546  -4.590  -4.590
  320    HE2  HIS  45           HE2      HIS  45  -6.021  -2.651  -2.651
  321    H    ILE  46           H        ILE  46  -2.476  -1.057  -1.057
  322    HA   ILE  46           HA       ILE  46  -2.612  -0.239  -0.239
  323    HB   ILE  46           HB       ILE  46  -0.295   0.350   0.350
  324   1HG1  ILE  46          2HG1      ILE  46   0.790   0.242   0.242
  325   2HG1  ILE  46          1HG1      ILE  46  -0.732  -0.499  -0.499
  326   1HG2  ILE  46          3HG2      ILE  46  -1.469   2.186   2.186
  327   2HG2  ILE  46          2HG2      ILE  46   0.253   2.227   2.227
  328   3HG2  ILE  46          1HG2      ILE  46  -0.951   2.557   2.557
  329   1HD1  ILE  46          3HD1      ILE  46   0.169  -1.780  -1.780
  330   2HD1  ILE  46          2HD1      ILE  46   1.520  -1.687  -1.687
  331   3HD1  ILE  46          1HD1      ILE  46   0.004  -2.442  -2.442
  332    H    ARG  47           H        ARG  47  -4.468   0.890   0.890
  333    HA   ARG  47           HA       ARG  47  -4.605   3.040   3.040
  334   1HB   ARG  47          2HB       ARG  47  -5.887   1.001   1.001
  335   2HB   ARG  47          1HB       ARG  47  -6.953   1.253   1.253
  336   1HG   ARG  47          2HG       ARG  47  -7.523   3.480   3.480
  337   2HG   ARG  47          1HG       ARG  47  -6.500   3.166   3.166
  338   1HD   ARG  47          2HD       ARG  47  -8.608   2.606   2.606
  339   2HD   ARG  47          1HD       ARG  47  -7.952   1.045   1.045
  340    HE   ARG  47           HE       ARG  47  -9.584   0.914   0.914
  341   1HH1  ARG  47          2HH1      ARG  47  -9.304   4.238   4.238
  342   2HH1  ARG  47          1HH1      ARG  47 -10.682   4.765   4.765
  343   1HH2  ARG  47          1HH2      ARG  47 -11.397   1.604   1.604
  344   2HH2  ARG  47          2HH2      ARG  47 -11.870   3.270   3.270
  345    H    ILE  48           H        ILE  48  -5.094   4.914   4.914
  346    HA   ILE  48           HA       ILE  48  -5.663   5.306   5.306
  347    HB   ILE  48           HB       ILE  48  -5.787   7.107   7.107
  348   1HG1  ILE  48          2HG1      ILE  48  -4.051   7.180   7.180
  349   2HG1  ILE  48          1HG1      ILE  48  -3.570   6.516   6.516
  350   1HG2  ILE  48          2HG2      ILE  48  -6.548   7.819   7.819
  351   2HG2  ILE  48          1HG2      ILE  48  -6.142   9.008   9.008
  352   3HG2  ILE  48          3HG2      ILE  48  -7.541   7.954   7.954
  353   1HD1  ILE  48          3HD1      ILE  48  -4.230   8.886   8.886
  354   2HD1  ILE  48          2HD1      ILE  48  -3.987   9.345   9.345
  355   3HD1  ILE  48          1HD1      ILE  48  -2.664   8.617   8.617
  356    H    GLN  49           H        GLN  49  -7.588   6.323   6.323
  357    HA   GLN  49           HA       GLN  49 -10.034   6.185   6.185
  358   1HB   GLN  49          2HB       GLN  49 -11.205   4.651   4.651
  359   2HB   GLN  49          1HB       GLN  49  -9.736   3.863   3.863
  360   1HG   GLN  49          2HG       GLN  49  -8.823   4.865   4.865
  361   2HG   GLN  49          1HG       GLN  49 -10.527   4.723   4.723
  362   1HE2  GLN  49          2HE2      GLN  49  -9.765   1.485   1.485
  363   2HE2  GLN  49          1HE2      GLN  49 -10.205   3.091   3.091
  364    H    GLN  50           H        GLN  50  -9.715   8.466   8.466
  365    HA   GLN  50           HA       GLN  50  -9.886   9.443   9.443
  366   1HB   GLN  50          2HB       GLN  50  -9.147  10.509  10.509
  367   2HB   GLN  50          1HB       GLN  50 -10.622  11.372  11.372
  368   1HG   GLN  50          2HG       GLN  50  -9.685  12.286  12.286
  369   2HG   GLN  50          1HG       GLN  50  -8.388  11.095  11.095
  370   1HE2  GLN  50          2HE2      GLN  50  -6.549  13.888  13.888
  371   2HE2  GLN  50          1HE2      GLN  50  -7.094  13.063  13.063
  372    H    ARG  51           H        ARG  51 -11.727   8.818   8.818
  373    HA   ARG  51           HA       ARG  51 -14.275   8.600   8.600
  374   1HB   ARG  51          2HB       ARG  51 -13.262   9.032   9.032
  375   2HB   ARG  51          1HB       ARG  51 -14.991   9.080   9.080
  376   1HG   ARG  51          2HG       ARG  51 -15.101   6.847   6.847
  377   2HG   ARG  51          1HG       ARG  51 -13.405   6.763   6.763
  378   1HD   ARG  51          2HD       ARG  51 -13.976   5.617   5.617
  379   2HD   ARG  51          1HD       ARG  51 -12.674   6.803   6.803
  380    HE   ARG  51           HE       ARG  51 -15.189   7.973   7.973
  381   1HH1  ARG  51          2HH1      ARG  51 -12.659   5.962   5.962
  382   2HH1  ARG  51          1HH1      ARG  51 -12.988   6.407   6.407
  383   1HH2  ARG  51          1HH2      ARG  51 -15.623   8.559   8.559
  384   2HH2  ARG  51          2HH2      ARG  51 -14.670   7.881   7.881
  385    H    ASN  52           H        ASN  52 -12.641  11.364  11.364
  386    HA   ASN  52           HA       ASN  52 -14.806  13.090  13.090
  387   1HB   ASN  52          2HB       ASN  52 -14.314  12.742  12.742
  388   2HB   ASN  52          1HB       ASN  52 -13.200  14.062  14.062
  389   1HD2  ASN  52          2HD2      ASN  52 -15.947  16.076  16.076
  390   2HD2  ASN  52          1HD2      ASN  52 -14.464  15.390  15.390
  391    H    GLY  53           H        GLY  53 -13.271  15.486  15.486
  392   1HA   GLY  53          2HA       GLY  53 -11.515  15.569  15.569
  393   2HA   GLY  53          1HA       GLY  53 -12.036  16.944  16.944
  394    H    ARG  54           H        ARG  54 -10.549  13.958  13.958
  395    HA   ARG  54           HA       ARG  54  -7.915  14.677  14.677
  396   1HB   ARG  54          2HB       ARG  54  -7.805  15.413  15.413
  397   2HB   ARG  54          1HB       ARG  54  -8.256  16.610  16.610
  398   1HG   ARG  54          2HG       ARG  54 -10.454  16.673  16.673
  399   2HG   ARG  54          1HG       ARG  54 -10.379  15.069  15.069
  400   1HD   ARG  54          2HD       ARG  54 -10.476  16.752  16.752
  401   2HD   ARG  54          1HD       ARG  54  -8.896  15.968  15.968
  402    HE   ARG  54           HE       ARG  54  -8.545  18.168  18.168
  403   1HH1  ARG  54          2HH1      ARG  54  -9.695  17.639  17.639
  404   2HH1  ARG  54          1HH1      ARG  54  -9.138  19.172  19.172
  405   1HH2  ARG  54          1HH2      ARG  54  -7.813  20.185  20.185
  406   2HH2  ARG  54          2HH2      ARG  54  -8.070  20.618  20.618
  407    H    LYS  55           H        LYS  55 -10.614  13.084  13.084
  408    HA   LYS  55           HA       LYS  55  -9.133  11.365  11.365
  409   1HB   LYS  55          2HB       LYS  55 -11.866  10.944  10.944
  410   2HB   LYS  55          1HB       LYS  55 -11.197  10.042  10.042
  411   1HG   LYS  55          2HG       LYS  55 -11.792  12.994  12.994
  412   2HG   LYS  55          1HG       LYS  55 -12.778  11.743  11.743
  413   1HD   LYS  55          2HD       LYS  55 -11.585  12.154  12.154
  414   2HD   LYS  55          1HD       LYS  55 -10.283  11.270  11.270
  415   1HE   LYS  55          2HE       LYS  55  -9.892  13.688  13.688
  416   2HE   LYS  55          1HE       LYS  55 -10.617  14.176  14.176
  417   1HZ   LYS  55          2HZ       LYS  55  -8.449  12.199  12.199
  418   2HZ   LYS  55          1HZ       LYS  55  -8.055  13.827  13.827
  419   3HZ   LYS  55          3HZ       LYS  55  -8.871  13.354  13.354
  420    H    THR  56           H        THR  56  -7.485  11.057  11.057
  421    HA   THR  56           HA       THR  56  -8.138   9.119   9.119
  422    HB   THR  56           HB       THR  56  -5.307   9.545   9.545
  423    HG1  THR  56           HG1      THR  56  -5.252  11.723  11.723
  424   1HG2  THR  56          2HG2      THR  56  -7.135   9.498   9.498
  425   2HG2  THR  56          1HG2      THR  56  -5.976  10.824  10.824
  426   3HG2  THR  56          3HG2      THR  56  -5.403   9.164   9.164
  427    H    LEU  57           H        LEU  57  -7.878   6.962   6.962
  428    HA   LEU  57           HA       LEU  57  -6.361   5.845   5.845
  429   1HB   LEU  57          2HB       LEU  57  -9.163   5.333   5.333
  430   2HB   LEU  57          1HB       LEU  57  -8.225   3.946   3.946
  431    HG   LEU  57           HG       LEU  57  -8.518   6.437   6.437
  432   1HD1  LEU  57          1HD1      LEU  57 -10.650   4.970   4.970
  433   2HD1  LEU  57          3HD1      LEU  57 -10.034   3.991   3.991
  434   3HD1  LEU  57          2HD1      LEU  57 -10.434   5.689   5.689
  435   1HD2  LEU  57          2HD2      LEU  57  -7.369   3.712   3.712
  436   2HD2  LEU  57          1HD2      LEU  57  -6.718   5.286   5.286
  437   3HD2  LEU  57          3HD2      LEU  57  -8.047   4.577   4.577
  438    H    THR  58           H        THR  58  -4.674   5.697   5.697
  439    HA   THR  58           HA       THR  58  -4.925   4.150   4.150
  440    HB   THR  58           HB       THR  58  -2.477   4.567   4.567
  441    HG1  THR  58           HG1      THR  58  -3.549   6.477   6.477
  442   1HG2  THR  58          3HG2      THR  58  -2.618   2.811   2.811
  443   2HG2  THR  58          2HG2      THR  58  -2.168   4.288   4.288
  444   3HG2  THR  58          1HG2      THR  58  -1.161   3.689   3.689
  445    H    THR  59           H        THR  59  -5.535   2.089   2.089
  446    HA   THR  59           HA       THR  59  -4.926   0.273   0.273
  447    HB   THR  59           HB       THR  59  -6.422  -1.192  -1.192
  448    HG1  THR  59           HG1      THR  59  -7.933   0.110   0.110
  449   1HG2  THR  59          1HG2      THR  59  -7.166   0.466   0.466
  450   2HG2  THR  59          3HG2      THR  59  -8.416  -0.345  -0.345
  451   3HG2  THR  59          2HG2      THR  59  -7.136  -1.288  -1.288
  452    H    VAL  60           H        VAL  60  -4.479  -2.054  -2.054
  453    HA   VAL  60           HA       VAL  60  -2.720  -2.178  -2.178
  454    HB   VAL  60           HB       VAL  60  -1.954  -3.049  -3.049
  455   1HG1  VAL  60          1HG1      VAL  60  -0.942  -3.885  -3.885
  456   2HG1  VAL  60          3HG1      VAL  60   0.269  -3.509  -3.509
  457   3HG1  VAL  60          2HG1      VAL  60  -0.944  -4.749  -4.749
  458   1HG2  VAL  60          2HG2      VAL  60  -1.281  -0.781  -0.781
  459   2HG2  VAL  60          1HG2      VAL  60  -1.254  -0.910  -0.910
  460   3HG2  VAL  60          3HG2      VAL  60   0.087  -1.548  -1.548
  461    H    GLN  61           H        GLN  61  -3.512  -3.722  -3.722
  462    HA   GLN  61           HA       GLN  61  -4.838  -6.038  -6.038
  463   1HB   GLN  61          2HB       GLN  61  -5.274  -4.474  -4.474
  464   2HB   GLN  61          1HB       GLN  61  -5.141  -6.184  -6.184
  465   1HG   GLN  61          2HG       GLN  61  -7.269  -6.389  -6.389
  466   2HG   GLN  61          1HG       GLN  61  -6.800  -6.077  -6.077
  467   1HE2  GLN  61          2HE2      GLN  61  -7.475  -2.461  -2.461
  468   2HE2  GLN  61          1HE2      GLN  61  -6.052  -3.394  -3.394
  469    H    GLY  62           H        GLY  62  -2.673  -6.854  -6.854
  470   1HA   GLY  62          2HA       GLY  62  -1.837  -8.882  -8.882
  471   2HA   GLY  62          1HA       GLY  62  -0.691  -7.552  -7.552
  472    H    ILE  63           H        ILE  63  -0.375  -6.726  -6.726
  473    HA   ILE  63           HA       ILE  63   1.298  -8.599  -8.599
  474    HB   ILE  63           HB       ILE  63   0.040  -6.070  -6.070
  475   1HG1  ILE  63          2HG1      ILE  63   2.139  -5.173  -5.173
  476   2HG1  ILE  63          1HG1      ILE  63   2.946  -6.664  -6.664
  477   1HG2  ILE  63          1HG2      ILE  63   1.294  -8.124  -8.124
  478   2HG2  ILE  63          3HG2      ILE  63   1.538  -6.415  -6.415
  479   3HG2  ILE  63          2HG2      ILE  63  -0.094  -7.082  -7.082
  480   1HD1  ILE  63          2HD1      ILE  63   1.561  -6.324  -6.324
  481   2HD1  ILE  63          1HD1      ILE  63   3.253  -5.901  -5.901
  482   3HD1  ILE  63          3HD1      ILE  63   2.716  -7.567  -7.567
  483    H    ALA  64           H        ALA  64   1.122  -9.894  -9.894
  484    HA   ALA  64           HA       ALA  64  -1.600 -10.863 -10.863
  485   1HB   ALA  64          3HB       ALA  64   1.105 -12.141 -12.141
  486   2HB   ALA  64          2HB       ALA  64  -0.324 -12.844 -12.844
  487   3HB   ALA  64          1HB       ALA  64  -0.270 -12.633 -12.633
  488    H    ASP  65           H        ASP  65  -2.078 -11.628 -11.628
  489    HA   ASP  65           HA       ASP  65  -1.505  -9.584  -9.584
  490   1HB   ASP  65          2HB       ASP  65  -3.687 -10.756 -10.756
  491   2HB   ASP  65          1HB       ASP  65  -2.895 -12.241 -12.241
  492    H    ASP  66           H        ASP  66   0.145 -12.376 -12.376
  493    HA   ASP  66           HA       ASP  66   1.360 -12.792 -12.792
  494   1HB   ASP  66          2HB       ASP  66   0.672 -14.560 -14.560
  495   2HB   ASP  66          1HB       ASP  66   2.393 -14.347 -14.347
  496    H    TYR  67           H        TYR  67   1.812 -10.348 -10.348
  497    HA   TYR  67           HA       TYR  67   4.626 -10.591 -10.591
  498   1HB   TYR  67          2HB       TYR  67   2.491  -8.535  -8.535
  499   2HB   TYR  67          1HB       TYR  67   4.183  -8.071  -8.071
  500    HD1  TYR  67           HD2      TYR  67   3.234 -11.459 -11.459
  501    HD2  TYR  67           HD1      TYR  67   3.797  -7.478  -7.478
  502    HE1  TYR  67           HE2      TYR  67   3.273 -12.275 -12.275
  503    HE2  TYR  67           HE1      TYR  67   3.836  -8.276  -8.276
  504    HH   TYR  67           HH       TYR  67   2.865 -10.369 -10.369
  505    H    ASP  68           H        ASP  68   3.982 -10.874 -10.874
  506    HA   ASP  68           HA       ASP  68   5.002 -10.284 -10.284
  507   1HB   ASP  68          2HB       ASP  68   6.640  -9.063  -9.063
  508   2HB   ASP  68          1HB       ASP  68   5.885  -7.623  -7.623
  509    H    LYS  69           H        LYS  69   2.745  -8.366  -8.366
  510    HA   LYS  69           HA       LYS  69   0.994  -7.093  -7.093
  511   1HB   LYS  69          2HB       LYS  69   0.650  -8.919  -8.919
  512   2HB   LYS  69          1HB       LYS  69   1.684  -8.070  -8.070
  513   1HG   LYS  69          2HG       LYS  69  -0.198  -6.176  -6.176
  514   2HG   LYS  69          1HG       LYS  69  -1.119  -7.679  -7.679
  515   1HD   LYS  69          2HD       LYS  69  -0.023  -8.057  -8.057
  516   2HD   LYS  69          1HD       LYS  69   0.566  -6.396  -6.396
  517   1HE   LYS  69          2HE       LYS  69  -2.092  -6.111  -6.111
  518   2HE   LYS  69          1HE       LYS  69  -2.111  -7.412  -7.412
  519   1HZ   LYS  69          3HZ       LYS  69  -0.362  -5.466  -5.466
  520   2HZ   LYS  69          2HZ       LYS  69  -1.750  -4.652  -4.652
  521   3HZ   LYS  69          1HZ       LYS  69  -1.876  -5.887  -5.887
  522    H    LYS  70           H        LYS  70   3.074  -6.732  -6.732
  523    HA   LYS  70           HA       LYS  70   2.726  -3.958  -3.958
  524   1HB   LYS  70          2HB       LYS  70   5.063  -5.576  -5.576
  525   2HB   LYS  70          1HB       LYS  70   4.555  -3.995  -3.995
  526   1HG   LYS  70          2HG       LYS  70   2.949  -4.846  -4.846
  527   2HG   LYS  70          1HG       LYS  70   2.463  -6.041  -6.041
  528   1HD   LYS  70          2HD       LYS  70   5.098  -6.496  -6.496
  529   2HD   LYS  70          1HD       LYS  70   3.722  -6.637  -6.637
  530   1HE   LYS  70          2HE       LYS  70   3.120  -7.964  -7.964
  531   2HE   LYS  70          1HE       LYS  70   4.671  -8.536  -8.536
  532   1HZ   LYS  70          2HZ       LYS  70   3.532  -8.897  -8.897
  533   2HZ   LYS  70          1HZ       LYS  70   2.060  -8.570  -8.570
  534   3HZ   LYS  70          3HZ       LYS  70   2.989  -9.901  -9.901
  535    H    LYS  71           H        LYS  71   5.776  -5.610  -5.610
  536    HA   LYS  71           HA       LYS  71   7.155  -3.449  -3.449
  537   1HB   LYS  71          2HB       LYS  71   7.549  -6.204  -6.204
  538   2HB   LYS  71          1HB       LYS  71   7.660  -5.814  -5.814
  539   1HG   LYS  71          2HG       LYS  71   9.462  -4.342  -4.342
  540   2HG   LYS  71          1HG       LYS  71   9.201  -4.308  -4.308
  541   1HD   LYS  71          2HD       LYS  71   9.729  -6.953  -6.953
  542   2HD   LYS  71          1HD       LYS  71  11.080  -5.819  -5.819
  543   1HE   LYS  71          2HE       LYS  71  10.865  -5.588  -5.588
  544   2HE   LYS  71          1HE       LYS  71   9.401  -6.570  -6.570
  545   1HZ   LYS  71          1HZ       LYS  71  11.794  -7.785  -7.785
  546   2HZ   LYS  71          3HZ       LYS  71  11.784  -7.560  -7.560
  547   3HZ   LYS  71          2HZ       LYS  71  10.571  -8.477  -8.477
  548    H    LEU  72           H        LEU  72   4.519  -5.132  -5.132
  549    HA   LEU  72           HA       LEU  72   4.987  -4.350  -4.350
  550   1HB   LEU  72          2HB       LEU  72   3.418  -6.173  -6.173
  551   2HB   LEU  72          1HB       LEU  72   2.257  -4.873  -4.873
  552    HG   LEU  72           HG       LEU  72   3.394  -6.103  -6.103
  553   1HD1  LEU  72          1HD1      LEU  72   1.007  -6.365  -6.365
  554   2HD1  LEU  72          3HD1      LEU  72   0.604  -5.376  -5.376
  555   3HD1  LEU  72          2HD1      LEU  72   1.357  -6.955  -6.955
  556   1HD2  LEU  72          2HD2      LEU  72   3.681  -3.670  -3.670
  557   2HD2  LEU  72          1HD2      LEU  72   2.448  -4.300  -4.300
  558   3HD2  LEU  72          3HD2      LEU  72   1.971  -3.444  -3.444
  559    H    VAL  73           H        VAL  73   2.185  -3.265  -3.265
  560    HA   VAL  73           HA       VAL  73   2.203  -0.760  -0.760
  561    HB   VAL  73           HB       VAL  73   0.117  -2.121  -2.121
  562   1HG1  VAL  73          2HG1      VAL  73   0.647  -2.481  -2.481
  563   2HG1  VAL  73          1HG1      VAL  73   0.392  -0.759  -0.759
  564   3HG1  VAL  73          3HG1      VAL  73  -0.947  -1.771  -1.771
  565   1HG2  VAL  73          1HG2      VAL  73   0.365   0.385   0.385
  566   2HG2  VAL  73          3HG2      VAL  73  -1.201  -0.249  -0.249
  567   3HG2  VAL  73          2HG2      VAL  73  -0.221   0.689   0.689
  568    H    LYS  74           H        LYS  74   2.649  -1.844  -1.844
  569    HA   LYS  74           HA       LYS  74   2.693   0.589   0.589
  570   1HB   LYS  74          2HB       LYS  74   2.996  -1.857  -1.857
  571   2HB   LYS  74          1HB       LYS  74   4.710  -1.509  -1.509
  572   1HG   LYS  74          2HG       LYS  74   3.296   0.607   0.607
  573   2HG   LYS  74          1HG       LYS  74   3.147  -0.956  -0.956
  574   1HD   LYS  74          2HD       LYS  74   5.367  -1.070  -1.070
  575   2HD   LYS  74          1HD       LYS  74   5.841  -0.187  -0.187
  576   1HE   LYS  74          2HE       LYS  74   5.628   1.845   1.845
  577   2HE   LYS  74          1HE       LYS  74   4.320   1.310   1.310
  578   1HZ   LYS  74          1HZ       LYS  74   6.099  -0.027  -0.027
  579   2HZ   LYS  74          3HZ       LYS  74   7.230   0.910   0.910
  580   3HZ   LYS  74          2HZ       LYS  74   6.136   1.650   1.650
  581    H    ALA  75           H        ALA  75   5.313  -1.005  -1.005
  582    HA   ALA  75           HA       ALA  75   7.332   0.854   0.854
  583   1HB   ALA  75          3HB       ALA  75   7.467  -1.505  -1.505
  584   2HB   ALA  75          2HB       ALA  75   7.350  -0.582  -0.582
  585   3HB   ALA  75          1HB       ALA  75   8.672  -0.274  -0.274
  586    H    PHE  76           H        PHE  76   4.800   0.844   0.844
  587    HA   PHE  76           HA       PHE  76   5.725   2.740   2.740
  588   1HB   PHE  76          2HB       PHE  76   3.491   1.344   1.344
  589   2HB   PHE  76          1HB       PHE  76   2.859   2.793   2.793
  590    HD1  PHE  76           HD2      PHE  76   4.533   1.558   1.558
  591    HD2  PHE  76           HD1      PHE  76   2.233   4.659   4.659
  592    HE1  PHE  76           HE2      PHE  76   4.210   2.582   2.582
  593    HE2  PHE  76           HE1      PHE  76   1.901   5.690   5.690
  594    HZ   PHE  76           HZ       PHE  76   2.889   4.651   4.651
  595    H    LYS  77           H        LYS  77   3.970   3.215   3.215
  596    HA   LYS  77           HA       LYS  77   3.861   6.034   6.034
  597   1HB   LYS  77          2HB       LYS  77   3.846   4.339   4.339
  598   2HB   LYS  77          1HB       LYS  77   3.170   5.951   5.951
  599   1HG   LYS  77          2HG       LYS  77   1.244   5.151   5.151
  600   2HG   LYS  77          1HG       LYS  77   2.057   4.075   4.075
  601   1HD   LYS  77          2HD       LYS  77   1.830   2.301   2.301
  602   2HD   LYS  77          1HD       LYS  77   2.311   3.218   3.218
  603   1HE   LYS  77          2HE       LYS  77   0.038   4.198   4.198
  604   2HE   LYS  77          1HE       LYS  77  -0.421   3.168   3.168
  605   1HZ   LYS  77          3HZ       LYS  77   0.521   1.332   1.332
  606   2HZ   LYS  77          2HZ       LYS  77   0.046   2.466   2.466
  607   3HZ   LYS  77          1HZ       LYS  77  -1.088   1.852   1.852
  608    H    LYS  78           H        LYS  78   6.437   3.904   3.904
  609    HA   LYS  78           HA       LYS  78   7.938   5.905   5.905
  610   1HB   LYS  78          2HB       LYS  78   7.819   3.327   3.327
  611   2HB   LYS  78          1HB       LYS  78   9.050   3.234   3.234
  612   1HG   LYS  78          2HG       LYS  78  10.578   4.498   4.498
  613   2HG   LYS  78          1HG       LYS  78   9.327   5.063   5.063
  614   1HD   LYS  78          2HD       LYS  78   9.064   2.473   2.473
  615   2HD   LYS  78          1HD       LYS  78  10.735   2.445   2.445
  616   1HE   LYS  78          2HE       LYS  78   9.873   4.413   4.413
  617   2HE   LYS  78          1HE       LYS  78  10.247   2.749   2.749
  618   1HZ   LYS  78          2HZ       LYS  78  12.189   4.158   4.158
  619   2HZ   LYS  78          1HZ       LYS  78  12.075   4.633   4.633
  620   3HZ   LYS  78          3HZ       LYS  78  12.440   3.027   3.027
  621    H    LYS  79           H        LYS  79   7.630   4.630   4.630
  622    HA   LYS  79           HA       LYS  79  10.243   5.648   5.648
  623   1HB   LYS  79          2HB       LYS  79   9.207   3.387   3.387
  624   2HB   LYS  79          1HB       LYS  79   8.257   4.366   4.366
  625   1HG   LYS  79          2HG       LYS  79  10.834   5.275   5.275
  626   2HG   LYS  79          1HG       LYS  79  11.030   3.536   3.536
  627   1HD   LYS  79          2HD       LYS  79   9.445   3.083   3.083
  628   2HD   LYS  79          1HD       LYS  79   9.092   4.804   4.804
  629   1HE   LYS  79          2HE       LYS  79  11.915   3.924   3.924
  630   2HE   LYS  79          1HE       LYS  79  10.800   3.552   3.552
  631   1HZ   LYS  79          2HZ       LYS  79  11.092   6.279   6.279
  632   2HZ   LYS  79          1HZ       LYS  79  12.031   5.720   5.720
  633   3HZ   LYS  79          3HZ       LYS  79  10.350   5.822   5.822
  634    H    PHE  80           H        PHE  80   6.811   6.059   6.059
  635    HA   PHE  80           HA       PHE  80   7.533   8.524   8.524
  636   1HB   PHE  80          2HB       PHE  80   4.826   7.215   7.215
  637   2HB   PHE  80          1HB       PHE  80   5.526   8.334   8.334
  638    HD1  PHE  80           HD2      PHE  80   5.708   4.884   4.884
  639    HD2  PHE  80           HD1      PHE  80   6.797   7.558   7.558
  640    HE1  PHE  80           HE2      PHE  80   6.461   2.980   2.980
  641    HE2  PHE  80           HE1      PHE  80   7.552   5.657   5.657
  642    HZ   PHE  80           HZ       PHE  80   7.383   3.365   3.365
  643    H    ALA  81           H        ALA  81   5.971   7.395   7.395
  644    HA   ALA  81           HA       ALA  81   5.170   8.563   8.563
  645   1HB   ALA  81          2HB       ALA  81   6.805  10.377  10.377
  646   2HB   ALA  81          1HB       ALA  81   5.318  11.172  11.172
  647   3HB   ALA  81          3HB       ALA  81   5.583  10.815  10.815
  648    H    CYS  82           H        CYS  82   3.561   7.466   7.466
  649    HA   CYS  82           HA       CYS  82   1.215   9.245   9.245
  650   1HB   CYS  82          2HB       CYS  82   2.154   7.342   7.342
  651   2HB   CYS  82          1HB       CYS  82   0.455   7.790   7.790
  652    HG   CYS  82           HG       CYS  82   1.267   9.564   9.564
  653    H    ASN  83           H        ASN  83  -0.895   8.036   8.036
  654    HA   ASN  83           HA       ASN  83  -0.814   5.965   5.965
  655   1HB   ASN  83          2HB       ASN  83  -2.932   7.693   7.693
  656   2HB   ASN  83          1HB       ASN  83  -3.422   6.183   6.183
  657   1HD2  ASN  83          2HD2      ASN  83  -2.056   7.271   7.271
  658   2HD2  ASN  83          1HD2      ASN  83  -1.854   5.942   5.942
  659    H    GLY  84           H        GLY  84  -1.468   3.854   3.854
  660   1HA   GLY  84          2HA       GLY  84  -2.474   2.978   2.978
  661   2HA   GLY  84          1HA       GLY  84  -0.899   2.359   2.359
  662    H    THR  85           H        THR  85  -3.341   0.886   0.886
  663    HA   THR  85           HA       THR  85  -3.401  -0.606  -0.606
  664    HB   THR  85           HB       THR  85  -5.802  -0.679  -0.679
  665    HG1  THR  85           HG1      THR  85  -5.796   0.932   0.932
  666   1HG2  THR  85          2HG2      THR  85  -4.546   1.406   1.406
  667   2HG2  THR  85          1HG2      THR  85  -5.327   2.225   2.225
  668   3HG2  THR  85          3HG2      THR  85  -6.307   1.444   1.444
  669    H    VAL  86           H        VAL  86  -4.456  -2.741  -2.741
  670    HA   VAL  86           HA       VAL  86  -4.162  -3.728  -3.728
  671    HB   VAL  86           HB       VAL  86  -2.440  -4.603  -4.603
  672   1HG1  VAL  86          3HG1      VAL  86  -4.661  -4.877  -4.877
  673   2HG1  VAL  86          2HG1      VAL  86  -3.822  -6.417  -6.417
  674   3HG1  VAL  86          1HG1      VAL  86  -2.932  -4.983  -4.983
  675   1HG2  VAL  86          3HG2      VAL  86  -3.494  -5.979  -5.979
  676   2HG2  VAL  86          2HG2      VAL  86  -2.615  -6.871  -6.871
  677   3HG2  VAL  86          1HG2      VAL  86  -4.377  -6.827  -6.827
  678    H    ILE  87           H        ILE  87  -6.505  -2.993  -2.993
  679    HA   ILE  87           HA       ILE  87  -8.428  -4.580  -4.580
  680    HB   ILE  87           HB       ILE  87 -10.111  -3.431  -3.431
  681   1HG1  ILE  87          2HG1      ILE  87  -8.519  -1.417  -1.417
  682   2HG1  ILE  87          1HG1      ILE  87  -7.840  -2.970  -2.970
  683   1HG2  ILE  87          1HG2      ILE  87  -9.328  -2.409  -2.409
  684   2HG2  ILE  87          3HG2      ILE  87  -8.037  -1.594  -1.594
  685   3HG2  ILE  87          2HG2      ILE  87  -9.720  -1.182  -1.182
  686   1HD1  ILE  87          1HD1      ILE  87 -10.154  -3.648  -3.648
  687   2HD1  ILE  87          3HD1      ILE  87 -10.638  -1.972  -1.972
  688   3HD1  ILE  87          2HD1      ILE  87  -9.420  -2.362  -2.362
  689    H    GLU  88           H        GLU  88 -10.045  -5.919  -5.919
  690    HA   GLU  88           HA       GLU  88  -8.986  -7.365  -7.365
  691   1HB   GLU  88          2HB       GLU  88  -9.357  -8.508  -8.508
  692   2HB   GLU  88          1HB       GLU  88 -11.055  -8.492  -8.492
  693   1HG   GLU  88          2HG       GLU  88 -10.270  -9.619  -9.619
  694   2HG   GLU  88          1HG       GLU  88  -8.775  -9.935  -9.935
  695    H    HIS  89           H        HIS  89 -10.035  -5.512  -5.512
  696    HA   HIS  89           HA       HIS  89 -12.716  -4.956  -4.956
  697   1HB   HIS  89          2HB       HIS  89 -10.609  -4.087  -4.087
  698   2HB   HIS  89          1HB       HIS  89 -11.303  -5.152  -5.152
  699    HD1  HIS  89           HD1      HIS  89 -13.172  -4.220  -4.220
  700    HD2  HIS  89           HD2      HIS  89 -12.488  -2.025  -2.025
  701    HE1  HIS  89           HE1      HIS  89 -14.680  -2.215  -2.215
  702    HE2  HIS  89           HE2      HIS  89 -14.170  -0.847  -0.847
  703    HA   PRO  90           HA       PRO  90 -14.466  -8.815  -8.815
  704   1HB   PRO  90          2HB       PRO  90 -17.021  -7.989  -7.989
  705   2HB   PRO  90          1HB       PRO  90 -16.281  -8.257  -8.257
  706   1HG   PRO  90          2HG       PRO  90 -16.710  -5.691  -5.691
  707   2HG   PRO  90          1HG       PRO  90 -16.965  -6.047  -6.047
  708   1HD   PRO  90          2HD       PRO  90 -14.753  -4.772  -4.772
  709   2HD   PRO  90          1HD       PRO  90 -14.740  -5.789  -5.789
  710    H    GLU  91           H        GLU  91 -14.431  -5.839  -5.839
  711    HA   GLU  91           HA       GLU  91 -15.616  -6.927  -6.927
  712   1HB   GLU  91          2HB       GLU  91 -15.057  -4.329  -4.329
  713   2HB   GLU  91          1HB       GLU  91 -14.284  -4.478  -4.478
  714   1HG   GLU  91          2HG       GLU  91 -16.554  -3.541  -3.541
  715   2HG   GLU  91          1HG       GLU  91 -16.375  -5.036  -5.036
  716    H    TYR  92           H        TYR  92 -12.455  -6.474  -6.474
  717    HA   TYR  92           HA       TYR  92 -11.244  -7.342  -7.342
  718   1HB   TYR  92          2HB       TYR  92  -9.653  -6.098  -6.098
  719   2HB   TYR  92          1HB       TYR  92  -9.310  -6.137  -6.137
  720    HD1  TYR  92           HD2      TYR  92 -12.081  -5.202  -5.202
  721    HD2  TYR  92           HD1      TYR  92  -9.411  -3.758  -3.758
  722    HE1  TYR  92           HE2      TYR  92 -13.042  -2.953  -2.953
  723    HE2  TYR  92           HE1      TYR  92 -10.363  -1.503  -1.503
  724    HH   TYR  92           HH       TYR  92 -11.589  -0.197  -0.197
  725    H    GLY  93           H        GLY  93 -10.839  -7.615  -7.615
  726   1HA   GLY  93          2HA       GLY  93 -10.764  -9.761  -9.761
  727   2HA   GLY  93          1HA       GLY  93 -10.104 -10.436 -10.436
  728    H    GLU  94           H        GLU  94  -9.415  -8.804  -8.804
  729    HA   GLU  94           HA       GLU  94  -7.487  -8.399  -8.399
  730   1HB   GLU  94          2HB       GLU  94  -7.269 -10.903 -10.903
  731   2HB   GLU  94          1HB       GLU  94  -6.001 -10.270 -10.270
  732   1HG   GLU  94          2HG       GLU  94  -4.696  -9.583  -9.583
  733   2HG   GLU  94          1HG       GLU  94  -6.043  -9.723  -9.723
  734    H    VAL  95           H        VAL  95  -7.159  -6.278  -6.278
  735    HA   VAL  95           HA       VAL  95  -4.942  -5.872  -5.872
  736    HB   VAL  95           HB       VAL  95  -6.048  -3.914  -3.914
  737   1HG1  VAL  95          3HG1      VAL  95  -6.114  -6.162  -6.162
  738   2HG1  VAL  95          2HG1      VAL  95  -7.696  -6.418  -6.418
  739   3HG1  VAL  95          1HG1      VAL  95  -7.471  -5.129  -5.129
  740   1HG2  VAL  95          1HG2      VAL  95  -7.654  -3.672  -3.672
  741   2HG2  VAL  95          3HG2      VAL  95  -8.274  -3.330  -3.330
  742   3HG2  VAL  95          2HG2      VAL  95  -8.645  -4.868  -4.868
  743    H    ILE  96           H        ILE  96  -3.582  -4.199  -4.199
  744    HA   ILE  96           HA       ILE  96  -3.880  -3.186  -3.186
  745    HB   ILE  96           HB       ILE  96  -1.711  -3.148  -3.148
  746   1HG1  ILE  96          2HG1      ILE  96  -2.100  -4.802  -4.802
  747   2HG1  ILE  96          1HG1      ILE  96  -0.469  -4.207  -4.207
  748   1HG2  ILE  96          1HG2      ILE  96  -2.106  -1.024  -1.024
  749   2HG2  ILE  96          3HG2      ILE  96  -0.471  -1.589  -1.589
  750   3HG2  ILE  96          2HG2      ILE  96  -1.461  -0.903  -0.903
  751   1HD1  ILE  96          1HD1      ILE  96  -2.343  -3.026  -3.026
  752   2HD1  ILE  96          3HD1      ILE  96  -1.148  -4.272  -4.272
  753   3HD1  ILE  96          2HD1      ILE  96  -0.625  -2.686  -2.686
  754    H    GLN  97           H        GLN  97  -4.699  -1.285  -1.285
  755    HA   GLN  97           HA       GLN  97  -5.403   0.598   0.598
  756   1HB   GLN  97          2HB       GLN  97  -6.816  -0.418  -0.418
  757   2HB   GLN  97          1HB       GLN  97  -6.661   1.324   1.324
  758   1HG   GLN  97          2HG       GLN  97  -7.602   1.572   1.572
  759   2HG   GLN  97          1HG       GLN  97  -7.870  -0.171  -0.171
  760   1HE2  GLN  97          2HE2      GLN  97 -10.030   1.993   1.993
  761   2HE2  GLN  97          1HE2      GLN  97  -8.369   2.364   2.364
  762    H    LEU  98           H        LEU  98  -3.939   2.152   2.152
  763    HA   LEU  98           HA       LEU  98  -2.573   3.225   3.225
  764   1HB   LEU  98          2HB       LEU  98  -2.063   3.543   3.543
  765   2HB   LEU  98          1HB       LEU  98  -1.192   4.438   4.438
  766    HG   LEU  98           HG       LEU  98  -1.230   1.453   1.453
  767   1HD1  LEU  98          3HD1      LEU  98  -0.447   2.727   2.727
  768   2HD1  LEU  98          2HD1      LEU  98   1.061   2.544   2.544
  769   3HD1  LEU  98          1HD1      LEU  98   0.073   1.129   1.129
  770   1HD2  LEU  98          2HD2      LEU  98   0.287   3.697   3.697
  771   2HD2  LEU  98          1HD2      LEU  98  -0.054   2.100   2.100
  772   3HD2  LEU  98          3HD2      LEU  98   1.257   2.310   2.310
  773    H    GLN  99           H        GLN  99  -2.405   5.542   5.542
  774    HA   GLN  99           HA       GLN  99  -4.870   6.883   6.883
  775   1HB   GLN  99          2HB       GLN  99  -3.255   6.917   6.917
  776   2HB   GLN  99          1HB       GLN  99  -3.625   8.536   8.536
  777   1HG   GLN  99          2HG       GLN  99  -5.797   6.504   6.504
  778   2HG   GLN  99          1HG       GLN  99  -5.223   7.348   7.348
  779   1HE2  GLN  99          2HE2      GLN  99  -7.865   9.082   9.082
  780   2HE2  GLN  99          1HE2      GLN  99  -7.449   7.405   7.405
  781    H    GLY 100           H        GLY 100  -4.817   8.414   8.414
  782   1HA   GLY 100          2HA       GLY 100  -3.977  10.414  10.414
  783   2HA   GLY 100          1HA       GLY 100  -2.385  10.018  10.018
  784    H    ASP 101           H        ASP 101  -2.595  10.845  10.845
  785    HA   ASP 101           HA       ASP 101  -2.926   8.739   8.739
  786   1HB   ASP 101          2HB       ASP 101  -1.718  10.282  10.282
  787   2HB   ASP 101          1HB       ASP 101  -3.102  11.016  11.016
  788    H    GLN 102           H        GLN 102  -1.672   7.127   7.127
  789    HA   GLN 102           HA       GLN 102   1.202   7.414   7.414
  790   1HB   GLN 102          2HB       GLN 102  -0.445   5.026   5.026
  791   2HB   GLN 102          1HB       GLN 102   1.260   5.293   5.293
  792   1HG   GLN 102          2HG       GLN 102  -1.094   6.783   6.783
  793   2HG   GLN 102          1HG       GLN 102   0.061   5.776   5.776
  794   1HE2  GLN 102          2HE2      GLN 102   0.887   9.648   9.648
  795   2HE2  GLN 102          1HE2      GLN 102  -0.476   8.825   8.825
  796    H    ARG 103           H        ARG 103  -0.917   6.710   6.710
  797    HA   ARG 103           HA       ARG 103  -0.302   4.354   4.354
  798   1HB   ARG 103          2HB       ARG 103  -0.792   5.378   5.378
  799   2HB   ARG 103          1HB       ARG 103  -1.874   6.026   6.026
  800   1HG   ARG 103          2HG       ARG 103  -1.148   8.108   8.108
  801   2HG   ARG 103          1HG       ARG 103   0.543   7.612   7.612
  802   1HD   ARG 103          2HD       ARG 103   0.577   8.023   8.023
  803   2HD   ARG 103          1HD       ARG 103  -0.487   6.634   6.634
  804    HE   ARG 103           HE       ARG 103  -2.187   8.075   8.075
  805   1HH1  ARG 103          2HH1      ARG 103   0.312   9.846   9.846
  806   2HH1  ARG 103          1HH1      ARG 103  -0.453  11.383  11.383
  807   1HH2  ARG 103          1HH2      ARG 103  -3.194  10.096  10.096
  808   2HH2  ARG 103          2HH2      ARG 103  -2.444  11.525  11.525
  809    H    LYS 104           H        LYS 104   1.802   7.119   7.119
  810    HA   LYS 104           HA       LYS 104   3.823   5.808   5.808
  811   1HB   LYS 104          2HB       LYS 104   3.077   8.322   8.322
  812   2HB   LYS 104          1HB       LYS 104   4.180   8.543   8.543
  813   1HG   LYS 104          2HG       LYS 104   5.390   9.012   9.012
  814   2HG   LYS 104          1HG       LYS 104   5.956   7.449   7.449
  815   1HD   LYS 104          2HD       LYS 104   5.646   6.850   6.850
  816   2HD   LYS 104          1HD       LYS 104   3.981   6.624   6.624
  817   1HE   LYS 104          2HE       LYS 104   4.103   7.897   7.897
  818   2HE   LYS 104          1HE       LYS 104   3.398   8.844   8.844
  819   1HZ   LYS 104          2HZ       LYS 104   6.282   9.054   9.054
  820   2HZ   LYS 104          1HZ       LYS 104   5.246   9.832   9.832
  821   3HZ   LYS 104          3HZ       LYS 104   5.192  10.220  10.220
  822    H    ASN 105           H        ASN 105   3.036   6.550   6.550
  823    HA   ASN 105           HA       ASN 105   5.755   6.233   6.233
  824   1HB   ASN 105          2HB       ASN 105   3.113   6.762   6.762
  825   2HB   ASN 105          1HB       ASN 105   4.546   6.353   6.353
  826   1HD2  ASN 105          2HD2      ASN 105   3.972  10.072  10.072
  827   2HD2  ASN 105          1HD2      ASN 105   2.798   8.809   8.809
  828    H    ILE 106           H        ILE 106   2.751   4.366   4.366
  829    HA   ILE 106           HA       ILE 106   3.709   2.276   2.276
  830    HB   ILE 106           HB       ILE 106   1.301   2.696   2.696
  831   1HG1  ILE 106          2HG1      ILE 106   0.645   0.383   0.383
  832   2HG1  ILE 106          1HG1      ILE 106   2.115  -0.101  -0.101
  833   1HG2  ILE 106          2HG2      ILE 106   1.406   3.130   3.130
  834   2HG2  ILE 106          1HG2      ILE 106   1.821   1.445   1.445
  835   3HG2  ILE 106          3HG2      ILE 106   0.243   1.862   1.862
  836   1HD1  ILE 106          3HD1      ILE 106   2.561   1.316   1.316
  837   2HD1  ILE 106          2HD1      ILE 106   1.736  -0.235  -0.235
  838   3HD1  ILE 106          1HD1      ILE 106   3.312  -0.148  -0.148
  839    H    CYS 107           H        CYS 107   3.432   2.557   2.557
  840    HA   CYS 107           HA       CYS 107   4.445   0.054   0.054
  841   1HB   CYS 107          2HB       CYS 107   5.156   1.106   1.106
  842   2HB   CYS 107          1HB       CYS 107   3.522   1.576   1.576
  843    HG   CYS 107           HG       CYS 107   5.985   3.461   3.461
  844    H    GLN 108           H        GLN 108   6.009   2.976   2.976
  845    HA   GLN 108           HA       GLN 108   8.697   2.249   2.249
  846   1HB   GLN 108          2HB       GLN 108   7.318   4.279   4.279
  847   2HB   GLN 108          1HB       GLN 108   9.000   3.925   3.925
  848   1HG   GLN 108          2HG       GLN 108   8.330   4.455   4.455
  849   2HG   GLN 108          1HG       GLN 108   8.243   5.814   5.814
  850   1HE2  GLN 108          2HE2      GLN 108  11.895   4.001   4.001
  851   2HE2  GLN 108          1HE2      GLN 108  10.451   3.094   3.094
  852    H    PHE 109           H        PHE 109   6.625   1.987   1.987
  853    HA   PHE 109           HA       PHE 109   8.423   0.952   0.952
  854   1HB   PHE 109          2HB       PHE 109   6.056   1.750   1.750
  855   2HB   PHE 109          1HB       PHE 109   5.506   0.197   0.197
  856    HD1  PHE 109           HD2      PHE 109   7.904   1.531   1.531
  857    HD2  PHE 109           HD1      PHE 109   5.011  -1.421  -1.421
  858    HE1  PHE 109           HE2      PHE 109   8.101   0.572   0.572
  859    HE2  PHE 109           HE1      PHE 109   5.201  -2.383  -2.383
  860    HZ   PHE 109           HZ       PHE 109   6.748  -1.391  -1.391
  861    H    LEU 110           H        LEU 110   6.183  -0.847  -0.847
  862    HA   LEU 110           HA       LEU 110   6.938  -3.417  -3.417
  863   1HB   LEU 110          2HB       LEU 110   5.852  -2.252  -2.252
  864   2HB   LEU 110          1HB       LEU 110   6.256  -3.955  -3.955
  865    HG   LEU 110           HG       LEU 110   4.612  -4.329  -4.329
  866   1HD1  LEU 110          2HD1      LEU 110   4.944  -2.235  -2.235
  867   2HD1  LEU 110          1HD1      LEU 110   4.094  -1.360  -1.360
  868   3HD1  LEU 110          3HD1      LEU 110   3.239  -2.563  -2.563
  869   1HD2  LEU 110          2HD2      LEU 110   3.932  -3.138  -3.138
  870   2HD2  LEU 110          1HD2      LEU 110   3.235  -4.535  -4.535
  871   3HD2  LEU 110          3HD2      LEU 110   2.656  -2.914  -2.914
  872    H    VAL 111           H        VAL 111   8.534  -1.110  -1.110
  873    HA   VAL 111           HA       VAL 111  10.444  -3.096  -3.096
  874    HB   VAL 111           HB       VAL 111  10.277  -0.134  -0.134
  875   1HG1  VAL 111          2HG1      VAL 111  12.154  -2.268  -2.268
  876   2HG1  VAL 111          1HG1      VAL 111  11.631  -1.146  -1.146
  877   3HG1  VAL 111          3HG1      VAL 111  12.420  -0.535  -0.535
  878   1HG2  VAL 111          2HG2      VAL 111   8.377  -1.730  -1.730
  879   2HG2  VAL 111          1HG2      VAL 111   9.068  -0.591  -0.591
  880   3HG2  VAL 111          3HG2      VAL 111   9.558  -2.285  -2.285
  881    H    GLU 112           H        GLU 112  10.146  -0.627  -0.627
  882    HA   GLU 112           HA       GLU 112  12.993  -0.355  -0.355
  883   1HB   GLU 112          2HB       GLU 112  10.588   0.724   0.724
  884   2HB   GLU 112          1HB       GLU 112  12.251   1.071   1.071
  885   1HG   GLU 112          2HG       GLU 112  11.759   1.608   1.608
  886   2HG   GLU 112          1HG       GLU 112  10.678   2.519   2.519
  887    H    ILE 113           H        ILE 113  10.212  -1.703  -1.703
  888    HA   ILE 113           HA       ILE 113  11.957  -2.853  -2.853
  889    HB   ILE 113           HB       ILE 113   9.888  -3.559  -3.559
  890   1HG1  ILE 113          2HG1      ILE 113   8.135  -2.052  -2.052
  891   2HG1  ILE 113          1HG1      ILE 113   8.779  -3.543  -3.543
  892   1HG2  ILE 113          1HG2      ILE 113  10.887  -1.140  -1.140
  893   2HG2  ILE 113          3HG2      ILE 113   9.387  -0.731  -0.731
  894   3HG2  ILE 113          2HG2      ILE 113   9.333  -1.469  -1.469
  895   1HD1  ILE 113          3HD1      ILE 113   7.554  -3.581  -3.581
  896   2HD1  ILE 113          2HD1      ILE 113   6.522  -3.534  -3.534
  897   3HD1  ILE 113          1HD1      ILE 113   7.661  -4.861  -4.861
  898    H    GLY 114           H        GLY 114  11.669  -3.801  -3.801
  899   1HA   GLY 114          2HA       GLY 114  11.637  -5.799  -5.799
  900   2HA   GLY 114          1HA       GLY 114  12.303  -6.460  -6.460
  901    H    LEU 115           H        LEU 115   9.098  -5.136  -5.136
  902    HA   LEU 115           HA       LEU 115   7.882  -7.484  -7.484
  903   1HB   LEU 115          2HB       LEU 115   7.264  -4.910  -4.910
  904   2HB   LEU 115          1HB       LEU 115   6.247  -5.248  -5.248
  905    HG   LEU 115           HG       LEU 115   5.019  -6.911  -6.911
  906   1HD1  LEU 115          2HD1      LEU 115   7.320  -6.791  -6.791
  907   2HD1  LEU 115          1HD1      LEU 115   5.751  -6.895  -6.895
  908   3HD1  LEU 115          3HD1      LEU 115   6.229  -8.126  -8.126
  909   1HD2  LEU 115          2HD2      LEU 115   4.885  -4.264  -4.264
  910   2HD2  LEU 115          1HD2      LEU 115   3.771  -5.459  -5.459
  911   3HD2  LEU 115          3HD2      LEU 115   5.139  -4.900  -4.900
  912    H    ALA 116           H        ALA 116   7.040  -5.508  -5.508
  913    HA   ALA 116           HA       ALA 116   6.134  -7.950  -7.950
  914   1HB   ALA 116          1HB       ALA 116   4.735  -5.771  -5.771
  915   2HB   ALA 116          3HB       ALA 116   5.700  -5.212  -5.212
  916   3HB   ALA 116          2HB       ALA 116   4.704  -6.659  -6.659
  917    H    LYS 117           H        LYS 117   6.404  -7.651  -7.651
  918    HA   LYS 117           HA       LYS 117   9.284  -7.279  -7.279
  919   1HB   LYS 117          2HB       LYS 117   7.531  -9.327  -9.327
  920   2HB   LYS 117          1HB       LYS 117   7.880  -8.457  -8.457
  921   1HG   LYS 117          2HG       LYS 117   9.427 -10.303 -10.303
  922   2HG   LYS 117          1HG       LYS 117  10.264  -8.750  -8.750
  923   1HD   LYS 117          2HD       LYS 117   9.471  -9.333  -9.333
  924   2HD   LYS 117          1HD       LYS 117  10.208 -10.793 -10.793
  925   1HE   LYS 117          2HE       LYS 117  11.426  -8.035  -8.035
  926   2HE   LYS 117          1HE       LYS 117  11.891  -9.409  -9.409
  927   1HZ   LYS 117          3HZ       LYS 117  12.228 -10.509 -10.509
  928   2HZ   LYS 117          2HZ       LYS 117  12.438  -8.902  -8.902
  929   3HZ   LYS 117          1HZ       LYS 117  13.439  -9.563  -9.563
  930    H    ASP 118           H        ASP 118  10.024  -6.235  -6.235
  931    HA   ASP 118           HA       ASP 118   8.723  -3.797  -3.797
  932   1HB   ASP 118          2HB       ASP 118  10.697  -5.025  -5.025
  933   2HB   ASP 118          1HB       ASP 118  10.434  -3.320  -3.320
  934    H    ASP 119           H        ASP 119   8.483  -6.921  -6.921
  935    HA   ASP 119           HA       ASP 119   7.103  -5.993  -5.993
  936   1HB   ASP 119          2HB       ASP 119   7.282  -8.804  -8.804
  937   2HB   ASP 119          1HB       ASP 119   6.811  -8.348  -8.348
  938    H    GLN 120           H        GLN 120   6.298  -6.807  -6.807
  939    HA   GLN 120           HA       GLN 120   3.484  -7.237  -7.237
  940   1HB   GLN 120          2HB       GLN 120   4.866  -7.136  -7.136
  941   2HB   GLN 120          1HB       GLN 120   3.243  -7.726  -7.726
  942   1HG   GLN 120          2HG       GLN 120   4.399  -9.431  -9.431
  943   2HG   GLN 120          1HG       GLN 120   5.871  -8.980  -8.980
  944   1HE2  GLN 120          2HE2      GLN 120   4.176 -10.072 -10.072
  945   2HE2  GLN 120          1HE2      GLN 120   4.640  -8.534  -8.534
  946    H    LEU 121           H        LEU 121   5.459  -4.613  -4.613
  947    HA   LEU 121           HA       LEU 121   4.007  -2.934  -2.934
  948   1HB   LEU 121          2HB       LEU 121   5.914  -2.423  -2.423
  949   2HB   LEU 121          1HB       LEU 121   5.113  -1.093  -1.093
  950    HG   LEU 121           HG       LEU 121   6.747  -3.135  -3.135
  951   1HD1  LEU 121          1HD1      LEU 121   8.162  -2.074  -2.074
  952   2HD1  LEU 121          3HD1      LEU 121   7.677  -0.486  -0.486
  953   3HD1  LEU 121          2HD1      LEU 121   8.606  -1.571  -1.571
  954   1HD2  LEU 121          2HD2      LEU 121   5.000  -1.290  -1.290
  955   2HD2  LEU 121          1HD2      LEU 121   6.409  -1.863  -1.863
  956   3HD2  LEU 121          3HD2      LEU 121   6.494  -0.353  -0.353
  957    H    LYS 122           H        LYS 122   1.802  -3.443  -3.443
  958    HA   LYS 122           HA       LYS 122   0.897  -2.334  -2.334
  959   1HB   LYS 122          2HB       LYS 122  -0.171  -4.266  -4.266
  960   2HB   LYS 122          1HB       LYS 122  -1.370  -3.215  -3.215
  961   1HG   LYS 122          2HG       LYS 122   0.612  -4.859  -4.859
  962   2HG   LYS 122          1HG       LYS 122  -1.025  -5.389  -5.389
  963   1HD   LYS 122          2HD       LYS 122  -1.985  -3.968  -3.968
  964   2HD   LYS 122          1HD       LYS 122  -0.748  -2.728  -2.728
  965   1HE   LYS 122          2HE       LYS 122   0.769  -3.855  -3.855
  966   2HE   LYS 122          1HE       LYS 122  -0.207  -5.324  -5.324
  967   1HZ   LYS 122          3HZ       LYS 122  -1.024  -2.730  -2.730
  968   2HZ   LYS 122          2HZ       LYS 122  -0.438  -4.060  -4.060
  969   3HZ   LYS 122          1HZ       LYS 122  -1.912  -4.170  -4.170
  970    H    VAL 123           H        VAL 123   1.521  -0.158  -0.158
  971    HA   VAL 123           HA       VAL 123  -0.197   0.985   0.985
  972    HB   VAL 123           HB       VAL 123   2.177   1.607   1.607
  973   1HG1  VAL 123          3HG1      VAL 123   2.043   1.609   1.609
  974   2HG1  VAL 123          2HG1      VAL 123   1.840   3.336   3.336
  975   3HG1  VAL 123          1HG1      VAL 123   3.271   2.502   2.502
  976   1HG2  VAL 123          3HG2      VAL 123   0.239   3.843   3.843
  977   2HG2  VAL 123          2HG2      VAL 123   0.653   3.167   3.167
  978   3HG2  VAL 123          1HG2      VAL 123   1.856   4.076   4.076
  979    H    HIS 124           H        HIS 124  -2.090   1.863   1.863
  980    HA   HIS 124           HA       HIS 124  -2.578   2.875   2.875
  981   1HB   HIS 124          2HB       HIS 124  -4.609   1.907   1.907
  982   2HB   HIS 124          1HB       HIS 124  -4.949   2.429   2.429
  983    HD1  HIS 124           HD1      HIS 124  -4.962   0.638   0.638
  984    HD2  HIS 124           HD2      HIS 124  -2.924  -0.510  -0.510
  985    HE1  HIS 124           HE1      HIS 124  -4.351  -1.775  -1.775
  986    HE2  HIS 124           HE2      HIS 124  -2.980  -2.395  -2.395
  987    H    GLY 125           H        GLY 125  -2.851   3.542   3.542
  988   1HA   GLY 125          2HA       GLY 125  -3.397   5.452   5.452
  989   2HA   GLY 125          1HA       GLY 125  -2.452   6.236   6.236
  990    H    PHE 126           HN       PHE 126  -5.724   4.827   4.827
  991    HA   PHE 126           HA       PHE 126  -7.778   5.703   5.703
  992   1HB   PHE 126          2HB       PHE 126  -6.308   7.874   7.874
  993   2HB   PHE 126          1HB       PHE 126  -6.944   8.419   8.419
  994    HD1  PHE 126           HD2      PHE 126  -9.532   6.751   6.751
  995    HD2  PHE 126           HD1      PHE 126  -7.526   9.381   9.381
  996    HE1  PHE 126           HE2      PHE 126 -11.682   7.279   7.279
  997    HE2  PHE 126           HE1      PHE 126  -9.675   9.916   9.916
  998    HZ   PHE 126           HZ       PHE 126 -11.754   8.864   8.864

  Start of MODEL   22
    1   1H    MET   1          1H        MET   1  12.979 -36.017 -36.017
    2   2H    MET   1          3H        MET   1  12.808 -35.148 -35.148
    3   3H    MET   1          2H        MET   1  14.115 -36.242 -36.242
    4    HA   MET   1           HA       MET   1  12.769 -38.077 -38.077
    5   1HB   MET   1          2HB       MET   1  13.082 -36.443 -36.443
    6   2HB   MET   1          1HB       MET   1  11.329 -36.368 -36.368
    7   1HG   MET   1          2HG       MET   1  11.051 -38.497 -38.497
    8   2HG   MET   1          1HG       MET   1  12.533 -39.059 -39.059
    9   1HE   MET   1          2HE       MET   1  11.392 -36.441 -36.441
   10   2HE   MET   1          1HE       MET   1  11.083 -37.745 -37.745
   11   3HE   MET   1          3HE       MET   1  12.421 -36.628 -36.628
   12    H    ARG   2           H        ARG   2  11.352 -38.711 -38.711
   13    HA   ARG   2           HA       ARG   2   8.920 -37.187 -37.187
   14   1HB   ARG   2          2HB       ARG   2  10.195 -38.049 -38.049
   15   2HB   ARG   2          1HB       ARG   2   9.956 -39.692 -39.692
   16   1HG   ARG   2          2HG       ARG   2   8.077 -39.808 -39.808
   17   2HG   ARG   2          1HG       ARG   2   7.404 -38.506 -38.506
   18   1HD   ARG   2          2HD       ARG   2   7.254 -37.903 -37.903
   19   2HD   ARG   2          1HD       ARG   2   8.439 -36.866 -36.866
   20    HE   ARG   2           HE       ARG   2   9.939 -38.885 -38.885
   21   1HH1  ARG   2          2HH1      ARG   2   7.585 -36.709 -36.709
   22   2HH1  ARG   2          1HH1      ARG   2   8.318 -36.712 -36.712
   23   1HH2  ARG   2          1HH2      ARG   2  10.904 -38.890 -38.890
   24   2HH2  ARG   2          2HH2      ARG   2  10.203 -37.950 -37.950
   25    H    GLY   3           H        GLY   3   7.431 -37.505 -37.505
   26   1HA   GLY   3          2HA       GLY   3   7.003 -40.181 -40.181
   27   2HA   GLY   3          1HA       GLY   3   6.272 -38.695 -38.695
   28    H    SER   4           H        SER   4   5.240 -41.432 -41.432
   29    HA   SER   4           HA       SER   4   3.711 -41.079 -41.079
   30   1HB   SER   4          2HB       SER   4   2.659 -43.108 -43.108
   31   2HB   SER   4          1HB       SER   4   4.248 -43.252 -43.252
   32    HG   SER   4           HG       SER   4   2.038 -43.620 -43.620
   33    H    HIS   5           H        HIS   5   2.012 -39.828 -39.828
   34    HA   HIS   5           HA       HIS   5   0.495 -38.804 -38.804
   35   1HB   HIS   5          2HB       HIS   5   1.705 -37.370 -37.370
   36   2HB   HIS   5          1HB       HIS   5   0.116 -37.578 -37.578
   37    HD1  HIS   5           HD1      HIS   5   1.226 -34.819 -34.819
   38    HD2  HIS   5           HD2      HIS   5  -1.328 -37.287 -37.287
   39    HE1  HIS   5           HE1      HIS   5   0.048 -33.307 -33.307
   40    HE2  HIS   5           HE2      HIS   5  -1.429 -34.837 -34.837
   41    H    HIS   6           H        HIS   6  -0.955 -40.497 -40.497
   42    HA   HIS   6           HA       HIS   6  -2.704 -41.105 -41.105
   43   1HB   HIS   6          2HB       HIS   6  -1.731 -42.640 -42.640
   44   2HB   HIS   6          1HB       HIS   6  -3.442 -42.864 -42.864
   45    HD1  HIS   6           HD1      HIS   6  -1.285 -42.235 -42.235
   46    HD2  HIS   6           HD2      HIS   6  -2.752 -45.511 -45.511
   47    HE1  HIS   6           HE1      HIS   6  -0.902 -44.216 -44.216
   48    HE2  HIS   6           HE2      HIS   6  -1.883 -46.173 -46.173
   49    H    HIS   7           H        HIS   7  -3.704 -38.961 -38.961
   50    HA   HIS   7           HA       HIS   7  -5.273 -38.565 -38.565
   51   1HB   HIS   7          2HB       HIS   7  -4.290 -36.681 -36.681
   52   2HB   HIS   7          1HB       HIS   7  -5.384 -37.063 -37.063
   53    HD1  HIS   7           HD1      HIS   7  -6.209 -36.828 -36.828
   54    HD2  HIS   7           HD2      HIS   7  -7.131 -34.983 -34.983
   55    HE1  HIS   7           HE1      HIS   7  -8.024 -35.174 -35.174
   56    HE2  HIS   7           HE2      HIS   7  -8.623 -34.128 -34.128
   57    H    HIS   8           H        HIS   8  -6.999 -39.805 -39.805
   58    HA   HIS   8           HA       HIS   8  -9.276 -39.688 -39.688
   59   1HB   HIS   8          2HB       HIS   8  -7.878 -41.180 -41.180
   60   2HB   HIS   8          1HB       HIS   8  -7.851 -42.353 -42.353
   61    HD1  HIS   8           HD1      HIS   8 -11.070 -40.628 -40.628
   62    HD2  HIS   8           HD2      HIS   8  -9.234 -44.085 -44.085
   63    HE1  HIS   8           HE1      HIS   8 -12.917 -42.019 -42.019
   64    HE2  HIS   8           HE2      HIS   8 -11.796 -44.146 -44.146
   65    H    HIS   9           H        HIS   9 -10.091 -39.204 -39.204
   66    HA   HIS   9           HA       HIS   9 -11.171 -41.454 -41.454
   67   1HB   HIS   9          2HB       HIS   9 -10.129 -40.805 -40.805
   68   2HB   HIS   9          1HB       HIS   9  -9.102 -41.676 -41.676
   69    HD1  HIS   9           HD1      HIS   9  -6.814 -40.771 -40.771
   70    HD2  HIS   9           HD2      HIS   9  -9.672 -37.775 -37.775
   71    HE1  HIS   9           HE1      HIS   9  -5.518 -38.624 -38.624
   72    HE2  HIS   9           HE2      HIS   9  -7.266 -36.835 -36.835
   73    H    HIS  10           H        HIS  10 -12.307 -39.265 -39.265
   74    HA   HIS  10           HA       HIS  10 -13.394 -37.719 -37.719
   75   1HB   HIS  10          2HB       HIS  10 -14.060 -36.078 -36.078
   76   2HB   HIS  10          1HB       HIS  10 -12.389 -36.102 -36.102
   77    HD1  HIS  10           HD1      HIS  10 -14.365 -37.948 -37.948
   78    HD2  HIS  10           HD2      HIS  10 -10.706 -36.071 -36.071
   79    HE1  HIS  10           HE1      HIS  10 -13.158 -38.122 -38.122
   80    HE2  HIS  10           HE2      HIS  10 -10.979 -36.907 -36.907
   81    H    THR  11           H        THR  11 -15.263 -38.636 -38.636
   82    HA   THR  11           HA       THR  11 -17.096 -39.510 -39.510
   83    HB   THR  11           HB       THR  11 -18.229 -40.626 -40.626
   84    HG1  THR  11           HG1      THR  11 -15.518 -40.476 -40.476
   85   1HG2  THR  11          3HG2      THR  11 -16.904 -41.684 -41.684
   86   2HG2  THR  11          2HG2      THR  11 -15.693 -41.970 -41.970
   87   3HG2  THR  11          1HG2      THR  11 -17.319 -42.630 -42.630
   88    H    ASP  12           H        ASP  12 -16.918 -36.786 -36.786
   89    HA   ASP  12           HA       ASP  12 -19.577 -36.280 -36.280
   90   1HB   ASP  12          2HB       ASP  12 -17.134 -34.551 -34.551
   91   2HB   ASP  12          1HB       ASP  12 -18.763 -34.202 -34.202
   92    HA   PRO  13           HA       PRO  13 -19.615 -34.474 -34.474
   93   1HB   PRO  13          2HB       PRO  13 -22.291 -34.612 -34.612
   94   2HB   PRO  13          1HB       PRO  13 -21.237 -36.006 -36.006
   95   1HG   PRO  13          2HG       PRO  13 -22.887 -35.302 -35.302
   96   2HG   PRO  13          1HG       PRO  13 -22.683 -36.875 -36.875
   97   1HD   PRO  13          2HD       PRO  13 -21.346 -36.188 -36.188
   98   2HD   PRO  13          1HD       PRO  13 -20.661 -37.273 -37.273
   99    H    MET  14           H        MET  14 -20.573 -33.366 -33.366
  100    HA   MET  14           HA       MET  14 -21.286 -31.336 -31.336
  101   1HB   MET  14          2HB       MET  14 -19.343 -30.810 -30.810
  102   2HB   MET  14          1HB       MET  14 -20.688 -29.921 -29.921
  103   1HG   MET  14          2HG       MET  14 -20.266 -28.259 -28.259
  104   2HG   MET  14          1HG       MET  14 -20.689 -29.310 -29.310
  105   1HE   MET  14          2HE       MET  14 -17.963 -28.318 -28.318
  106   2HE   MET  14          1HE       MET  14 -16.446 -28.643 -28.643
  107   3HE   MET  14          3HE       MET  14 -17.398 -29.978 -29.978
  108    H    SER  15           H        SER  15 -23.149 -33.047 -33.047
  109    HA   SER  15           HA       SER  15 -25.249 -33.093 -33.093
  110   1HB   SER  15          2HB       SER  15 -25.850 -31.650 -31.650
  111   2HB   SER  15          1HB       SER  15 -25.187 -30.239 -30.239
  112    HG   SER  15           HG       SER  15 -27.595 -31.565 -31.565
  113    H    ALA  16           H        ALA  16 -22.941 -32.380 -32.380
  114    HA   ALA  16           HA       ALA  16 -22.430 -31.792 -31.792
  115   1HB   ALA  16          3HB       ALA  16 -25.420 -31.848 -31.848
  116   2HB   ALA  16          2HB       ALA  16 -24.427 -31.385 -31.385
  117   3HB   ALA  16          1HB       ALA  16 -24.241 -32.984 -32.984
  118    H    ILE  17           H        ILE  17 -22.496 -29.888 -29.888
  119    HA   ILE  17           HA       ILE  17 -23.582 -27.404 -27.404
  120    HB   ILE  17           HB       ILE  17 -21.734 -28.231 -28.231
  121   1HG1  ILE  17          2HG1      ILE  17 -24.181 -26.541 -26.541
  122   2HG1  ILE  17          1HG1      ILE  17 -24.371 -28.256 -28.256
  123   1HG2  ILE  17          3HG2      ILE  17 -22.010 -25.529 -25.529
  124   2HG2  ILE  17          2HG2      ILE  17 -22.055 -25.658 -25.658
  125   3HG2  ILE  17          1HG2      ILE  17 -20.662 -26.267 -26.267
  126   1HD1  ILE  17          1HD1      ILE  17 -22.715 -28.531 -28.531
  127   2HD1  ILE  17          3HD1      ILE  17 -23.297 -26.919 -26.919
  128   3HD1  ILE  17          2HD1      ILE  17 -24.437 -28.257 -28.257
  129    H    GLN  18           H        GLN  18 -22.803 -26.905 -26.905
  130    HA   GLN  18           HA       GLN  18 -19.888 -26.594 -26.594
  131   1HB   GLN  18          2HB       GLN  18 -21.882 -26.643 -26.643
  132   2HB   GLN  18          1HB       GLN  18 -20.135 -26.817 -26.817
  133   1HG   GLN  18          2HG       GLN  18 -20.728 -28.896 -28.896
  134   2HG   GLN  18          1HG       GLN  18 -22.206 -28.802 -28.802
  135   1HE2  GLN  18          2HE2      GLN  18 -20.641 -30.827 -30.827
  136   2HE2  GLN  18          1HE2      GLN  18 -21.919 -30.616 -30.616
  137    H    ASN  19           H        ASN  19 -19.224 -24.582 -24.582
  138    HA   ASN  19           HA       ASN  19 -20.184 -22.399 -22.399
  139   1HB   ASN  19          2HB       ASN  19 -22.039 -22.597 -22.597
  140   2HB   ASN  19          1HB       ASN  19 -20.866 -22.268 -22.268
  141   1HD2  ASN  19          2HD2      ASN  19 -22.627 -19.270 -19.270
  142   2HD2  ASN  19          1HD2      ASN  19 -23.141 -20.919 -20.919
  143    H    LEU  20           H        LEU  20 -18.629 -23.266 -23.266
  144    HA   LEU  20           HA       LEU  20 -16.919 -21.045 -21.045
  145   1HB   LEU  20          2HB       LEU  20 -17.462 -22.751 -22.751
  146   2HB   LEU  20          1HB       LEU  20 -16.279 -23.796 -23.796
  147    HG   LEU  20           HG       LEU  20 -14.518 -22.164 -22.164
  148   1HD1  LEU  20          2HD1      LEU  20 -16.740 -20.540 -20.540
  149   2HD1  LEU  20          1HD1      LEU  20 -15.023 -20.211 -20.211
  150   3HD1  LEU  20          3HD1      LEU  20 -15.727 -20.107 -20.107
  151   1HD2  LEU  20          1HD2      LEU  20 -16.203 -22.985 -22.985
  152   2HD2  LEU  20          3HD2      LEU  20 -14.765 -23.776 -23.776
  153   3HD2  LEU  20          2HD2      LEU  20 -14.623 -22.223 -22.223
  154    H    HIS  21           H        HIS  21 -15.999 -24.385 -24.385
  155    HA   HIS  21           HA       HIS  21 -14.359 -23.403 -23.403
  156   1HB   HIS  21          2HB       HIS  21 -13.246 -24.368 -24.368
  157   2HB   HIS  21          1HB       HIS  21 -12.487 -24.999 -24.999
  158    HD1  HIS  21           HD1      HIS  21 -13.376 -21.629 -21.629
  159    HD2  HIS  21           HD2      HIS  21 -10.605 -23.353 -23.353
  160    HE1  HIS  21           HE1      HIS  21 -11.727 -19.806 -19.806
  161    HE2  HIS  21           HE2      HIS  21 -10.101 -20.852 -20.852
  162    H    SER  22           H        SER  22 -15.543 -24.620 -24.620
  163    HA   SER  22           HA       SER  22 -14.863 -27.388 -27.388
  164   1HB   SER  22          2HB       SER  22 -16.952 -27.054 -27.054
  165   2HB   SER  22          1HB       SER  22 -17.817 -27.049 -27.049
  166    HG   SER  22           HG       SER  22 -17.148 -29.146 -29.146
  167    H    PHE  23           H        PHE  23 -14.354 -27.422 -27.422
  168    HA   PHE  23           HA       PHE  23 -16.010 -25.933 -25.933
  169   1HB   PHE  23          2HB       PHE  23 -14.091 -26.452 -26.452
  170   2HB   PHE  23          1HB       PHE  23 -13.715 -25.379 -25.379
  171    HD1  PHE  23           HD2      PHE  23 -13.347 -28.816 -28.816
  172    HD2  PHE  23           HD1      PHE  23 -12.107 -25.971 -25.971
  173    HE1  PHE  23           HE2      PHE  23 -11.496 -30.300 -30.300
  174    HE2  PHE  23           HE1      PHE  23 -10.253 -27.448 -27.448
  175    HZ   PHE  23           HZ       PHE  23  -9.947 -29.616 -29.616
  176    H    ASP  24           H        ASP  24 -17.432 -26.962 -26.962
  177    HA   ASP  24           HA       ASP  24 -16.951 -29.766 -29.766
  178   1HB   ASP  24          2HB       ASP  24 -19.252 -28.663 -28.663
  179   2HB   ASP  24          1HB       ASP  24 -19.611 -29.879 -29.879
  180    HA   PRO  25           HA       PRO  25 -17.787 -28.213 -28.213
  181   1HB   PRO  25          2HB       PRO  25 -18.674 -31.015 -31.015
  182   2HB   PRO  25          1HB       PRO  25 -17.512 -30.036 -30.036
  183   1HG   PRO  25          2HG       PRO  25 -16.685 -31.975 -31.975
  184   2HG   PRO  25          1HG       PRO  25 -15.797 -30.444 -30.444
  185   1HD   PRO  25          2HD       PRO  25 -17.624 -31.410 -31.410
  186   2HD   PRO  25          1HD       PRO  25 -16.145 -30.436 -30.436
  187    H    PHE  26           H        PHE  26 -20.084 -30.060 -30.060
  188    HA   PHE  26           HA       PHE  26 -22.302 -29.134 -29.134
  189   1HB   PHE  26          2HB       PHE  26 -22.504 -30.974 -30.974
  190   2HB   PHE  26          1HB       PHE  26 -23.650 -30.775 -30.775
  191    HD1  PHE  26           HD1      PHE  26 -20.265 -32.025 -32.025
  192    HD2  PHE  26           HD2      PHE  26 -23.508 -32.097 -32.097
  193    HE1  PHE  26           HE1      PHE  26 -19.204 -33.897 -33.897
  194    HE2  PHE  26           HE2      PHE  26 -22.453 -33.971 -33.971
  195    HZ   PHE  26           HZ       PHE  26 -20.299 -34.873 -34.873
  196    H    ALA  27           H        ALA  27 -20.594 -27.938 -27.938
  197    HA   ALA  27           HA       ALA  27 -22.892 -26.377 -26.377
  198   1HB   ALA  27          2HB       ALA  27 -22.045 -28.357 -28.357
  199   2HB   ALA  27          1HB       ALA  27 -20.888 -27.121 -27.121
  200   3HB   ALA  27          3HB       ALA  27 -22.618 -26.823 -26.823
  201    H    ASP  28           H        ASP  28 -22.189 -24.593 -24.593
  202    HA   ASP  28           HA       ASP  28 -19.658 -23.407 -23.407
  203   1HB   ASP  28          2HB       ASP  28 -19.774 -22.173 -22.173
  204   2HB   ASP  28          1HB       ASP  28 -19.202 -23.837 -23.837
  205    H    ALA  29           H        ALA  29 -22.938 -22.752 -22.752
  206    HA   ALA  29           HA       ALA  29 -22.895 -19.972 -19.972
  207   1HB   ALA  29          2HB       ALA  29 -24.971 -21.977 -21.977
  208   2HB   ALA  29          1HB       ALA  29 -25.507 -20.467 -20.467
  209   3HB   ALA  29          3HB       ALA  29 -24.586 -20.436 -20.436
  210    H    SER  30           H        SER  30 -21.998 -19.840 -19.840
  211    HA   SER  30           HA       SER  30 -24.024 -20.090 -20.090
  212   1HB   SER  30          2HB       SER  30 -22.913 -22.145 -22.145
  213   2HB   SER  30          1HB       SER  30 -21.327 -21.435 -21.435
  214    HG   SER  30           HG       SER  30 -21.259 -20.739 -20.739
  215    H    LYS  31           H        LYS  31 -20.677 -19.119 -19.119
  216    HA   LYS  31           HA       LYS  31 -21.191 -16.616 -16.616
  217   1HB   LYS  31          2HB       LYS  31 -19.684 -18.437 -18.437
  218   2HB   LYS  31          1HB       LYS  31 -18.460 -17.833 -17.833
  219   1HG   LYS  31          2HG       LYS  31 -18.008 -16.328 -16.328
  220   2HG   LYS  31          1HG       LYS  31 -19.496 -15.527 -15.527
  221   1HD   LYS  31          2HD       LYS  31 -20.455 -17.424 -17.424
  222   2HD   LYS  31          1HD       LYS  31 -18.904 -17.037 -17.037
  223   1HE   LYS  31          2HE       LYS  31 -21.110 -15.103 -15.103
  224   2HE   LYS  31          1HE       LYS  31 -20.627 -15.613 -15.613
  225   1HZ   LYS  31          1HZ       LYS  31 -18.327 -14.683 -14.683
  226   2HZ   LYS  31          3HZ       LYS  31 -19.304 -13.760 -13.760
  227   3HZ   LYS  31          2HZ       LYS  31 -19.506 -13.656 -13.656
  228    H    GLY  32           H        GLY  32 -18.994 -18.260 -18.260
  229   1HA   GLY  32          2HA       GLY  32 -18.781 -17.294 -17.294
  230   2HA   GLY  32          1HA       GLY  32 -18.808 -15.710 -15.710
  231    H    ASP  33           H        ASP  33 -17.028 -15.901 -15.901
  232    HA   ASP  33           HA       ASP  33 -14.539 -15.793 -15.793
  233   1HB   ASP  33          2HB       ASP  33 -15.150 -15.703 -15.703
  234   2HB   ASP  33          1HB       ASP  33 -13.585 -15.331 -15.331
  235    H    ASP  34           H        ASP  34 -13.354 -17.485 -17.485
  236    HA   ASP  34           HA       ASP  34 -13.617 -19.990 -19.990
  237   1HB   ASP  34          2HB       ASP  34 -12.597 -19.284 -19.284
  238   2HB   ASP  34          1HB       ASP  34 -12.158 -20.819 -20.819
  239    H    LEU  35           H        LEU  35 -11.220 -17.595 -17.595
  240    HA   LEU  35           HA       LEU  35  -9.203 -18.997 -18.997
  241   1HB   LEU  35          2HB       LEU  35  -8.972 -16.959 -16.959
  242   2HB   LEU  35          1HB       LEU  35  -7.622 -17.361 -17.361
  243    HG   LEU  35           HG       LEU  35  -9.067 -19.489 -19.489
  244   1HD1  LEU  35          2HD1      LEU  35  -8.340 -17.726 -17.726
  245   2HD1  LEU  35          1HD1      LEU  35  -6.694 -17.902 -17.902
  246   3HD1  LEU  35          3HD1      LEU  35  -7.477 -19.247 -19.247
  247   1HD2  LEU  35          2HD2      LEU  35  -7.367 -19.856 -19.856
  248   2HD2  LEU  35          1HD2      LEU  35  -7.247 -20.821 -20.821
  249   3HD2  LEU  35          3HD2      LEU  35  -6.168 -19.447 -19.447
  250    H    LEU  36           H        LEU  36  -7.735 -17.627 -17.627
  251    HA   LEU  36           HA       LEU  36  -8.814 -15.052 -15.052
  252   1HB   LEU  36          2HB       LEU  36  -8.356 -17.318 -17.318
  253   2HB   LEU  36          1HB       LEU  36  -8.772 -15.671 -15.671
  254    HG   LEU  36           HG       LEU  36 -10.557 -17.416 -17.416
  255   1HD1  LEU  36          2HD1      LEU  36 -10.040 -18.285 -18.285
  256   2HD1  LEU  36          1HD1      LEU  36 -10.960 -16.890 -16.890
  257   3HD1  LEU  36          3HD1      LEU  36 -11.732 -18.098 -18.098
  258   1HD2  LEU  36          3HD2      LEU  36 -10.681 -14.806 -14.806
  259   2HD2  LEU  36          2HD2      LEU  36 -12.151 -15.776 -15.776
  260   3HD2  LEU  36          1HD2      LEU  36 -11.441 -15.124 -15.124
  261    HA   PRO  37           HA       PRO  37  -4.550 -13.947 -13.947
  262   1HB   PRO  37          2HB       PRO  37  -4.658 -12.137 -12.137
  263   2HB   PRO  37          1HB       PRO  37  -5.055 -11.765 -11.765
  264   1HG   PRO  37          2HG       PRO  37  -6.873 -12.399 -12.399
  265   2HG   PRO  37          1HG       PRO  37  -7.078 -11.218 -11.218
  266   1HD   PRO  37          2HD       PRO  37  -8.369 -13.576 -13.576
  267   2HD   PRO  37          1HD       PRO  37  -7.792 -12.820 -12.820
  268    H    ALA  38           H        ALA  38  -5.768 -13.871 -13.871
  269    HA   ALA  38           HA       ALA  38  -4.994 -14.808 -14.808
  270   1HB   ALA  38          3HB       ALA  38  -4.204 -16.960 -16.960
  271   2HB   ALA  38          2HB       ALA  38  -4.063 -17.130 -17.130
  272   3HB   ALA  38          1HB       ALA  38  -5.647 -16.893 -16.893
  273    H    GLY  39           H        GLY  39  -2.997 -15.534 -15.534
  274   1HA   GLY  39          2HA       GLY  39  -0.745 -15.374 -15.374
  275   2HA   GLY  39          1HA       GLY  39  -0.444 -15.092 -15.092
  276    H    THR  40           H        THR  40  -0.489 -13.720 -13.720
  277    HA   THR  40           HA       THR  40   0.022 -11.080 -11.080
  278    HB   THR  40           HB       THR  40  -1.397  -9.943  -9.943
  279    HG1  THR  40           HG1      THR  40  -2.434 -10.956 -10.956
  280   1HG2  THR  40          2HG2      THR  40  -2.911 -12.232 -12.232
  281   2HG2  THR  40          1HG2      THR  40  -3.635 -10.772 -10.772
  282   3HG2  THR  40          3HG2      THR  40  -2.587 -10.665 -10.665
  283    H    GLU  41           H        GLU  41   1.436 -13.411 -13.411
  284    HA   GLU  41           HA       GLU  41   3.059 -13.702 -13.702
  285   1HB   GLU  41          2HB       GLU  41   3.508 -11.171 -11.171
  286   2HB   GLU  41          1HB       GLU  41   4.196 -11.177 -11.177
  287   1HG   GLU  41          2HG       GLU  41   4.911 -13.632 -13.632
  288   2HG   GLU  41          1HG       GLU  41   5.128 -12.459 -12.459
  289    H    ASP  42           H        ASP  42   0.376 -12.745 -12.745
  290    HA   ASP  42           HA       ASP  42  -0.650 -11.942 -11.942
  291   1HB   ASP  42          2HB       ASP  42   1.576 -13.694 -13.694
  292   2HB   ASP  42          1HB       ASP  42   0.966 -12.657 -12.657
  293    H    TYR  43           H        TYR  43   0.087  -9.742  -9.742
  294    HA   TYR  43           HA       TYR  43   2.179  -8.325  -8.325
  295   1HB   TYR  43          2HB       TYR  43  -0.292  -7.229  -7.229
  296   2HB   TYR  43          1HB       TYR  43   1.172  -6.326  -6.326
  297    HD1  TYR  43           HD1      TYR  43   3.013  -8.763  -8.763
  298    HD2  TYR  43           HD2      TYR  43  -0.178  -6.689  -6.689
  299    HE1  TYR  43           HE1      TYR  43   3.937  -9.363  -9.363
  300    HE2  TYR  43           HE2      TYR  43   0.737  -7.294  -7.294
  301    HH   TYR  43           HH       TYR  43   3.151  -9.633  -9.633
  302    H    ILE  44           H        ILE  44   1.642  -6.188  -6.188
  303    HA   ILE  44           HA       ILE  44  -0.251  -6.822  -6.822
  304    HB   ILE  44           HB       ILE  44   2.193  -5.046  -5.046
  305   1HG1  ILE  44          2HG1      ILE  44   2.944  -7.293  -7.293
  306   2HG1  ILE  44          1HG1      ILE  44   2.970  -6.808  -6.808
  307   1HG2  ILE  44          3HG2      ILE  44   0.216  -4.404  -4.404
  308   2HG2  ILE  44          2HG2      ILE  44   0.510  -5.912  -5.912
  309   3HG2  ILE  44          1HG2      ILE  44   1.757  -4.667  -4.667
  310   1HD1  ILE  44          1HD1      ILE  44   0.713  -7.906  -7.906
  311   2HD1  ILE  44          3HD1      ILE  44   0.999  -8.595  -8.595
  312   3HD1  ILE  44          2HD1      ILE  44   2.085  -8.981  -8.981
  313    H    HIS  45           H        HIS  45  -2.099  -5.873  -5.873
  314    HA   HIS  45           HA       HIS  45  -2.212  -3.361  -3.361
  315   1HB   HIS  45          2HB       HIS  45  -3.979  -5.494  -5.494
  316   2HB   HIS  45          1HB       HIS  45  -4.720  -4.041  -4.041
  317    HD1  HIS  45           HD1      HIS  45  -3.578  -5.556  -5.556
  318    HD2  HIS  45           HD2      HIS  45  -5.661  -2.231  -2.231
  319    HE1  HIS  45           HE1      HIS  45  -4.592  -4.512  -4.512
  320    HE2  HIS  45           HE2      HIS  45  -5.782  -2.457  -2.457
  321    H    ILE  46           H        ILE  46  -2.018  -1.428  -1.428
  322    HA   ILE  46           HA       ILE  46  -2.154  -0.998  -0.998
  323    HB   ILE  46           HB       ILE  46  -1.700   0.996   0.996
  324   1HG1  ILE  46          2HG1      ILE  46   0.024  -0.779  -0.779
  325   2HG1  ILE  46          1HG1      ILE  46   0.657   0.815   0.815
  326   1HG2  ILE  46          1HG2      ILE  46  -1.592   1.227   1.227
  327   2HG2  ILE  46          3HG2      ILE  46  -0.644   2.294   2.294
  328   3HG2  ILE  46          2HG2      ILE  46  -2.403   2.272   2.272
  329   1HD1  ILE  46          2HD1      ILE  46   0.139   0.099   0.099
  330   2HD1  ILE  46          1HD1      ILE  46   0.177  -1.528  -1.528
  331   3HD1  ILE  46          3HD1      ILE  46   1.594  -0.485  -0.485
  332    H    ARG  47           H        ARG  47  -3.446   1.518   1.518
  333    HA   ARG  47           HA       ARG  47  -5.593   2.220   2.220
  334   1HB   ARG  47          2HB       ARG  47  -6.267  -0.236  -0.236
  335   2HB   ARG  47          1HB       ARG  47  -6.702   0.359   0.359
  336   1HG   ARG  47          2HG       ARG  47  -8.700   0.484   0.484
  337   2HG   ARG  47          1HG       ARG  47  -8.075   2.127   2.127
  338   1HD   ARG  47          2HD       ARG  47  -8.601   1.774   1.774
  339   2HD   ARG  47          1HD       ARG  47  -6.990   1.056   1.056
  340    HE   ARG  47           HE       ARG  47  -8.576  -1.033  -1.033
  341   1HH1  ARG  47          2HH1      ARG  47  -8.690   1.334   1.334
  342   2HH1  ARG  47          1HH1      ARG  47  -9.445   0.260   0.260
  343   1HH2  ARG  47          1HH2      ARG  47  -9.567  -2.449  -2.449
  344   2HH2  ARG  47          2HH2      ARG  47  -9.944  -1.887  -1.887
  345    H    ILE  48           H        ILE  48  -6.400   4.032   4.032
  346    HA   ILE  48           HA       ILE  48  -5.953   4.685   4.685
  347    HB   ILE  48           HB       ILE  48  -5.148   6.079   6.079
  348   1HG1  ILE  48          2HG1      ILE  48  -5.388   7.038   7.038
  349   2HG1  ILE  48          1HG1      ILE  48  -4.026   6.163   6.163
  350   1HG2  ILE  48          3HG2      ILE  48  -7.510   6.889   6.889
  351   2HG2  ILE  48          2HG2      ILE  48  -7.275   7.709   7.709
  352   3HG2  ILE  48          1HG2      ILE  48  -6.294   8.156   8.156
  353   1HD1  ILE  48          2HD1      ILE  48  -4.750   8.614   8.614
  354   2HD1  ILE  48          1HD1      ILE  48  -4.190   8.859   8.859
  355   3HD1  ILE  48          3HD1      ILE  48  -3.167   8.005   8.005
  356    H    GLN  49           H        GLN  49  -7.533   6.453   6.453
  357    HA   GLN  49           HA       GLN  49 -10.110   6.521   6.521
  358   1HB   GLN  49          2HB       GLN  49 -11.381   5.417   5.417
  359   2HB   GLN  49          1HB       GLN  49 -10.209   4.295   4.295
  360   1HG   GLN  49          2HG       GLN  49  -8.827   5.384   5.384
  361   2HG   GLN  49          1HG       GLN  49 -10.474   5.339   5.339
  362   1HE2  GLN  49          2HE2      GLN  49 -10.540   1.911   1.911
  363   2HE2  GLN  49          1HE2      GLN  49 -11.355   3.432   3.432
  364    H    GLN  50           H        GLN  50 -10.144   8.685   8.685
  365    HA   GLN  50           HA       GLN  50  -9.728   9.921   9.921
  366   1HB   GLN  50          2HB       GLN  50  -8.482  10.582  10.582
  367   2HB   GLN  50          1HB       GLN  50  -9.933  11.545  11.545
  368   1HG   GLN  50          2HG       GLN  50  -9.548  12.741  12.741
  369   2HG   GLN  50          1HG       GLN  50  -8.190  11.695  11.695
  370   1HE2  GLN  50          2HE2      GLN  50  -6.247  14.310  14.310
  371   2HE2  GLN  50          1HE2      GLN  50  -6.841  13.517  13.517
  372    H    ARG  51           H        ARG  51 -11.490  10.392  10.392
  373    HA   ARG  51           HA       ARG  51 -13.988  10.923  10.923
  374   1HB   ARG  51          2HB       ARG  51 -13.537  10.274  10.274
  375   2HB   ARG  51          1HB       ARG  51 -15.103  10.511  10.511
  376   1HG   ARG  51          2HG       ARG  51 -15.176   8.404   8.404
  377   2HG   ARG  51          1HG       ARG  51 -13.580   8.526   8.526
  378   1HD   ARG  51          2HD       ARG  51 -12.709   7.288   7.288
  379   2HD   ARG  51          1HD       ARG  51 -13.256   8.453   8.453
  380    HE   ARG  51           HE       ARG  51 -15.482   7.001   7.001
  381   1HH1  ARG  51          2HH1      ARG  51 -12.223   6.152   6.152
  382   2HH1  ARG  51          1HH1      ARG  51 -12.702   4.723   4.723
  383   1HH2  ARG  51          1HH2      ARG  51 -16.113   5.121   5.121
  384   2HH2  ARG  51          2HH2      ARG  51 -14.909   4.138   4.138
  385    H    ASN  52           H        ASN  52 -15.151  12.799  12.799
  386    HA   ASN  52           HA       ASN  52 -15.508  15.002  15.002
  387   1HB   ASN  52          2HB       ASN  52 -15.459  14.140  14.140
  388   2HB   ASN  52          1HB       ASN  52 -13.764  14.615  14.615
  389   1HD2  ASN  52          2HD2      ASN  52 -15.252  17.474  17.474
  390   2HD2  ASN  52          1HD2      ASN  52 -14.641  15.896  15.896
  391    H    GLY  53           H        GLY  53 -13.005  13.981  13.981
  392   1HA   GLY  53          2HA       GLY  53 -11.201  14.907  14.907
  393   2HA   GLY  53          1HA       GLY  53 -11.905  16.469  16.469
  394    H    ARG  54           H        ARG  54 -10.684  13.946  13.946
  395    HA   ARG  54           HA       ARG  54  -8.223  15.207  15.207
  396   1HB   ARG  54          2HB       ARG  54  -8.618  16.285  16.285
  397   2HB   ARG  54          1HB       ARG  54  -9.824  16.894  16.894
  398   1HG   ARG  54          2HG       ARG  54 -11.450  15.280  15.280
  399   2HG   ARG  54          1HG       ARG  54 -10.236  14.847  14.847
  400   1HD   ARG  54          2HD       ARG  54 -10.208  17.104  17.104
  401   2HD   ARG  54          1HD       ARG  54 -11.292  17.637  17.637
  402    HE   ARG  54           HE       ARG  54 -12.638  15.636  15.636
  403   1HH1  ARG  54          2HH1      ARG  54 -11.259  18.727  18.727
  404   2HH1  ARG  54          1HH1      ARG  54 -12.405  19.033  19.033
  405   1HH2  ARG  54          1HH2      ARG  54 -14.147  16.037  16.037
  406   2HH2  ARG  54          2HH2      ARG  54 -14.046  17.506  17.506
  407    H    LYS  55           H        LYS  55 -10.838  13.236  13.236
  408    HA   LYS  55           HA       LYS  55  -9.185  11.784  11.784
  409   1HB   LYS  55          2HB       LYS  55 -11.827  12.061  12.061
  410   2HB   LYS  55          1HB       LYS  55 -11.668  10.553  10.553
  411   1HG   LYS  55          2HG       LYS  55 -12.108   9.943   9.943
  412   2HG   LYS  55          1HG       LYS  55 -10.381   9.669   9.669
  413   1HD   LYS  55          2HD       LYS  55 -10.258  12.170  12.170
  414   2HD   LYS  55          1HD       LYS  55 -11.783  11.707  11.707
  415   1HE   LYS  55          2HE       LYS  55  -9.286  10.047  10.047
  416   2HE   LYS  55          1HE       LYS  55  -9.666  11.348  11.348
  417   1HZ   LYS  55          2HZ       LYS  55 -11.939  10.037  10.037
  418   2HZ   LYS  55          1HZ       LYS  55 -10.938   8.741   8.741
  419   3HZ   LYS  55          3HZ       LYS  55 -10.630   9.626   9.626
  420    H    THR  56           H        THR  56  -7.499  11.533  11.533
  421    HA   THR  56           HA       THR  56  -7.963   9.463   9.463
  422    HB   THR  56           HB       THR  56  -5.171  10.066  10.066
  423    HG1  THR  56           HG1      THR  56  -5.213  12.178  12.178
  424   1HG2  THR  56          2HG2      THR  56  -6.060   9.016   9.016
  425   2HG2  THR  56          1HG2      THR  56  -6.592  10.642  10.642
  426   3HG2  THR  56          3HG2      THR  56  -4.880  10.318  10.318
  427    H    LEU  57           H        LEU  57  -7.267   7.354   7.354
  428    HA   LEU  57           HA       LEU  57  -5.823   6.328   6.328
  429   1HB   LEU  57          2HB       LEU  57  -8.704   5.894   5.894
  430   2HB   LEU  57          1HB       LEU  57  -7.779   4.458   4.458
  431    HG   LEU  57           HG       LEU  57  -7.494   6.871   6.871
  432   1HD1  LEU  57          2HD1      LEU  57 -10.005   5.921   5.921
  433   2HD1  LEU  57          1HD1      LEU  57  -9.560   5.018   5.018
  434   3HD1  LEU  57          3HD1      LEU  57  -9.532   6.781   6.781
  435   1HD2  LEU  57          2HD2      LEU  57  -7.004   3.966   3.966
  436   2HD2  LEU  57          1HD2      LEU  57  -6.107   5.306   5.306
  437   3HD2  LEU  57          3HD2      LEU  57  -7.587   4.732   4.732
  438    H    THR  58           H        THR  58  -4.187   5.491   5.491
  439    HA   THR  58           HA       THR  58  -4.655   4.066   4.066
  440    HB   THR  58           HB       THR  58  -2.114   4.433   4.433
  441    HG1  THR  58           HG1      THR  58  -3.283   6.336   6.336
  442   1HG2  THR  58          3HG2      THR  58  -2.292   2.583   2.583
  443   2HG2  THR  58          2HG2      THR  58  -2.155   3.957   3.957
  444   3HG2  THR  58          1HG2      THR  58  -0.884   3.642   3.642
  445    H    THR  59           H        THR  59  -5.286   2.002   2.002
  446    HA   THR  59           HA       THR  59  -4.755   0.309   0.309
  447    HB   THR  59           HB       THR  59  -6.120  -1.296  -1.296
  448    HG1  THR  59           HG1      THR  59  -7.151   1.319   1.319
  449   1HG2  THR  59          2HG2      THR  59  -6.683   0.014   0.014
  450   2HG2  THR  59          1HG2      THR  59  -8.041   0.346   0.346
  451   3HG2  THR  59          3HG2      THR  59  -7.565  -1.319  -1.319
  452    H    VAL  60           H        VAL  60  -4.261  -2.075  -2.075
  453    HA   VAL  60           HA       VAL  60  -2.339  -2.270  -2.270
  454    HB   VAL  60           HB       VAL  60  -1.704  -3.027  -3.027
  455   1HG1  VAL  60          2HG1      VAL  60  -0.349  -3.629  -3.629
  456   2HG1  VAL  60          1HG1      VAL  60   0.611  -3.423  -3.423
  457   3HG1  VAL  60          3HG1      VAL  60  -0.627  -4.677  -4.677
  458   1HG2  VAL  60          3HG2      VAL  60  -0.913  -0.770  -0.770
  459   2HG2  VAL  60          2HG2      VAL  60  -1.307  -0.770  -0.770
  460   3HG2  VAL  60          1HG2      VAL  60   0.251  -1.389  -1.389
  461    H    GLN  61           H        GLN  61  -2.831  -3.981  -3.981
  462    HA   GLN  61           HA       GLN  61  -4.041  -6.314  -6.314
  463   1HB   GLN  61          2HB       GLN  61  -5.155  -4.782  -4.782
  464   2HB   GLN  61          1HB       GLN  61  -4.432  -6.104  -6.104
  465   1HG   GLN  61          2HG       GLN  61  -5.641  -7.515  -7.515
  466   2HG   GLN  61          1HG       GLN  61  -6.703  -6.109  -6.109
  467   1HE2  GLN  61          2HE2      GLN  61  -7.215  -6.775  -6.775
  468   2HE2  GLN  61          1HE2      GLN  61  -6.369  -5.550  -5.550
  469    H    GLY  62           H        GLY  62  -3.463  -8.395  -8.395
  470   1HA   GLY  62          2HA       GLY  62  -2.136  -9.859  -9.859
  471   2HA   GLY  62          1HA       GLY  62  -1.088  -8.499  -8.499
  472    H    ILE  63           H        ILE  63  -1.076  -7.688  -7.688
  473    HA   ILE  63           HA       ILE  63   1.254  -9.148  -9.148
  474    HB   ILE  63           HB       ILE  63  -0.375  -7.048  -7.048
  475   1HG1  ILE  63          2HG1      ILE  63   0.771  -5.881  -5.881
  476   2HG1  ILE  63          1HG1      ILE  63   1.999  -5.898  -5.898
  477   1HG2  ILE  63          2HG2      ILE  63   1.728  -8.785  -8.785
  478   2HG2  ILE  63          1HG2      ILE  63   1.998  -7.065  -7.065
  479   3HG2  ILE  63          3HG2      ILE  63   0.514  -7.827  -7.827
  480   1HD1  ILE  63          3HD1      ILE  63   2.864  -8.011  -8.011
  481   2HD1  ILE  63          2HD1      ILE  63   1.864  -7.489  -7.489
  482   3HD1  ILE  63          1HD1      ILE  63   3.156  -6.446  -6.446
  483    H    ALA  64           H        ALA  64   1.571 -10.532 -10.532
  484    HA   ALA  64           HA       ALA  64  -0.729 -12.144 -12.144
  485   1HB   ALA  64          1HB       ALA  64   1.784 -12.841 -12.841
  486   2HB   ALA  64          3HB       ALA  64   1.921 -12.680 -12.680
  487   3HB   ALA  64          2HB       ALA  64   0.744 -13.795 -13.795
  488    H    ASP  65           H        ASP  65  -1.642 -12.367 -12.367
  489    HA   ASP  65           HA       ASP  65  -1.469 -10.187 -10.187
  490   1HB   ASP  65          2HB       ASP  65  -3.437 -11.814 -11.814
  491   2HB   ASP  65          1HB       ASP  65  -2.639 -12.855 -12.855
  492    H    ASP  66           H        ASP  66   0.490 -12.927 -12.927
  493    HA   ASP  66           HA       ASP  66   1.304 -12.945 -12.945
  494   1HB   ASP  66          2HB       ASP  66   1.917 -14.746 -14.746
  495   2HB   ASP  66          1HB       ASP  66   2.789 -14.863 -14.863
  496    H    TYR  67           H        TYR  67   1.906 -10.647 -10.647
  497    HA   TYR  67           HA       TYR  67   4.760 -10.830 -10.830
  498   1HB   TYR  67          2HB       TYR  67   2.616  -8.835  -8.835
  499   2HB   TYR  67          1HB       TYR  67   4.279  -8.267  -8.267
  500    HD1  TYR  67           HD1      TYR  67   3.843 -11.661 -11.661
  501    HD2  TYR  67           HD2      TYR  67   3.922  -7.586  -7.586
  502    HE1  TYR  67           HE1      TYR  67   4.177 -12.366 -12.366
  503    HE2  TYR  67           HE2      TYR  67   4.254  -8.273  -8.273
  504    HH   TYR  67           HH       TYR  67   3.575 -10.793 -10.793
  505    H    ASP  68           H        ASP  68   3.922 -11.132 -11.132
  506    HA   ASP  68           HA       ASP  68   4.792 -10.560 -10.560
  507   1HB   ASP  68          2HB       ASP  68   6.684  -9.586  -9.586
  508   2HB   ASP  68          1HB       ASP  68   5.996  -8.036  -8.036
  509    H    LYS  69           H        LYS  69   2.753  -8.606  -8.606
  510    HA   LYS  69           HA       LYS  69   1.090  -7.157  -7.157
  511   1HB   LYS  69          2HB       LYS  69   1.310  -8.897  -8.897
  512   2HB   LYS  69          1HB       LYS  69   1.099  -7.280  -7.280
  513   1HG   LYS  69          2HG       LYS  69  -0.820  -7.192  -7.192
  514   2HG   LYS  69          1HG       LYS  69  -0.762  -8.942  -8.942
  515   1HD   LYS  69          2HD       LYS  69  -2.344  -8.244  -8.244
  516   2HD   LYS  69          1HD       LYS  69  -0.868  -8.415  -8.415
  517   1HE   LYS  69          2HE       LYS  69  -0.476  -6.009  -6.009
  518   2HE   LYS  69          1HE       LYS  69  -1.941  -5.835  -5.835
  519   1HZ   LYS  69          3HZ       LYS  69  -3.006  -6.990  -6.990
  520   2HZ   LYS  69          2HZ       LYS  69  -1.660  -6.345  -6.345
  521   3HZ   LYS  69          1HZ       LYS  69  -2.733  -5.320  -5.320
  522    H    LYS  70           H        LYS  70   3.008  -6.771  -6.771
  523    HA   LYS  70           HA       LYS  70   2.853  -4.021  -4.021
  524   1HB   LYS  70          2HB       LYS  70   4.995  -5.907  -5.907
  525   2HB   LYS  70          1HB       LYS  70   4.986  -4.192  -4.192
  526   1HG   LYS  70          2HG       LYS  70   2.709  -6.053  -6.053
  527   2HG   LYS  70          1HG       LYS  70   4.021  -5.685  -5.685
  528   1HD   LYS  70          2HD       LYS  70   3.413  -3.384  -3.384
  529   2HD   LYS  70          1HD       LYS  70   2.285  -3.572  -3.572
  530   1HE   LYS  70          2HE       LYS  70   0.742  -3.738  -3.738
  531   2HE   LYS  70          1HE       LYS  70   1.313  -5.401  -5.401
  532   1HZ   LYS  70          1HZ       LYS  70   2.856  -4.676  -4.676
  533   2HZ   LYS  70          3HZ       LYS  70   2.220  -3.110  -3.110
  534   3HZ   LYS  70          2HZ       LYS  70   1.243  -4.393  -4.393
  535    H    LYS  71           H        LYS  71   5.790  -5.768  -5.768
  536    HA   LYS  71           HA       LYS  71   7.238  -3.663  -3.663
  537   1HB   LYS  71          2HB       LYS  71   7.725  -6.251  -6.251
  538   2HB   LYS  71          1HB       LYS  71   7.233  -6.190  -6.190
  539   1HG   LYS  71          2HG       LYS  71   9.589  -5.991  -5.991
  540   2HG   LYS  71          1HG       LYS  71   8.948  -4.393  -4.393
  541   1HD   LYS  71          2HD       LYS  71  10.089  -3.559  -3.559
  542   2HD   LYS  71          1HD       LYS  71   9.120  -4.545  -4.545
  543   1HE   LYS  71          2HE       LYS  71  10.781  -6.432  -6.432
  544   2HE   LYS  71          1HE       LYS  71  11.816  -5.105  -5.105
  545   1HZ   LYS  71          3HZ       LYS  71  10.642  -5.301  -5.301
  546   2HZ   LYS  71          2HZ       LYS  71  12.193  -5.848  -5.848
  547   3HZ   LYS  71          1HZ       LYS  71  11.817  -4.205  -4.205
  548    H    LEU  72           H        LEU  72   4.413  -5.085  -5.085
  549    HA   LEU  72           HA       LEU  72   4.793  -4.132  -4.132
  550   1HB   LEU  72          2HB       LEU  72   3.138  -5.913  -5.913
  551   2HB   LEU  72          1HB       LEU  72   2.073  -4.536  -4.536
  552    HG   LEU  72           HG       LEU  72   3.139  -5.701  -5.701
  553   1HD1  LEU  72          2HD1      LEU  72   0.406  -5.169  -5.169
  554   2HD1  LEU  72          1HD1      LEU  72   0.686  -5.586  -5.586
  555   3HD1  LEU  72          3HD1      LEU  72   1.129  -6.722  -6.722
  556   1HD2  LEU  72          2HD2      LEU  72   3.448  -3.259  -3.259
  557   2HD2  LEU  72          1HD2      LEU  72   2.198  -3.811  -3.811
  558   3HD2  LEU  72          3HD2      LEU  72   1.746  -3.043  -3.043
  559    H    VAL  73           H        VAL  73   2.289  -3.007  -3.007
  560    HA   VAL  73           HA       VAL  73   2.333  -0.408  -0.408
  561    HB   VAL  73           HB       VAL  73   0.409   0.065   0.065
  562   1HG1  VAL  73          3HG1      VAL  73   0.324  -1.880  -1.880
  563   2HG1  VAL  73          2HG1      VAL  73  -1.148  -1.406  -1.406
  564   3HG1  VAL  73          1HG1      VAL  73  -0.166  -0.186  -0.186
  565   1HG2  VAL  73          3HG2      VAL  73   0.961  -1.869  -1.869
  566   2HG2  VAL  73          2HG2      VAL  73  -0.719  -1.812  -1.812
  567   3HG2  VAL  73          1HG2      VAL  73   0.403  -2.943  -2.943
  568    H    LYS  74           H        LYS  74   2.903  -1.784  -1.784
  569    HA   LYS  74           HA       LYS  74   3.227   0.504   0.504
  570   1HB   LYS  74          2HB       LYS  74   3.470  -2.041  -2.041
  571   2HB   LYS  74          1HB       LYS  74   5.180  -1.735  -1.735
  572   1HG   LYS  74          2HG       LYS  74   4.871  -1.445  -1.445
  573   2HG   LYS  74          1HG       LYS  74   4.943   0.191   0.191
  574   1HD   LYS  74          2HD       LYS  74   2.463   0.240   0.240
  575   2HD   LYS  74          1HD       LYS  74   2.458  -1.345  -1.345
  576   1HE   LYS  74          2HE       LYS  74   4.012  -0.134  -0.134
  577   2HE   LYS  74          1HE       LYS  74   3.238   1.315   1.315
  578   1HZ   LYS  74          3HZ       LYS  74   1.073   0.253   0.253
  579   2HZ   LYS  74          2HZ       LYS  74   1.896  -1.014  -1.014
  580   3HZ   LYS  74          1HZ       LYS  74   2.005   0.556   0.556
  581    H    ALA  75           H        ALA  75   5.535  -1.052  -1.052
  582    HA   ALA  75           HA       ALA  75   7.679   0.744   0.744
  583   1HB   ALA  75          1HB       ALA  75   8.020  -1.547  -1.547
  584   2HB   ALA  75          3HB       ALA  75   7.340  -1.022  -1.022
  585   3HB   ALA  75          2HB       ALA  75   8.841  -0.309  -0.309
  586    H    PHE  76           H        PHE  76   5.049   0.671   0.671
  587    HA   PHE  76           HA       PHE  76   5.941   2.542   2.542
  588   1HB   PHE  76          2HB       PHE  76   3.797   1.072   1.072
  589   2HB   PHE  76          1HB       PHE  76   3.069   2.420   2.420
  590    HD1  PHE  76           HD1      PHE  76   4.584   1.363   1.363
  591    HD2  PHE  76           HD2      PHE  76   2.484   4.433   4.433
  592    HE1  PHE  76           HE1      PHE  76   4.138   2.489   2.489
  593    HE2  PHE  76           HE2      PHE  76   2.033   5.565   5.565
  594    HZ   PHE  76           HZ       PHE  76   2.859   4.592   4.592
  595    H    LYS  77           H        LYS  77   4.313   2.996   2.996
  596    HA   LYS  77           HA       LYS  77   4.047   5.818   5.818
  597   1HB   LYS  77          2HB       LYS  77   3.776   3.832   3.832
  598   2HB   LYS  77          1HB       LYS  77   3.905   5.536   5.536
  599   1HG   LYS  77          2HG       LYS  77   1.999   5.896   5.896
  600   2HG   LYS  77          1HG       LYS  77   1.770   4.148   4.148
  601   1HD   LYS  77          2HD       LYS  77   1.802   5.961   5.961
  602   2HD   LYS  77          1HD       LYS  77   0.331   5.470   5.470
  603   1HE   LYS  77          2HE       LYS  77   0.395   3.373   3.373
  604   2HE   LYS  77          1HE       LYS  77   2.155   3.288   3.288
  605   1HZ   LYS  77          3HZ       LYS  77   0.748   4.942   4.942
  606   2HZ   LYS  77          2HZ       LYS  77   1.099   3.310   3.310
  607   3HZ   LYS  77          1HZ       LYS  77   2.355   4.414   4.414
  608    H    LYS  78           H        LYS  78   6.716   3.815   3.815
  609    HA   LYS  78           HA       LYS  78   8.187   5.830   5.830
  610   1HB   LYS  78          2HB       LYS  78   8.296   3.277   3.277
  611   2HB   LYS  78          1HB       LYS  78   9.323   3.248   3.248
  612   1HG   LYS  78          2HG       LYS  78  11.013   4.464   4.464
  613   2HG   LYS  78          1HG       LYS  78   9.935   5.056   5.056
  614   1HD   LYS  78          2HD       LYS  78  10.231   3.228   3.228
  615   2HD   LYS  78          1HD       LYS  78  10.155   2.138   2.138
  616   1HE   LYS  78          2HE       LYS  78  12.490   2.927   2.927
  617   2HE   LYS  78          1HE       LYS  78  12.523   3.696   3.696
  618   1HZ   LYS  78          3HZ       LYS  78  11.758   0.883   0.883
  619   2HZ   LYS  78          2HZ       LYS  78  13.381   1.241   1.241
  620   3HZ   LYS  78          1HZ       LYS  78  12.674   1.720   1.720
  621    H    LYS  79           H        LYS  79   7.710   4.803   4.803
  622    HA   LYS  79           HA       LYS  79  10.181   6.071   6.071
  623   1HB   LYS  79          2HB       LYS  79   8.882   3.784   3.784
  624   2HB   LYS  79          1HB       LYS  79   8.414   4.953   4.953
  625   1HG   LYS  79          2HG       LYS  79  10.946   5.493   5.493
  626   2HG   LYS  79          1HG       LYS  79  11.129   3.924   3.924
  627   1HD   LYS  79          2HD       LYS  79  10.872   2.896   2.896
  628   2HD   LYS  79          1HD       LYS  79   9.288   3.644   3.644
  629   1HE   LYS  79          2HE       LYS  79  11.965   4.649   4.649
  630   2HE   LYS  79          1HE       LYS  79  10.541   4.274   4.274
  631   1HZ   LYS  79          1HZ       LYS  79   9.610   6.173   6.173
  632   2HZ   LYS  79          3HZ       LYS  79  11.207   6.687   6.687
  633   3HZ   LYS  79          2HZ       LYS  79  10.196   6.467   6.467
  634    H    PHE  80           H        PHE  80   6.663   6.242   6.242
  635    HA   PHE  80           HA       PHE  80   7.068   8.934   8.934
  636   1HB   PHE  80          2HB       PHE  80   4.579   7.425   7.425
  637   2HB   PHE  80          1HB       PHE  80   5.465   8.586   8.586
  638    HD1  PHE  80           HD1      PHE  80   5.367   5.089   5.089
  639    HD2  PHE  80           HD2      PHE  80   7.139   7.886   7.886
  640    HE1  PHE  80           HE1      PHE  80   6.384   3.239   3.239
  641    HE2  PHE  80           HE2      PHE  80   8.160   6.038   6.038
  642    HZ   PHE  80           HZ       PHE  80   7.784   3.710   3.710
  643    H    ALA  81           H        ALA  81   5.748   7.213   7.213
  644    HA   ALA  81           HA       ALA  81   4.458   7.832   7.832
  645   1HB   ALA  81          3HB       ALA  81   5.334  10.416  10.416
  646   2HB   ALA  81          2HB       ALA  81   3.951  10.467  10.467
  647   3HB   ALA  81          1HB       ALA  81   5.482   9.784   9.784
  648    H    CYS  82           H        CYS  82   3.142   6.754   6.754
  649    HA   CYS  82           HA       CYS  82   0.663   8.338   8.338
  650   1HB   CYS  82          2HB       CYS  82   2.114   6.667   6.667
  651   2HB   CYS  82          1HB       CYS  82   0.366   6.460   6.460
  652    HG   CYS  82           HG       CYS  82   0.060   8.732   8.732
  653    H    ASN  83           H        ASN  83  -1.237   7.450   7.450
  654    HA   ASN  83           HA       ASN  83  -1.206   5.317   5.317
  655   1HB   ASN  83          2HB       ASN  83  -3.226   7.095   7.095
  656   2HB   ASN  83          1HB       ASN  83  -3.843   5.516   5.516
  657   1HD2  ASN  83          2HD2      ASN  83  -2.745   6.084   6.084
  658   2HD2  ASN  83          1HD2      ASN  83  -2.432   4.930   4.930
  659    H    GLY  84           H        GLY  84  -0.641   3.325   3.325
  660   1HA   GLY  84          2HA       GLY  84  -1.809   2.250   2.250
  661   2HA   GLY  84          1HA       GLY  84  -0.401   1.601   1.601
  662    H    THR  85           H        THR  85  -3.659   1.191   1.191
  663    HA   THR  85           HA       THR  85  -3.992  -0.455  -0.455
  664    HB   THR  85           HB       THR  85  -6.364  -0.182  -0.182
  665    HG1  THR  85           HG1      THR  85  -5.742   0.988   0.988
  666   1HG2  THR  85          1HG2      THR  85  -4.664   2.148   2.148
  667   2HG2  THR  85          3HG2      THR  85  -6.258   2.526   2.526
  668   3HG2  THR  85          2HG2      THR  85  -6.111   1.754   1.754
  669    H    VAL  86           H        VAL  86  -4.887  -2.539  -2.539
  670    HA   VAL  86           HA       VAL  86  -4.478  -3.764  -3.764
  671    HB   VAL  86           HB       VAL  86  -3.119  -4.688  -4.688
  672   1HG1  VAL  86          1HG1      VAL  86  -5.387  -4.337  -4.337
  673   2HG1  VAL  86          3HG1      VAL  86  -5.252  -6.088  -6.088
  674   3HG1  VAL  86          2HG1      VAL  86  -3.904  -5.156  -5.156
  675   1HG2  VAL  86          3HG2      VAL  86  -4.175  -6.076  -6.076
  676   2HG2  VAL  86          2HG2      VAL  86  -3.393  -6.914  -6.914
  677   3HG2  VAL  86          1HG2      VAL  86  -5.151  -6.790  -6.790
  678    H    ILE  87           H        ILE  87  -6.718  -2.698  -2.698
  679    HA   ILE  87           HA       ILE  87  -9.010  -3.850  -3.850
  680    HB   ILE  87           HB       ILE  87 -10.292  -2.818  -2.818
  681   1HG1  ILE  87          2HG1      ILE  87  -7.612  -2.001  -2.001
  682   2HG1  ILE  87          1HG1      ILE  87  -8.627  -3.277  -3.277
  683   1HG2  ILE  87          2HG2      ILE  87  -9.477  -1.507  -1.507
  684   2HG2  ILE  87          1HG2      ILE  87  -8.157  -0.924  -0.924
  685   3HG2  ILE  87          3HG2      ILE  87  -9.827  -0.546  -0.546
  686   1HD1  ILE  87          2HD1      ILE  87 -10.399  -1.615  -1.615
  687   2HD1  ILE  87          1HD1      ILE  87  -9.309  -0.354  -0.354
  688   3HD1  ILE  87          3HD1      ILE  87  -8.913  -1.264  -1.264
  689    H    GLU  88           H        GLU  88 -10.616  -5.185  -5.185
  690    HA   GLU  88           HA       GLU  88  -9.442  -7.141  -7.141
  691   1HB   GLU  88          2HB       GLU  88 -10.166  -7.816  -7.816
  692   2HB   GLU  88          1HB       GLU  88 -11.803  -7.712  -7.712
  693   1HG   GLU  88          2HG       GLU  88 -11.176  -9.335  -9.335
  694   2HG   GLU  88          1HG       GLU  88  -9.593  -9.490  -9.490
  695    H    HIS  89           H        HIS  89 -10.126  -5.557  -5.557
  696    HA   HIS  89           HA       HIS  89 -12.741  -4.796  -4.796
  697   1HB   HIS  89          2HB       HIS  89 -10.424  -4.250  -4.250
  698   2HB   HIS  89          1HB       HIS  89 -10.999  -5.464  -5.464
  699    HD1  HIS  89           HD1      HIS  89 -12.644  -4.708  -4.708
  700    HD2  HIS  89           HD2      HIS  89 -12.230  -1.979  -1.979
  701    HE1  HIS  89           HE1      HIS  89 -13.970  -2.693  -2.693
  702    HE2  HIS  89           HE2      HIS  89 -13.792  -1.094  -1.094
  703    HA   PRO  90           HA       PRO  90 -14.649  -8.586  -8.586
  704   1HB   PRO  90          2HB       PRO  90 -16.959  -7.620  -7.620
  705   2HB   PRO  90          1HB       PRO  90 -16.563  -7.540  -7.540
  706   1HG   PRO  90          2HG       PRO  90 -16.401  -5.401  -5.401
  707   2HG   PRO  90          1HG       PRO  90 -16.964  -5.292  -5.292
  708   1HD   PRO  90          2HD       PRO  90 -14.452  -4.542  -4.542
  709   2HD   PRO  90          1HD       PRO  90 -14.851  -4.991  -4.991
  710    H    GLU  91           H        GLU  91 -14.106  -5.953  -5.953
  711    HA   GLU  91           HA       GLU  91 -14.806  -7.518  -7.518
  712   1HB   GLU  91          2HB       GLU  91 -13.345  -4.882  -4.882
  713   2HB   GLU  91          1HB       GLU  91 -14.262  -5.581  -5.581
  714   1HG   GLU  91          2HG       GLU  91 -16.257  -5.447  -5.447
  715   2HG   GLU  91          1HG       GLU  91 -15.243  -4.274  -4.274
  716    H    TYR  92           H        TYR  92 -12.005  -6.955  -6.955
  717    HA   TYR  92           HA       TYR  92 -10.340  -8.260  -8.260
  718   1HB   TYR  92          2HB       TYR  92  -9.201  -6.569  -6.569
  719   2HB   TYR  92          1HB       TYR  92  -8.479  -7.000  -7.000
  720    HD1  TYR  92           HD2      TYR  92 -10.854  -6.315  -6.315
  721    HD2  TYR  92           HD1      TYR  92  -8.997  -4.212  -4.212
  722    HE1  TYR  92           HE2      TYR  92 -11.637  -4.191  -4.191
  723    HE2  TYR  92           HE1      TYR  92  -9.777  -2.080  -2.080
  724    HH   TYR  92           HH       TYR  92 -12.127  -1.876  -1.876
  725    H    GLY  93           H        GLY  93 -10.729  -7.842  -7.842
  726   1HA   GLY  93          2HA       GLY  93 -10.867  -9.631  -9.631
  727   2HA   GLY  93          1HA       GLY  93 -10.145 -10.688 -10.688
  728    H    GLU  94           H        GLU  94  -9.577  -8.527  -8.527
  729    HA   GLU  94           HA       GLU  94  -7.756  -8.151  -8.151
  730   1HB   GLU  94          2HB       GLU  94  -7.521 -10.755 -10.755
  731   2HB   GLU  94          1HB       GLU  94  -6.022 -10.118 -10.118
  732   1HG   GLU  94          2HG       GLU  94  -5.181 -10.446 -10.446
  733   2HG   GLU  94          1HG       GLU  94  -6.080  -9.003  -9.003
  734    H    VAL  95           H        VAL  95  -7.417  -6.097  -6.097
  735    HA   VAL  95           HA       VAL  95  -4.957  -5.905  -5.905
  736    HB   VAL  95           HB       VAL  95  -5.950  -4.054  -4.054
  737   1HG1  VAL  95          3HG1      VAL  95  -6.805  -6.899  -6.899
  738   2HG1  VAL  95          2HG1      VAL  95  -7.462  -5.714  -5.714
  739   3HG1  VAL  95          1HG1      VAL  95  -5.720  -5.960  -5.960
  740   1HG2  VAL  95          3HG2      VAL  95  -8.024  -4.176  -4.176
  741   2HG2  VAL  95          2HG2      VAL  95  -8.071  -3.366  -3.366
  742   3HG2  VAL  95          1HG2      VAL  95  -8.689  -5.010  -5.010
  743    H    ILE  96           H        ILE  96  -3.660  -4.228  -4.228
  744    HA   ILE  96           HA       ILE  96  -4.267  -2.880  -2.880
  745    HB   ILE  96           HB       ILE  96  -1.970  -2.704  -2.704
  746   1HG1  ILE  96          2HG1      ILE  96  -2.322  -4.616  -4.616
  747   2HG1  ILE  96          1HG1      ILE  96  -0.743  -3.837  -3.837
  748   1HG2  ILE  96          1HG2      ILE  96  -2.393  -1.008  -1.008
  749   2HG2  ILE  96          3HG2      ILE  96  -0.842  -1.199  -1.199
  750   3HG2  ILE  96          2HG2      ILE  96  -2.201  -0.453  -0.453
  751   1HD1  ILE  96          2HD1      ILE  96  -2.411  -2.490  -2.490
  752   2HD1  ILE  96          1HD1      ILE  96  -2.495  -4.226  -4.226
  753   3HD1  ILE  96          3HD1      ILE  96  -0.932  -3.409  -3.409
  754    H    GLN  97           H        GLN  97  -4.548  -0.632  -0.632
  755    HA   GLN  97           HA       GLN  97  -5.333   0.886   0.886
  756   1HB   GLN  97          2HB       GLN  97  -7.134  -0.102  -0.102
  757   2HB   GLN  97          1HB       GLN  97  -6.841   1.508   1.508
  758   1HG   GLN  97          2HG       GLN  97  -7.194   2.109   2.109
  759   2HG   GLN  97          1HG       GLN  97  -8.198   0.667   0.667
  760   1HE2  GLN  97          2HE2      GLN  97 -10.058   2.387   2.387
  761   2HE2  GLN  97          1HE2      GLN  97  -8.959   1.056   1.056
  762    H    LEU  98           H        LEU  98  -3.336   1.977   1.977
  763    HA   LEU  98           HA       LEU  98  -2.420   3.356   3.356
  764   1HB   LEU  98          2HB       LEU  98  -1.728   3.873   3.873
  765   2HB   LEU  98          1HB       LEU  98  -0.827   4.422   4.422
  766    HG   LEU  98           HG       LEU  98  -1.238   1.491   1.491
  767   1HD1  LEU  98          2HD1      LEU  98  -0.338   2.868   2.868
  768   2HD1  LEU  98          1HD1      LEU  98   1.172   2.602   2.602
  769   3HD1  LEU  98          3HD1      LEU  98   0.169   1.229   1.229
  770   1HD2  LEU  98          3HD2      LEU  98   0.244   3.201   3.201
  771   2HD2  LEU  98          2HD2      LEU  98   0.199   1.438   1.438
  772   3HD2  LEU  98          1HD2      LEU  98   1.397   2.297   2.297
  773    H    GLN  99           H        GLN  99  -2.266   5.684   5.684
  774    HA   GLN  99           HA       GLN  99  -4.728   6.979   6.979
  775   1HB   GLN  99          2HB       GLN  99  -2.982   7.196   7.196
  776   2HB   GLN  99          1HB       GLN  99  -3.449   8.760   8.760
  777   1HG   GLN  99          2HG       GLN  99  -5.763   7.130   7.130
  778   2HG   GLN  99          1HG       GLN  99  -4.948   6.992   6.992
  779   1HE2  GLN  99          2HE2      GLN  99  -6.840  10.398  10.398
  780   2HE2  GLN  99          1HE2      GLN  99  -6.670   9.057   9.057
  781    H    GLY 100           H        GLY 100  -4.772   8.925   8.925
  782   1HA   GLY 100          2HA       GLY 100  -3.977  10.660  10.660
  783   2HA   GLY 100          1HA       GLY 100  -2.363  10.326  10.326
  784    H    ASP 101           H        ASP 101  -2.370  10.969  10.969
  785    HA   ASP 101           HA       ASP 101  -2.776   8.686   8.686
  786   1HB   ASP 101          2HB       ASP 101  -1.851  10.116  10.116
  787   2HB   ASP 101          1HB       ASP 101  -3.140  10.926  10.926
  788    H    GLN 102           H        GLN 102  -1.465   7.062   7.062
  789    HA   GLN 102           HA       GLN 102   1.426   7.550   7.550
  790   1HB   GLN 102          2HB       GLN 102  -0.371   5.716   5.716
  791   2HB   GLN 102          1HB       GLN 102   1.166   5.029   5.029
  792   1HG   GLN 102          2HG       GLN 102   0.990   6.093   6.093
  793   2HG   GLN 102          1HG       GLN 102   2.392   6.476   6.476
  794   1HE2  GLN 102          2HE2      GLN 102  -0.490   9.374   9.374
  795   2HE2  GLN 102          1HE2      GLN 102  -0.917   7.722   7.722
  796    H    ARG 103           H        ARG 103  -0.700   6.824   6.824
  797    HA   ARG 103           HA       ARG 103  -0.188   4.370   4.370
  798   1HB   ARG 103          2HB       ARG 103  -0.641   5.422   5.422
  799   2HB   ARG 103          1HB       ARG 103  -1.824   5.834   5.834
  800   1HG   ARG 103          2HG       ARG 103  -1.334   8.013   8.013
  801   2HG   ARG 103          1HG       ARG 103   0.402   7.720   7.720
  802   1HD   ARG 103          2HD       ARG 103   0.190   8.446   8.446
  803   2HD   ARG 103          1HD       ARG 103  -0.455   6.836   6.836
  804    HE   ARG 103           HE       ARG 103  -2.643   8.231   8.231
  805   1HH1  ARG 103          2HH1      ARG 103  -0.148   8.816   8.816
  806   2HH1  ARG 103          1HH1      ARG 103  -1.189   9.703   9.703
  807   1HH2  ARG 103          1HH2      ARG 103  -4.015   9.396   9.396
  808   2HH2  ARG 103          2HH2      ARG 103  -3.385  10.032  10.032
  809    H    LYS 104           H        LYS 104   1.942   7.109   7.109
  810    HA   LYS 104           HA       LYS 104   3.865   5.812   5.812
  811   1HB   LYS 104          2HB       LYS 104   3.189   8.539   8.539
  812   2HB   LYS 104          1HB       LYS 104   4.891   8.272   8.272
  813   1HG   LYS 104          2HG       LYS 104   4.956   8.902   8.902
  814   2HG   LYS 104          1HG       LYS 104   4.910   7.142   7.142
  815   1HD   LYS 104          2HD       LYS 104   2.331   8.623   8.623
  816   2HD   LYS 104          1HD       LYS 104   3.301   8.686   8.686
  817   1HE   LYS 104          2HE       LYS 104   3.201   5.991   5.991
  818   2HE   LYS 104          1HE       LYS 104   1.562   6.635   6.635
  819   1HZ   LYS 104          1HZ       LYS 104   3.323   7.132   7.132
  820   2HZ   LYS 104          3HZ       LYS 104   2.747   5.554   5.554
  821   3HZ   LYS 104          2HZ       LYS 104   1.658   6.837   6.837
  822    H    ASN 105           H        ASN 105   3.281   6.562   6.562
  823    HA   ASN 105           HA       ASN 105   6.025   6.115   6.115
  824   1HB   ASN 105          2HB       ASN 105   3.458   6.684   6.684
  825   2HB   ASN 105          1HB       ASN 105   4.912   6.201   6.201
  826   1HD2  ASN 105          2HD2      ASN 105   4.431   9.964   9.964
  827   2HD2  ASN 105          1HD2      ASN 105   3.225   8.740   8.740
  828    H    ILE 106           H        ILE 106   2.951   4.351   4.351
  829    HA   ILE 106           HA       ILE 106   3.846   2.205   2.205
  830    HB   ILE 106           HB       ILE 106   1.459   2.670   2.670
  831   1HG1  ILE 106          2HG1      ILE 106   0.785   0.338   0.338
  832   2HG1  ILE 106          1HG1      ILE 106   2.345  -0.130  -0.130
  833   1HG2  ILE 106          2HG2      ILE 106   1.801   3.051   3.051
  834   2HG2  ILE 106          1HG2      ILE 106   1.961   1.305   1.305
  835   3HG2  ILE 106          3HG2      ILE 106   0.448   1.993   1.993
  836   1HD1  ILE 106          2HD1      ILE 106   2.510   1.334   1.334
  837   2HD1  ILE 106          1HD1      ILE 106   1.678  -0.218  -0.218
  838   3HD1  ILE 106          3HD1      ILE 106   3.327  -0.140  -0.140
  839    H    CYS 107           H        CYS 107   3.651   2.491   2.491
  840    HA   CYS 107           HA       CYS 107   4.770  -0.016  -0.016
  841   1HB   CYS 107          2HB       CYS 107   4.435   2.561   2.561
  842   2HB   CYS 107          1HB       CYS 107   5.648   1.456   1.456
  843    HG   CYS 107           HG       CYS 107   3.454   0.874   0.874
  844    H    GLN 108           H        GLN 108   6.122   3.045   3.045
  845    HA   GLN 108           HA       GLN 108   8.859   2.403   2.403
  846   1HB   GLN 108          2HB       GLN 108   8.430   4.693   4.693
  847   2HB   GLN 108          1HB       GLN 108   7.368   4.594   4.594
  848   1HG   GLN 108          2HG       GLN 108   9.127   5.603   5.603
  849   2HG   GLN 108          1HG       GLN 108   9.635   3.931   3.931
  850   1HE2  GLN 108          2HE2      GLN 108  12.362   4.103   4.103
  851   2HE2  GLN 108          1HE2      GLN 108  11.274   3.081   3.081
  852    H    PHE 109           H        PHE 109   6.633   2.074   2.074
  853    HA   PHE 109           HA       PHE 109   8.594   1.430   1.430
  854   1HB   PHE 109          2HB       PHE 109   6.392   2.343   2.343
  855   2HB   PHE 109          1HB       PHE 109   5.615   0.904   0.904
  856    HD1  PHE 109           HD1      PHE 109   8.153   1.928   1.928
  857    HD2  PHE 109           HD2      PHE 109   5.125  -0.849  -0.849
  858    HE1  PHE 109           HE1      PHE 109   8.354   0.842   0.842
  859    HE2  PHE 109           HE2      PHE 109   5.320  -1.941  -1.941
  860    HZ   PHE 109           HZ       PHE 109   6.937  -1.097  -1.097
  861    H    LEU 110           H        LEU 110   6.299  -0.451  -0.451
  862    HA   LEU 110           HA       LEU 110   6.888  -2.983  -2.983
  863   1HB   LEU 110          2HB       LEU 110   5.776  -1.932  -1.932
  864   2HB   LEU 110          1HB       LEU 110   6.264  -3.615  -3.615
  865    HG   LEU 110           HG       LEU 110   4.637  -4.166  -4.166
  866   1HD1  LEU 110          1HD1      LEU 110   4.462  -1.215  -1.215
  867   2HD1  LEU 110          3HD1      LEU 110   3.213  -2.339  -2.339
  868   3HD1  LEU 110          2HD1      LEU 110   4.864  -2.509  -2.509
  869   1HD2  LEU 110          1HD2      LEU 110   3.709  -3.780  -3.780
  870   2HD2  LEU 110          3HD2      LEU 110   2.540  -3.377  -3.377
  871   3HD2  LEU 110          2HD2      LEU 110   3.406  -2.093  -2.093
  872    H    VAL 111           H        VAL 111   8.618  -0.974  -0.974
  873    HA   VAL 111           HA       VAL 111  10.410  -3.146  -3.146
  874    HB   VAL 111           HB       VAL 111  10.438  -0.237  -0.237
  875   1HG1  VAL 111          2HG1      VAL 111  12.169  -2.566  -2.566
  876   2HG1  VAL 111          1HG1      VAL 111  11.821  -1.377  -1.377
  877   3HG1  VAL 111          3HG1      VAL 111  12.600  -0.873  -0.873
  878   1HG2  VAL 111          2HG2      VAL 111   8.531  -1.976  -1.976
  879   2HG2  VAL 111          1HG2      VAL 111   9.136  -0.746  -0.746
  880   3HG2  VAL 111          3HG2      VAL 111   9.736  -2.401  -2.401
  881    H    GLU 112           H        GLU 112  10.311  -0.344  -0.344
  882    HA   GLU 112           HA       GLU 112  13.117  -0.176  -0.176
  883   1HB   GLU 112          2HB       GLU 112  10.683   0.934   0.934
  884   2HB   GLU 112          1HB       GLU 112  12.272   1.100   1.100
  885   1HG   GLU 112          2HG       GLU 112  12.270   1.882   1.882
  886   2HG   GLU 112          1HG       GLU 112  11.113   2.804   2.804
  887    H    ILE 113           H        ILE 113  10.406  -1.618  -1.618
  888    HA   ILE 113           HA       ILE 113  12.173  -2.742  -2.742
  889    HB   ILE 113           HB       ILE 113  10.238  -3.499  -3.499
  890   1HG1  ILE 113          2HG1      ILE 113   8.702  -2.983  -2.983
  891   2HG1  ILE 113          1HG1      ILE 113   9.078  -4.559  -4.559
  892   1HG2  ILE 113          2HG2      ILE 113  10.657  -0.949  -0.949
  893   2HG2  ILE 113          1HG2      ILE 113   9.150  -1.006  -1.006
  894   3HG2  ILE 113          3HG2      ILE 113   9.175  -1.506  -1.506
  895   1HD1  ILE 113          1HD1      ILE 113   7.700  -2.919  -2.919
  896   2HD1  ILE 113          3HD1      ILE 113   6.790  -3.042  -3.042
  897   3HD1  ILE 113          2HD1      ILE 113   7.272  -4.504  -4.504
  898    H    GLY 114           H        GLY 114  10.856  -3.697  -3.697
  899   1HA   GLY 114          2HA       GLY 114  11.467  -5.610  -5.610
  900   2HA   GLY 114          1HA       GLY 114  12.093  -6.318  -6.318
  901    H    LEU 115           H        LEU 115   8.919  -4.892  -4.892
  902    HA   LEU 115           HA       LEU 115   7.677  -7.297  -7.297
  903   1HB   LEU 115          2HB       LEU 115   7.081  -4.661  -4.661
  904   2HB   LEU 115          1HB       LEU 115   5.985  -5.130  -5.130
  905    HG   LEU 115           HG       LEU 115   4.874  -6.709  -6.709
  906   1HD1  LEU 115          2HD1      LEU 115   7.280  -6.382  -6.382
  907   2HD1  LEU 115          1HD1      LEU 115   5.745  -6.623  -6.623
  908   3HD1  LEU 115          3HD1      LEU 115   6.313  -7.817  -7.817
  909   1HD2  LEU 115          3HD2      LEU 115   4.558  -4.134  -4.134
  910   2HD2  LEU 115          2HD2      LEU 115   3.779  -5.255  -5.255
  911   3HD2  LEU 115          1HD2      LEU 115   5.260  -4.425  -4.425
  912    H    ALA 116           H        ALA 116   6.833  -5.301  -5.301
  913    HA   ALA 116           HA       ALA 116   5.863  -7.695  -7.695
  914   1HB   ALA 116          3HB       ALA 116   4.513  -5.576  -5.576
  915   2HB   ALA 116          2HB       ALA 116   5.699  -4.854  -4.854
  916   3HB   ALA 116          1HB       ALA 116   4.748  -6.241  -6.241
  917    H    LYS 117           H        LYS 117   6.201  -7.084  -7.084
  918    HA   LYS 117           HA       LYS 117   9.132  -7.064  -7.064
  919   1HB   LYS 117          2HB       LYS 117   7.004  -8.756  -8.756
  920   2HB   LYS 117          1HB       LYS 117   8.386  -8.337  -8.337
  921   1HG   LYS 117          2HG       LYS 117   9.169  -9.258  -9.258
  922   2HG   LYS 117          1HG       LYS 117   8.219 -10.452 -10.452
  923   1HD   LYS 117          2HD       LYS 117  10.330 -10.968 -10.968
  924   2HD   LYS 117          1HD       LYS 117   9.839  -9.802  -9.802
  925   1HE   LYS 117          2HE       LYS 117  11.316  -8.242  -8.242
  926   2HE   LYS 117          1HE       LYS 117  11.118  -8.667  -8.667
  927   1HZ   LYS 117          2HZ       LYS 117  12.524 -10.509 -10.509
  928   2HZ   LYS 117          1HZ       LYS 117  13.340  -9.167  -9.167
  929   3HZ   LYS 117          3HZ       LYS 117  12.686 -10.327 -10.327
  930    H    ASP 118           H        ASP 118  10.022  -5.893  -5.893
  931    HA   ASP 118           HA       ASP 118   8.812  -3.517  -3.517
  932   1HB   ASP 118          2HB       ASP 118  10.571  -3.280  -3.280
  933   2HB   ASP 118          1HB       ASP 118  11.229  -3.901  -3.901
  934    H    ASP 119           H        ASP 119   8.595  -6.653  -6.653
  935    HA   ASP 119           HA       ASP 119   7.359  -5.670  -5.670
  936   1HB   ASP 119          2HB       ASP 119   8.007  -8.365  -8.365
  937   2HB   ASP 119          1HB       ASP 119   6.805  -8.252  -8.252
  938    H    GLN 120           H        GLN 120   6.356  -6.794  -6.794
  939    HA   GLN 120           HA       GLN 120   3.602  -7.180  -7.180
  940   1HB   GLN 120          2HB       GLN 120   4.983  -7.066  -7.066
  941   2HB   GLN 120          1HB       GLN 120   3.268  -7.389  -7.389
  942   1HG   GLN 120          2HG       GLN 120   3.833  -9.384  -9.384
  943   2HG   GLN 120          1HG       GLN 120   5.542  -9.075  -9.075
  944   1HE2  GLN 120          2HE2      GLN 120   3.222 -10.006 -10.006
  945   2HE2  GLN 120          1HE2      GLN 120   2.626  -8.964  -8.964
  946    H    LEU 121           H        LEU 121   5.514  -4.493  -4.493
  947    HA   LEU 121           HA       LEU 121   3.973  -2.802  -2.802
  948   1HB   LEU 121          2HB       LEU 121   5.721  -2.222  -2.222
  949   2HB   LEU 121          1HB       LEU 121   4.975  -0.953  -0.953
  950    HG   LEU 121           HG       LEU 121   6.794  -3.026  -3.026
  951   1HD1  LEU 121          3HD1      LEU 121   7.440  -0.422  -0.422
  952   2HD1  LEU 121          2HD1      LEU 121   8.443  -1.047  -1.047
  953   3HD1  LEU 121          1HD1      LEU 121   8.236  -1.987  -1.987
  954   1HD2  LEU 121          2HD2      LEU 121   5.101  -1.494  -1.494
  955   2HD2  LEU 121          1HD2      LEU 121   6.731  -1.779  -1.779
  956   3HD2  LEU 121          3HD2      LEU 121   6.358  -0.282  -0.282
  957    H    LYS 122           H        LYS 122   1.780  -3.108  -3.108
  958    HA   LYS 122           HA       LYS 122   0.747  -2.154  -2.154
  959   1HB   LYS 122          2HB       LYS 122  -0.133  -4.251  -4.251
  960   2HB   LYS 122          1HB       LYS 122  -1.413  -3.291  -3.291
  961   1HG   LYS 122          2HG       LYS 122   0.724  -4.712  -4.712
  962   2HG   LYS 122          1HG       LYS 122  -0.875  -5.380  -5.380
  963   1HD   LYS 122          2HD       LYS 122  -1.888  -4.048  -4.048
  964   2HD   LYS 122          1HD       LYS 122  -0.847  -2.670  -2.670
  965   1HE   LYS 122          2HE       LYS 122   0.457  -3.112  -3.112
  966   2HE   LYS 122          1HE       LYS 122   0.665  -4.787  -4.787
  967   1HZ   LYS 122          3HZ       LYS 122  -1.772  -4.937  -4.937
  968   2HZ   LYS 122          2HZ       LYS 122  -1.212  -3.650  -3.650
  969   3HZ   LYS 122          1HZ       LYS 122  -0.400  -5.134  -5.134
  970    H    VAL 123           H        VAL 123   1.012   0.047   0.047
  971    HA   VAL 123           HA       VAL 123  -0.594   0.948   0.948
  972    HB   VAL 123           HB       VAL 123   1.668   1.875   1.875
  973   1HG1  VAL 123          2HG1      VAL 123   1.196   1.902   1.902
  974   2HG1  VAL 123          1HG1      VAL 123   0.793   3.579   3.579
  975   3HG1  VAL 123          3HG1      VAL 123   2.392   2.948   2.948
  976   1HG2  VAL 123          3HG2      VAL 123  -0.583   3.863   3.863
  977   2HG2  VAL 123          2HG2      VAL 123   0.040   3.175   3.175
  978   3HG2  VAL 123          1HG2      VAL 123   1.051   4.252   4.252
  979    H    HIS 124           H        HIS 124  -2.604   1.637   1.637
  980    HA   HIS 124           HA       HIS 124  -3.461   2.850   2.850
  981   1HB   HIS 124          2HB       HIS 124  -5.207   0.984   0.984
  982   2HB   HIS 124          1HB       HIS 124  -5.535   1.654   1.654
  983    HD1  HIS 124           HD1      HIS 124  -4.797   0.301   0.301
  984    HD2  HIS 124           HD2      HIS 124  -3.078  -0.994  -0.994
  985    HE1  HIS 124           HE1      HIS 124  -3.591  -1.828  -1.828
  986    HE2  HIS 124           HE2      HIS 124  -2.691  -2.668  -2.668
  987    H    GLY 125           H        GLY 125  -2.587   4.155   4.155
  988   1HA   GLY 125          2HA       GLY 125  -4.525   4.884   4.884
  989   2HA   GLY 125          1HA       GLY 125  -3.204   5.924   5.924
  990    H    PHE 126           HN       PHE 126  -6.564   5.132   5.132
  991    HA   PHE 126           HA       PHE 126  -8.311   6.283   6.283
  992   1HB   PHE 126          2HB       PHE 126  -6.599   8.185   8.185
  993   2HB   PHE 126          1HB       PHE 126  -7.072   8.857   8.857
  994    HD1  PHE 126           HD1      PHE 126  -9.823   7.798   7.798
  995    HD2  PHE 126           HD2      PHE 126  -7.747   9.457   9.457
  996    HE1  PHE 126           HE1      PHE 126 -11.967   8.510   8.510
  997    HE2  PHE 126           HE2      PHE 126  -9.892  10.172  10.172
  998    HZ   PHE 126           HZ       PHE 126 -12.003   9.699   9.699

  Start of MODEL   23
    1   1H    MET   1          2H        MET   1  43.816   0.353   0.353
    2   2H    MET   1          1H        MET   1  43.757   0.653   0.653
    3   3H    MET   1          3H        MET   1  42.827   1.613   1.613
    4    HA   MET   1           HA       MET   1  41.414  -0.125  -0.125
    5   1HB   MET   1          2HB       MET   1  42.060   0.430   0.430
    6   2HB   MET   1          1HB       MET   1  40.985  -0.927  -0.927
    7   1HG   MET   1          2HG       MET   1  40.511   1.809   1.809
    8   2HG   MET   1          1HG       MET   1  39.892   1.302   1.302
    9   1HE   MET   1          2HE       MET   1  39.997   1.169   1.169
   10   2HE   MET   1          1HE       MET   1  38.270   1.500   1.500
   11   3HE   MET   1          3HE       MET   1  38.899  -0.092  -0.092
   12    H    ARG   2           H        ARG   2  42.450  -1.767  -1.767
   13    HA   ARG   2           HA       ARG   2  43.508  -4.009  -4.009
   14   1HB   ARG   2          2HB       ARG   2  44.791  -2.782  -2.782
   15   2HB   ARG   2          1HB       ARG   2  43.855  -3.912  -3.912
   16   1HG   ARG   2          2HG       ARG   2  45.262  -5.058  -5.058
   17   2HG   ARG   2          1HG       ARG   2  46.278  -4.461  -4.461
   18   1HD   ARG   2          2HD       ARG   2  43.941  -6.131  -6.131
   19   2HD   ARG   2          1HD       ARG   2  45.296  -6.941  -6.941
   20    HE   ARG   2           HE       ARG   2  46.458  -5.471  -5.471
   21   1HH1  ARG   2          2HH1      ARG   2  43.911  -7.855  -7.855
   22   2HH1  ARG   2          1HH1      ARG   2  44.237  -8.438  -8.438
   23   1HH2  ARG   2          1HH2      ARG   2  46.888  -6.237  -6.237
   24   2HH2  ARG   2          2HH2      ARG   2  45.927  -7.519  -7.519
   25    H    GLY   3           H        GLY   3  41.240  -3.114  -3.114
   26   1HA   GLY   3          2HA       GLY   3  40.009  -5.787  -5.787
   27   2HA   GLY   3          1HA       GLY   3  40.077  -4.931  -4.931
   28    H    SER   4           H        SER   4  38.055  -5.763  -5.763
   29    HA   SER   4           HA       SER   4  36.030  -3.945  -3.945
   30   1HB   SER   4          2HB       SER   4  37.063  -2.349  -2.349
   31   2HB   SER   4          1HB       SER   4  37.278  -3.543  -3.543
   32    HG   SER   4           HG       SER   4  35.255  -3.296  -3.296
   33    H    HIS   5           H        HIS   5  33.957  -4.456  -4.456
   34    HA   HIS   5           HA       HIS   5  33.778  -6.745  -6.745
   35   1HB   HIS   5          2HB       HIS   5  32.380  -8.048  -8.048
   36   2HB   HIS   5          1HB       HIS   5  33.960  -7.756  -7.756
   37    HD1  HIS   5           HD1      HIS   5  33.704  -5.167  -5.167
   38    HD2  HIS   5           HD2      HIS   5  30.569  -7.890  -7.890
   39    HE1  HIS   5           HE1      HIS   5  32.233  -4.591  -4.591
   40    HE2  HIS   5           HE2      HIS   5  30.392  -6.310  -6.310
   41    H    HIS   6           H        HIS   6  31.925  -6.780  -6.780
   42    HA   HIS   6           HA       HIS   6  29.663  -5.130  -5.130
   43   1HB   HIS   6          2HB       HIS   6  31.159  -3.585  -3.585
   44   2HB   HIS   6          1HB       HIS   6  31.114  -4.669  -4.669
   45    HD1  HIS   6           HD1      HIS   6  28.315  -3.237  -3.237
   46    HD2  HIS   6           HD2      HIS   6  29.504  -3.491  -3.491
   47    HE1  HIS   6           HE1      HIS   6  26.480  -2.136  -2.136
   48    HE2  HIS   6           HE2      HIS   6  27.188  -2.367  -2.367
   49    H    HIS   7           H        HIS   7  27.763  -5.522  -5.522
   50    HA   HIS   7           HA       HIS   7  27.691  -7.451  -7.451
   51   1HB   HIS   7          2HB       HIS   7  28.205  -8.918  -8.918
   52   2HB   HIS   7          1HB       HIS   7  26.653  -8.442  -8.442
   53    HD1  HIS   7           HD1      HIS   7  27.995 -10.108 -10.108
   54    HD2  HIS   7           HD2      HIS   7  24.598 -10.043 -10.043
   55    HE1  HIS   7           HE1      HIS   7  26.480 -11.884 -11.884
   56    HE2  HIS   7           HE2      HIS   7  24.398 -11.771 -11.771
   57    H    HIS   8           H        HIS   8  26.641  -4.918  -4.918
   58    HA   HIS   8           HA       HIS   8  23.771  -5.491  -5.491
   59   1HB   HIS   8          2HB       HIS   8  24.654  -4.327  -4.327
   60   2HB   HIS   8          1HB       HIS   8  24.588  -2.890  -2.890
   61    HD1  HIS   8           HD1      HIS   8  21.939  -4.274  -4.274
   62    HD2  HIS   8           HD2      HIS   8  22.487  -3.184  -3.184
   63    HE1  HIS   8           HE1      HIS   8  19.627  -3.946  -3.946
   64    HE2  HIS   8           HE2      HIS   8  19.980  -3.359  -3.359
   65    H    HIS   9           H        HIS   9  24.328  -5.459  -5.459
   66    HA   HIS   9           HA       HIS   9  24.011  -2.789  -2.789
   67   1HB   HIS   9          2HB       HIS   9  26.510  -3.280  -3.280
   68   2HB   HIS   9          1HB       HIS   9  26.253  -4.511  -4.511
   69    HD1  HIS   9           HD1      HIS   9  24.426  -1.256  -1.256
   70    HD2  HIS   9           HD2      HIS   9  27.752  -3.087  -3.087
   71    HE1  HIS   9           HE1      HIS   9  25.080   0.198   0.198
   72    HE2  HIS   9           HE2      HIS   9  27.142  -0.887  -0.887
   73    H    HIS  10           H        HIS  10  22.810  -2.775  -2.775
   74    HA   HIS  10           HA       HIS  10  21.404  -5.095  -5.095
   75   1HB   HIS  10          2HB       HIS  10  21.219  -2.329  -2.329
   76   2HB   HIS  10          1HB       HIS  10  21.346  -3.095  -3.095
   77    HD1  HIS  10           HD1      HIS  10  18.875  -2.494  -2.494
   78    HD2  HIS  10           HD2      HIS  10  19.380  -4.993  -4.993
   79    HE1  HIS  10           HE1      HIS  10  16.585  -3.398  -3.398
   80    HE2  HIS  10           HE2      HIS  10  16.922  -4.943  -4.943
   81    H    THR  11           H        THR  11  21.239  -5.469  -5.469
   82    HA   THR  11           HA       THR  11  23.924  -5.691  -5.691
   83    HB   THR  11           HB       THR  11  23.237  -8.096  -8.096
   84    HG1  THR  11           HG1      THR  11  21.299  -8.505  -8.505
   85   1HG2  THR  11          1HG2      THR  11  24.857  -7.212  -7.212
   86   2HG2  THR  11          3HG2      THR  11  23.711  -8.191  -8.191
   87   3HG2  THR  11          2HG2      THR  11  24.619  -8.908  -8.908
   88    H    ASP  12           H        ASP  12  23.904  -5.008  -5.008
   89    HA   ASP  12           HA       ASP  12  23.207  -4.421  -4.421
   90   1HB   ASP  12          2HB       ASP  12  21.139  -6.596  -6.596
   91   2HB   ASP  12          1HB       ASP  12  21.689  -5.908  -5.908
   92    HA   PRO  13           HA       PRO  13  19.870  -1.681  -1.681
   93   1HB   PRO  13          2HB       PRO  13  20.678   0.470   0.470
   94   2HB   PRO  13          1HB       PRO  13  21.437   0.003   0.003
   95   1HG   PRO  13          2HG       PRO  13  22.360  -0.499  -0.499
   96   2HG   PRO  13          1HG       PRO  13  23.298   0.032   0.032
   97   1HD   PRO  13          2HD       PRO  13  23.267  -2.542  -2.542
   98   2HD   PRO  13          1HD       PRO  13  23.478  -2.103  -2.103
   99    H    MET  14           H        MET  14  20.537  -3.180  -3.180
  100    HA   MET  14           HA       MET  14  19.386  -3.391  -3.391
  101   1HB   MET  14          2HB       MET  14  17.541  -3.549  -3.549
  102   2HB   MET  14          1HB       MET  14  16.902  -2.207  -2.207
  103   1HG   MET  14          2HG       MET  14  16.368  -3.516  -3.516
  104   2HG   MET  14          1HG       MET  14  17.714  -4.621  -4.621
  105   1HE   MET  14          2HE       MET  14  14.517  -4.296  -4.296
  106   2HE   MET  14          1HE       MET  14  14.054  -5.967  -5.967
  107   3HE   MET  14          3HE       MET  14  13.515  -4.679  -4.679
  108    H    SER  15           H        SER  15  20.872  -1.039  -1.039
  109    HA   SER  15           HA       SER  15  21.170   1.102   1.102
  110   1HB   SER  15          2HB       SER  15  20.083  -0.394  -0.394
  111   2HB   SER  15          1HB       SER  15  19.188   1.125   1.125
  112    HG   SER  15           HG       SER  15  22.005   0.802   0.802
  113    H    ALA  16           H        ALA  16  19.130   0.493   0.493
  114    HA   ALA  16           HA       ALA  16  17.526   1.521   1.521
  115   1HB   ALA  16          2HB       ALA  16  18.387   3.829   3.829
  116   2HB   ALA  16          1HB       ALA  16  17.172   3.981   3.981
  117   3HB   ALA  16          3HB       ALA  16  18.814   3.485   3.485
  118    H    ILE  17           H        ILE  17  16.871  -0.028  -0.028
  119    HA   ILE  17           HA       ILE  17  14.774   1.162   1.162
  120    HB   ILE  17           HB       ILE  17  15.812  -1.624  -1.624
  121   1HG1  ILE  17          2HG1      ILE  17  15.332  -0.246  -0.246
  122   2HG1  ILE  17          1HG1      ILE  17  16.686   0.267   0.267
  123   1HG2  ILE  17          1HG2      ILE  17  13.139  -0.865  -0.865
  124   2HG2  ILE  17          3HG2      ILE  17  14.032  -2.059  -2.059
  125   3HG2  ILE  17          2HG2      ILE  17  13.692  -2.359  -2.359
  126   1HD1  ILE  17          3HD1      ILE  17  17.238  -2.285  -2.285
  127   2HD1  ILE  17          2HD1      ILE  17  16.244  -2.313  -2.313
  128   3HD1  ILE  17          1HD1      ILE  17  17.680  -1.293  -1.293
  129    H    GLN  18           H        GLN  18  13.147   1.977   1.977
  130    HA   GLN  18           HA       GLN  18  11.273   2.023   2.023
  131   1HB   GLN  18          2HB       GLN  18  11.333  -0.924  -0.924
  132   2HB   GLN  18          1HB       GLN  18  10.002  -0.147  -0.147
  133   1HG   GLN  18          2HG       GLN  18   9.387   1.105   1.105
  134   2HG   GLN  18          1HG       GLN  18  10.931   0.828   0.828
  135   1HE2  GLN  18          2HE2      GLN  18   8.148  -2.181  -2.181
  136   2HE2  GLN  18          1HE2      GLN  18   8.240  -1.055  -1.055
  137    H    ASN  19           H        ASN  19  10.210   0.889   0.889
  138    HA   ASN  19           HA       ASN  19  12.383   0.510   0.510
  139   1HB   ASN  19          2HB       ASN  19   9.619   1.637   1.637
  140   2HB   ASN  19          1HB       ASN  19  10.341   0.931   0.931
  141   1HD2  ASN  19          2HD2      ASN  19  12.944   3.391   3.391
  142   2HD2  ASN  19          1HD2      ASN  19  12.690   1.689   1.689
  143    H    LEU  20           H        LEU  20   9.827  -1.146  -1.146
  144    HA   LEU  20           HA       LEU  20   8.980  -2.992  -2.992
  145   1HB   LEU  20          2HB       LEU  20   9.314  -3.073  -3.073
  146   2HB   LEU  20          1HB       LEU  20   8.897  -4.550  -4.550
  147    HG   LEU  20           HG       LEU  20   6.868  -3.518  -3.518
  148   1HD1  LEU  20          2HD1      LEU  20   7.943  -1.077  -1.077
  149   2HD1  LEU  20          1HD1      LEU  20   6.227  -1.266  -1.266
  150   3HD1  LEU  20          3HD1      LEU  20   7.412  -1.260  -1.260
  151   1HD2  LEU  20          3HD2      LEU  20   7.424  -3.633  -3.633
  152   2HD2  LEU  20          2HD2      LEU  20   6.268  -4.543  -4.543
  153   3HD2  LEU  20          1HD2      LEU  20   5.912  -2.880  -2.880
  154    H    HIS  21           H        HIS  21   9.521  -5.401  -5.401
  155    HA   HIS  21           HA       HIS  21  12.178  -6.194  -6.194
  156   1HB   HIS  21          2HB       HIS  21  12.571  -4.792  -4.792
  157   2HB   HIS  21          1HB       HIS  21  11.568  -5.920  -5.920
  158    HD1  HIS  21           HD1      HIS  21  14.612  -6.227  -6.227
  159    HD2  HIS  21           HD2      HIS  21  13.092  -7.731  -7.731
  160    HE1  HIS  21           HE1      HIS  21  16.363  -7.811  -7.811
  161    HE2  HIS  21           HE2      HIS  21  15.382  -8.780  -8.780
  162    H    SER  22           H        SER  22  10.878  -7.804  -7.804
  163    HA   SER  22           HA       SER  22   9.059  -9.477  -9.477
  164   1HB   SER  22          2HB       SER  22  10.615  -9.586  -9.586
  165   2HB   SER  22          1HB       SER  22  10.014 -11.127 -11.127
  166    HG   SER  22           HG       SER  22   8.612  -8.907  -8.907
  167    H    PHE  23           H        PHE  23   9.419 -10.730 -10.730
  168    HA   PHE  23           HA       PHE  23  11.970 -11.515 -11.515
  169   1HB   PHE  23          2HB       PHE  23   9.671 -11.342 -11.342
  170   2HB   PHE  23          1HB       PHE  23   9.509 -13.030 -13.030
  171    HD1  PHE  23           HD2      PHE  23  11.494 -10.643 -10.643
  172    HD2  PHE  23           HD1      PHE  23  10.793 -14.737 -14.737
  173    HE1  PHE  23           HE2      PHE  23  12.868 -11.309 -11.309
  174    HE2  PHE  23           HE1      PHE  23  12.164 -15.411 -15.411
  175    HZ   PHE  23           HZ       PHE  23  13.205 -13.696 -13.696
  176    H    ASP  24           H        ASP  24  13.152 -13.335 -13.335
  177    HA   ASP  24           HA       ASP  24  13.913 -15.265 -15.265
  178   1HB   ASP  24          2HB       ASP  24  11.020 -15.783 -15.783
  179   2HB   ASP  24          1HB       ASP  24  11.872 -16.891 -16.891
  180    HA   PRO  25           HA       PRO  25  12.822 -13.363 -13.363
  181   1HB   PRO  25          2HB       PRO  25  15.792 -13.393 -13.393
  182   2HB   PRO  25          1HB       PRO  25  14.662 -12.133 -12.133
  183   1HG   PRO  25          2HG       PRO  25  16.083 -11.872 -11.872
  184   2HG   PRO  25          1HG       PRO  25  14.402 -11.315 -11.315
  185   1HD   PRO  25          2HD       PRO  25  15.525 -13.773 -13.773
  186   2HD   PRO  25          1HD       PRO  25  14.208 -12.715 -12.715
  187    H    PHE  26           H        PHE  26  14.937 -15.896 -15.896
  188    HA   PHE  26           HA       PHE  26  14.684 -17.277 -17.277
  189   1HB   PHE  26          2HB       PHE  26  16.618 -18.656 -18.656
  190   2HB   PHE  26          1HB       PHE  26  16.912 -17.500 -17.500
  191    HD1  PHE  26           HD2      PHE  26  17.441 -15.144 -15.144
  192    HD2  PHE  26           HD1      PHE  26  17.160 -18.162 -18.162
  193    HE1  PHE  26           HE2      PHE  26  18.658 -13.695 -13.695
  194    HE2  PHE  26           HE1      PHE  26  18.377 -16.718 -16.718
  195    HZ   PHE  26           HZ       PHE  26  19.128 -14.481 -14.481
  196    H    ALA  27           H        ALA  27  12.583 -17.280 -17.280
  197    HA   ALA  27           HA       ALA  27  12.186 -20.106 -20.106
  198   1HB   ALA  27          3HB       ALA  27  13.496 -19.036 -19.036
  199   2HB   ALA  27          2HB       ALA  27  11.817 -18.868 -18.868
  200   3HB   ALA  27          1HB       ALA  27  12.451 -20.455 -20.455
  201    H    ASP  28           H        ASP  28  10.158 -20.355 -20.355
  202    HA   ASP  28           HA       ASP  28   8.255 -18.185 -18.185
  203   1HB   ASP  28          2HB       ASP  28   6.751 -19.753 -19.753
  204   2HB   ASP  28          1HB       ASP  28   8.263 -19.376 -19.376
  205    H    ALA  29           H        ALA  29   8.340 -18.328 -18.328
  206    HA   ALA  29           HA       ALA  29   7.230 -20.553 -20.553
  207   1HB   ALA  29          2HB       ALA  29   7.734 -17.698 -17.698
  208   2HB   ALA  29          1HB       ALA  29   6.942 -18.829 -18.829
  209   3HB   ALA  29          3HB       ALA  29   8.580 -19.154 -19.154
  210    H    SER  30           H        SER  30   5.198 -20.611 -20.611
  211    HA   SER  30           HA       SER  30   2.929 -20.522 -20.522
  212   1HB   SER  30          2HB       SER  30   2.689 -17.871 -17.871
  213   2HB   SER  30          1HB       SER  30   2.050 -18.443 -18.443
  214    HG   SER  30           HG       SER  30   4.169 -16.923 -16.923
  215    H    LYS  31           H        LYS  31   2.312 -22.056 -22.056
  216    HA   LYS  31           HA       LYS  31   2.343 -21.611 -21.611
  217   1HB   LYS  31          2HB       LYS  31   2.384 -23.844 -23.844
  218   2HB   LYS  31          1HB       LYS  31   0.660 -23.771 -23.771
  219   1HG   LYS  31          2HG       LYS  31   0.993 -24.618 -24.618
  220   2HG   LYS  31          1HG       LYS  31   2.089 -23.296 -23.296
  221   1HD   LYS  31          2HD       LYS  31   3.955 -24.505 -24.505
  222   2HD   LYS  31          1HD       LYS  31   2.876 -25.799 -25.799
  223   1HE   LYS  31          2HE       LYS  31   2.545 -26.572 -26.572
  224   2HE   LYS  31          1HE       LYS  31   3.008 -25.035 -25.035
  225   1HZ   LYS  31          1HZ       LYS  31   4.860 -26.920 -26.920
  226   2HZ   LYS  31          3HZ       LYS  31   4.706 -26.729 -26.729
  227   3HZ   LYS  31          2HZ       LYS  31   5.296 -25.457 -25.457
  228    H    GLY  32           H        GLY  32   0.153 -22.292 -22.292
  229   1HA   GLY  32          2HA       GLY  32  -1.931 -20.508 -20.508
  230   2HA   GLY  32          1HA       GLY  32  -1.601 -20.677 -20.677
  231    H    ASP  33           H        ASP  33  -1.573 -23.469 -23.469
  232    HA   ASP  33           HA       ASP  33  -4.033 -24.395 -24.395
  233   1HB   ASP  33          2HB       ASP  33  -1.717 -25.634 -25.634
  234   2HB   ASP  33          1HB       ASP  33  -2.171 -26.245 -26.245
  235    H    ASP  34           H        ASP  34  -2.342 -24.397 -24.397
  236    HA   ASP  34           HA       ASP  34  -4.940 -24.387 -24.387
  237   1HB   ASP  34          2HB       ASP  34  -4.186 -26.747 -26.747
  238   2HB   ASP  34          1HB       ASP  34  -2.705 -26.281 -26.281
  239    H    LEU  35           H        LEU  35  -4.753 -22.363 -22.363
  240    HA   LEU  35           HA       LEU  35  -2.399 -21.177 -21.177
  241   1HB   LEU  35          2HB       LEU  35  -4.370 -19.882 -19.882
  242   2HB   LEU  35          1HB       LEU  35  -5.275 -20.591 -20.591
  243    HG   LEU  35           HG       LEU  35  -3.293 -19.528 -19.528
  244   1HD1  LEU  35          1HD1      LEU  35  -2.226 -18.711 -18.711
  245   2HD1  LEU  35          3HD1      LEU  35  -3.549 -17.548 -17.548
  246   3HD1  LEU  35          2HD1      LEU  35  -2.441 -17.517 -17.517
  247   1HD2  LEU  35          3HD2      LEU  35  -5.926 -19.047 -19.047
  248   2HD2  LEU  35          2HD2      LEU  35  -4.870 -18.107 -18.107
  249   3HD2  LEU  35          1HD2      LEU  35  -5.263 -17.510 -17.510
  250    H    LEU  36           H        LEU  36  -1.319 -22.580 -22.580
  251    HA   LEU  36           HA       LEU  36  -2.433 -23.897 -23.897
  252   1HB   LEU  36          2HB       LEU  36   0.374 -22.960 -22.960
  253   2HB   LEU  36          1HB       LEU  36  -0.045 -23.896 -23.896
  254    HG   LEU  36           HG       LEU  36  -0.612 -24.885 -24.885
  255   1HD1  LEU  36          2HD1      LEU  36   1.932 -24.809 -24.809
  256   2HD1  LEU  36          1HD1      LEU  36   1.516 -26.337 -26.337
  257   3HD1  LEU  36          3HD1      LEU  36   1.635 -24.864 -24.864
  258   1HD2  LEU  36          3HD2      LEU  36  -1.797 -25.898 -25.898
  259   2HD2  LEU  36          2HD2      LEU  36  -0.787 -27.027 -27.027
  260   3HD2  LEU  36          1HD2      LEU  36  -0.226 -26.379 -26.379
  261    HA   PRO  37           HA       PRO  37  -3.312 -20.675 -20.675
  262   1HB   PRO  37          2HB       PRO  37  -2.415 -22.621 -22.621
  263   2HB   PRO  37          1HB       PRO  37  -3.952 -21.762 -21.762
  264   1HG   PRO  37          2HG       PRO  37  -3.779 -24.359 -24.359
  265   2HG   PRO  37          1HG       PRO  37  -4.809 -23.275 -23.275
  266   1HD   PRO  37          2HD       PRO  37  -2.127 -24.415 -24.415
  267   2HD   PRO  37          1HD       PRO  37  -3.532 -24.138 -24.138
  268    H    ALA  38           H        ALA  38  -2.108 -20.317 -20.317
  269    HA   ALA  38           HA       ALA  38  -0.322 -19.341 -19.341
  270   1HB   ALA  38          1HB       ALA  38   0.691 -21.588 -21.588
  271   2HB   ALA  38          3HB       ALA  38   1.422 -20.850 -20.850
  272   3HB   ALA  38          2HB       ALA  38   1.841 -20.263 -20.263
  273    H    GLY  39           H        GLY  39  -0.839 -17.258 -17.258
  274   1HA   GLY  39          2HA       GLY  39   1.170 -15.987 -15.987
  275   2HA   GLY  39          1HA       GLY  39  -0.347 -16.105 -16.105
  276    H    THR  40           H        THR  40   1.373 -14.534 -14.534
  277    HA   THR  40           HA       THR  40  -0.166 -12.221 -12.221
  278    HB   THR  40           HB       THR  40  -0.978 -12.773 -12.773
  279    HG1  THR  40           HG1      THR  40  -1.542 -14.796 -14.796
  280   1HG2  THR  40          1HG2      THR  40  -2.287 -12.541 -12.541
  281   2HG2  THR  40          3HG2      THR  40  -3.193 -13.494 -13.494
  282   3HG2  THR  40          2HG2      THR  40  -2.715 -11.841 -11.841
  283    H    GLU  41           H        GLU  41   1.914 -14.359 -14.359
  284    HA   GLU  41           HA       GLU  41   3.837 -13.963 -13.963
  285   1HB   GLU  41          2HB       GLU  41   3.560 -11.630 -11.630
  286   2HB   GLU  41          1HB       GLU  41   4.216 -11.172 -11.172
  287   1HG   GLU  41          2HG       GLU  41   5.416 -13.543 -13.543
  288   2HG   GLU  41          1HG       GLU  41   5.719 -11.990 -11.990
  289    H    ASP  42           H        ASP  42   0.912 -13.167 -13.167
  290    HA   ASP  42           HA       ASP  42  -0.091 -12.468 -12.468
  291   1HB   ASP  42          2HB       ASP  42   1.884 -14.220 -14.220
  292   2HB   ASP  42          1HB       ASP  42   2.320 -12.822 -12.822
  293    H    TYR  43           H        TYR  43   0.392 -10.317 -10.317
  294    HA   TYR  43           HA       TYR  43   2.255  -8.487  -8.487
  295   1HB   TYR  43          2HB       TYR  43  -0.433  -7.945  -7.945
  296   2HB   TYR  43          1HB       TYR  43   0.839  -6.752  -6.752
  297    HD1  TYR  43           HD1      TYR  43   3.032  -8.988  -8.988
  298    HD2  TYR  43           HD2      TYR  43  -0.436  -7.447  -7.447
  299    HE1  TYR  43           HE1      TYR  43   3.983  -9.592  -9.592
  300    HE2  TYR  43           HE2      TYR  43   0.509  -8.048  -8.048
  301    HH   TYR  43           HH       TYR  43   3.746  -8.889  -8.889
  302    H    ILE  44           H        ILE  44   1.640  -6.417  -6.417
  303    HA   ILE  44           HA       ILE  44  -0.184  -7.017  -7.017
  304    HB   ILE  44           HB       ILE  44   2.361  -5.390  -5.390
  305   1HG1  ILE  44          2HG1      ILE  44   2.829  -7.750  -7.750
  306   2HG1  ILE  44          1HG1      ILE  44   3.067  -7.130  -7.130
  307   1HG2  ILE  44          3HG2      ILE  44   0.238  -5.793  -5.793
  308   2HG2  ILE  44          2HG2      ILE  44   1.888  -5.320  -5.320
  309   3HG2  ILE  44          1HG2      ILE  44   0.900  -4.277  -4.277
  310   1HD1  ILE  44          3HD1      ILE  44   0.558  -7.900  -7.900
  311   2HD1  ILE  44          2HD1      ILE  44   1.008  -8.982  -8.982
  312   3HD1  ILE  44          1HD1      ILE  44   1.906  -9.020  -9.020
  313    H    HIS  45           H        HIS  45  -2.002  -6.002  -6.002
  314    HA   HIS  45           HA       HIS  45  -2.043  -3.482  -3.482
  315   1HB   HIS  45          2HB       HIS  45  -3.880  -5.564  -5.564
  316   2HB   HIS  45          1HB       HIS  45  -4.568  -4.076  -4.076
  317    HD1  HIS  45           HD1      HIS  45  -3.363  -5.604  -5.604
  318    HD2  HIS  45           HD2      HIS  45  -5.558  -2.340  -2.340
  319    HE1  HIS  45           HE1      HIS  45  -4.368  -4.579  -4.579
  320    HE2  HIS  45           HE2      HIS  45  -5.761  -2.656  -2.656
  321    H    ILE  46           H        ILE  46  -2.193  -1.496  -1.496
  322    HA   ILE  46           HA       ILE  46  -2.198  -1.111  -1.111
  323    HB   ILE  46           HB       ILE  46  -1.643   0.878   0.878
  324   1HG1  ILE  46          2HG1      ILE  46   0.026  -0.973  -0.973
  325   2HG1  ILE  46          1HG1      ILE  46   0.683   0.634   0.634
  326   1HG2  ILE  46          1HG2      ILE  46  -1.594   1.117   1.117
  327   2HG2  ILE  46          3HG2      ILE  46  -0.640   2.180   2.180
  328   3HG2  ILE  46          2HG2      ILE  46  -2.397   2.153   2.153
  329   1HD1  ILE  46          3HD1      ILE  46   0.157   0.083   0.083
  330   2HD1  ILE  46          2HD1      ILE  46   0.163  -1.584  -1.584
  331   3HD1  ILE  46          1HD1      ILE  46   1.598  -0.578  -0.578
  332    H    ARG  47           H        ARG  47  -3.368   1.499   1.499
  333    HA   ARG  47           HA       ARG  47  -5.492   2.230   2.230
  334   1HB   ARG  47          2HB       ARG  47  -6.232  -0.216  -0.216
  335   2HB   ARG  47          1HB       ARG  47  -6.697   0.311   0.311
  336   1HG   ARG  47          2HG       ARG  47  -8.590   0.338   0.338
  337   2HG   ARG  47          1HG       ARG  47  -8.204   1.963   1.963
  338   1HD   ARG  47          2HD       ARG  47  -7.679   2.687   2.687
  339   2HD   ARG  47          1HD       ARG  47  -6.823   1.201   1.201
  340    HE   ARG  47           HE       ARG  47  -9.533   1.858   1.858
  341   1HH1  ARG  47          2HH1      ARG  47  -7.342  -0.782  -0.782
  342   2HH1  ARG  47          1HH1      ARG  47  -8.272  -1.935  -1.935
  343   1HH2  ARG  47          1HH2      ARG  47 -10.758   0.343   0.343
  344   2HH2  ARG  47          2HH2      ARG  47 -10.210  -1.296  -1.296
  345    H    ILE  48           H        ILE  48  -6.258   4.037   4.037
  346    HA   ILE  48           HA       ILE  48  -5.898   4.655   4.655
  347    HB   ILE  48           HB       ILE  48  -5.169   6.086   6.086
  348   1HG1  ILE  48          2HG1      ILE  48  -5.378   7.031   7.031
  349   2HG1  ILE  48          1HG1      ILE  48  -4.011   6.180   6.180
  350   1HG2  ILE  48          1HG2      ILE  48  -7.528   6.835   6.835
  351   2HG2  ILE  48          3HG2      ILE  48  -7.351   7.600   7.600
  352   3HG2  ILE  48          2HG2      ILE  48  -6.371   8.146   8.146
  353   1HD1  ILE  48          2HD1      ILE  48  -4.758   8.572   8.572
  354   2HD1  ILE  48          1HD1      ILE  48  -4.293   8.899   8.899
  355   3HD1  ILE  48          3HD1      ILE  48  -3.180   8.048   8.048
  356    H    GLN  49           H        GLN  49  -7.576   6.357   6.357
  357    HA   GLN  49           HA       GLN  49 -10.133   6.274   6.274
  358   1HB   GLN  49          2HB       GLN  49 -11.369   5.101   5.101
  359   2HB   GLN  49          1HB       GLN  49 -10.107   4.053   4.053
  360   1HG   GLN  49          2HG       GLN  49  -8.841   5.229   5.229
  361   2HG   GLN  49          1HG       GLN  49 -10.498   5.122   5.122
  362   1HE2  GLN  49          2HE2      GLN  49 -10.207   1.795   1.795
  363   2HE2  GLN  49          1HE2      GLN  49 -10.951   3.337   3.337
  364    H    GLN  50           H        GLN  50 -10.304   8.428   8.428
  365    HA   GLN  50           HA       GLN  50 -10.081   9.708   9.708
  366   1HB   GLN  50          2HB       GLN  50  -8.792  10.438  10.438
  367   2HB   GLN  50          1HB       GLN  50 -10.287  11.323  11.323
  368   1HG   GLN  50          2HG       GLN  50 -10.005  12.586  12.586
  369   2HG   GLN  50          1HG       GLN  50  -8.691  11.549  11.549
  370   1HE2  GLN  50          2HE2      GLN  50  -6.573  14.045  14.045
  371   2HE2  GLN  50          1HE2      GLN  50  -7.252  13.240  13.240
  372    H    ARG  51           H        ARG  51 -12.099   9.350   9.350
  373    HA   ARG  51           HA       ARG  51 -14.537   9.455   9.455
  374   1HB   ARG  51          2HB       ARG  51 -13.803  10.088  10.088
  375   2HB   ARG  51          1HB       ARG  51 -15.468  10.090  10.090
  376   1HG   ARG  51          2HG       ARG  51 -15.574   7.839   7.839
  377   2HG   ARG  51          1HG       ARG  51 -13.885   7.676   7.676
  378   1HD   ARG  51          2HD       ARG  51 -13.116   7.824   7.824
  379   2HD   ARG  51          1HD       ARG  51 -14.623   8.532   8.532
  380    HE   ARG  51           HE       ARG  51 -15.352   6.063   6.063
  381   1HH1  ARG  51          2HH1      ARG  51 -12.951   7.232   7.232
  382   2HH1  ARG  51          1HH1      ARG  51 -13.010   5.813   5.813
  383   1HH2  ARG  51          1HH2      ARG  51 -15.430   4.198   4.198
  384   2HH2  ARG  51          2HH2      ARG  51 -14.416   4.090   4.090
  385    H    ASN  52           H        ASN  52 -13.554  12.019  12.019
  386    HA   ASN  52           HA       ASN  52 -15.092  13.962  13.962
  387   1HB   ASN  52          2HB       ASN  52 -13.270  14.636  14.636
  388   2HB   ASN  52          1HB       ASN  52 -14.782  15.404  15.404
  389   1HD2  ASN  52          2HD2      ASN  52 -14.878  12.861  12.861
  390   2HD2  ASN  52          1HD2      ASN  52 -13.545  13.829  13.829
  391    H    GLY  53           H        GLY  53 -13.200  16.173  16.173
  392   1HA   GLY  53          2HA       GLY  53 -11.514  15.865  15.865
  393   2HA   GLY  53          1HA       GLY  53 -11.853  17.369  17.369
  394    H    ARG  54           H        ARG  54 -10.768  14.377  14.377
  395    HA   ARG  54           HA       ARG  54  -8.032  14.871  14.871
  396   1HB   ARG  54          2HB       ARG  54  -7.753  15.742  15.742
  397   2HB   ARG  54          1HB       ARG  54  -8.494  16.898  16.898
  398   1HG   ARG  54          2HG       ARG  54 -10.720  15.865  15.865
  399   2HG   ARG  54          1HG       ARG  54  -9.661  15.466  15.466
  400   1HD   ARG  54          2HD       ARG  54 -10.239  18.188  18.188
  401   2HD   ARG  54          1HD       ARG  54 -10.649  17.588  17.588
  402    HE   ARG  54           HE       ARG  54  -7.903  17.417  17.417
  403   1HH1  ARG  54          1HH1      ARG  54  -9.247  21.164  21.164
  404   2HH1  ARG  54          2HH1      ARG  54 -10.309  19.941  19.941
  405   1HH2  ARG  54          1HH2      ARG  54  -6.505  19.024  19.024
  406   2HH2  ARG  54          2HH2      ARG  54  -7.087  20.644  20.644
  407    H    LYS  55           H        LYS  55 -10.840  13.487  13.487
  408    HA   LYS  55           HA       LYS  55  -9.513  11.743  11.743
  409   1HB   LYS  55          2HB       LYS  55 -11.935  12.318  12.318
  410   2HB   LYS  55          1HB       LYS  55 -12.195  11.331  11.331
  411   1HG   LYS  55          2HG       LYS  55 -12.795  10.159  10.159
  412   2HG   LYS  55          1HG       LYS  55 -11.490   9.350   9.350
  413   1HD   LYS  55          2HD       LYS  55 -11.046   9.410   9.410
  414   2HD   LYS  55          1HD       LYS  55  -9.852  10.356  10.356
  415   1HE   LYS  55          2HE       LYS  55 -10.633  11.486  11.486
  416   2HE   LYS  55          1HE       LYS  55 -10.977  12.409  12.409
  417   1HZ   LYS  55          2HZ       LYS  55 -12.926  10.704  10.704
  418   2HZ   LYS  55          1HZ       LYS  55 -12.862  12.393  12.393
  419   3HZ   LYS  55          3HZ       LYS  55 -13.251  11.611  11.611
  420    H    THR  56           H        THR  56  -7.787  11.241  11.241
  421    HA   THR  56           HA       THR  56  -8.490   9.211   9.211
  422    HB   THR  56           HB       THR  56  -5.645   9.741   9.741
  423    HG1  THR  56           HG1      THR  56  -6.138  11.812  11.812
  424   1HG2  THR  56          3HG2      THR  56  -7.278   9.039   9.039
  425   2HG2  THR  56          2HG2      THR  56  -6.139  10.339  10.339
  426   3HG2  THR  56          1HG2      THR  56  -5.553   8.799   8.799
  427    H    LEU  57           H        LEU  57  -7.259   7.160   7.160
  428    HA   LEU  57           HA       LEU  57  -6.107   6.139   6.139
  429   1HB   LEU  57          2HB       LEU  57  -8.941   5.686   5.686
  430   2HB   LEU  57          1HB       LEU  57  -8.042   4.221   4.221
  431    HG   LEU  57           HG       LEU  57  -7.864   6.544   6.544
  432   1HD1  LEU  57          1HD1      LEU  57 -10.306   5.658   5.658
  433   2HD1  LEU  57          3HD1      LEU  57  -9.889   4.482   4.482
  434   3HD1  LEU  57          2HD1      LEU  57  -9.878   6.205   6.205
  435   1HD2  LEU  57          3HD2      LEU  57  -7.081   3.742   3.742
  436   2HD2  LEU  57          2HD2      LEU  57  -6.499   5.060   5.060
  437   3HD2  LEU  57          1HD2      LEU  57  -7.959   4.178   4.178
  438    H    THR  58           H        THR  58  -4.366   5.526   5.526
  439    HA   THR  58           HA       THR  58  -4.657   4.047   4.047
  440    HB   THR  58           HB       THR  58  -2.220   4.364   4.364
  441    HG1  THR  58           HG1      THR  58  -3.315   6.316   6.316
  442   1HG2  THR  58          2HG2      THR  58  -2.525   3.513   3.513
  443   2HG2  THR  58          1HG2      THR  58  -1.010   4.111   4.111
  444   3HG2  THR  58          3HG2      THR  58  -1.744   2.644   2.644
  445    H    THR  59           H        THR  59  -5.222   1.977   1.977
  446    HA   THR  59           HA       THR  59  -4.787   0.220   0.220
  447    HB   THR  59           HB       THR  59  -6.246  -1.293  -1.293
  448    HG1  THR  59           HG1      THR  59  -7.131   1.367   1.367
  449   1HG2  THR  59          1HG2      THR  59  -7.010   0.583   0.583
  450   2HG2  THR  59          3HG2      THR  59  -8.291  -0.101  -0.101
  451   3HG2  THR  59          2HG2      THR  59  -7.203  -1.167  -1.167
  452    H    VAL  60           H        VAL  60  -4.170  -2.047  -2.047
  453    HA   VAL  60           HA       VAL  60  -2.418  -2.318  -2.318
  454    HB   VAL  60           HB       VAL  60  -1.657  -3.146  -3.146
  455   1HG1  VAL  60          1HG1      VAL  60  -0.126  -3.308  -3.308
  456   2HG1  VAL  60          3HG1      VAL  60   0.525  -3.690  -3.690
  457   3HG1  VAL  60          2HG1      VAL  60  -0.776  -4.667  -4.667
  458   1HG2  VAL  60          1HG2      VAL  60  -0.879  -0.810  -0.810
  459   2HG2  VAL  60          3HG2      VAL  60  -1.399  -0.830  -0.830
  460   3HG2  VAL  60          2HG2      VAL  60   0.202  -1.428  -1.428
  461    H    GLN  61           H        GLN  61  -3.131  -3.967  -3.967
  462    HA   GLN  61           HA       GLN  61  -4.222  -6.314  -6.314
  463   1HB   GLN  61          2HB       GLN  61  -4.954  -6.304  -6.304
  464   2HB   GLN  61          1HB       GLN  61  -5.995  -6.276  -6.276
  465   1HG   GLN  61          2HG       GLN  61  -5.659  -3.791  -3.791
  466   2HG   GLN  61          1HG       GLN  61  -4.850  -3.928  -3.928
  467   1HE2  GLN  61          2HE2      GLN  61  -8.133  -5.324  -5.324
  468   2HE2  GLN  61          1HE2      GLN  61  -6.637  -6.090  -6.090
  469    H    GLY  62           H        GLY  62  -3.471  -8.323  -8.323
  470   1HA   GLY  62          2HA       GLY  62  -2.365  -9.801  -9.801
  471   2HA   GLY  62          1HA       GLY  62  -1.318  -8.448  -8.448
  472    H    ILE  63           H        ILE  63  -1.052  -7.646  -7.646
  473    HA   ILE  63           HA       ILE  63   1.268  -9.118  -9.118
  474    HB   ILE  63           HB       ILE  63  -0.370  -7.136  -7.136
  475   1HG1  ILE  63          2HG1      ILE  63   0.780  -5.872  -5.872
  476   2HG1  ILE  63          1HG1      ILE  63   1.999  -5.955  -5.955
  477   1HG2  ILE  63          1HG2      ILE  63   1.765  -8.897  -8.897
  478   2HG2  ILE  63          3HG2      ILE  63   1.973  -7.192  -7.192
  479   3HG2  ILE  63          2HG2      ILE  63   0.510  -8.039  -8.039
  480   1HD1  ILE  63          1HD1      ILE  63   2.891  -7.986  -7.986
  481   2HD1  ILE  63          3HD1      ILE  63   1.888  -7.409  -7.409
  482   3HD1  ILE  63          2HD1      ILE  63   3.166  -6.381  -6.381
  483    H    ALA  64           H        ALA  64   1.680 -10.594 -10.594
  484    HA   ALA  64           HA       ALA  64  -0.360 -12.498 -12.498
  485   1HB   ALA  64          3HB       ALA  64   2.265 -12.717 -12.717
  486   2HB   ALA  64          2HB       ALA  64   2.091 -12.478 -12.478
  487   3HB   ALA  64          1HB       ALA  64   1.272 -13.824 -13.824
  488    H    ASP  65           H        ASP  65  -1.013 -13.287 -13.287
  489    HA   ASP  65           HA       ASP  65  -1.714 -11.032 -11.032
  490   1HB   ASP  65          2HB       ASP  65  -3.182 -12.846 -12.846
  491   2HB   ASP  65          1HB       ASP  65  -3.639 -12.274 -12.274
  492    H    ASP  66           H        ASP  66   0.960 -12.482 -12.482
  493    HA   ASP  66           HA       ASP  66   1.228 -12.776 -12.776
  494   1HB   ASP  66          2HB       ASP  66   2.276 -14.806 -14.806
  495   2HB   ASP  66          1HB       ASP  66   2.568 -14.822 -14.822
  496    H    TYR  67           H        TYR  67   1.961 -10.633 -10.633
  497    HA   TYR  67           HA       TYR  67   4.820 -10.837 -10.837
  498   1HB   TYR  67          2HB       TYR  67   2.693  -8.821  -8.821
  499   2HB   TYR  67          1HB       TYR  67   4.364  -8.278  -8.278
  500    HD1  TYR  67           HD2      TYR  67   3.936 -11.670 -11.670
  501    HD2  TYR  67           HD1      TYR  67   3.938  -7.598  -7.598
  502    HE1  TYR  67           HE2      TYR  67   4.254 -12.375 -12.375
  503    HE2  TYR  67           HE1      TYR  67   4.252  -8.285  -8.285
  504    HH   TYR  67           HH       TYR  67   3.677 -10.520 -10.520
  505    H    ASP  68           H        ASP  68   3.978 -11.133 -11.133
  506    HA   ASP  68           HA       ASP  68   4.800 -10.543 -10.543
  507   1HB   ASP  68          2HB       ASP  68   6.688  -9.523  -9.523
  508   2HB   ASP  68          1HB       ASP  68   6.039  -8.014  -8.014
  509    H    LYS  69           H        LYS  69   2.693  -8.751  -8.751
  510    HA   LYS  69           HA       LYS  69   1.063  -7.246  -7.246
  511   1HB   LYS  69          2HB       LYS  69   0.410  -8.851  -8.851
  512   2HB   LYS  69          1HB       LYS  69   1.575  -8.179  -8.179
  513   1HG   LYS  69          2HG       LYS  69   0.271  -5.990  -5.990
  514   2HG   LYS  69          1HG       LYS  69  -0.990  -6.981  -6.981
  515   1HD   LYS  69          2HD       LYS  69  -0.184  -8.313  -8.313
  516   2HD   LYS  69          1HD       LYS  69  -0.364  -6.609  -6.609
  517   1HE   LYS  69          2HE       LYS  69  -2.498  -7.440  -7.440
  518   2HE   LYS  69          1HE       LYS  69  -2.602  -6.775  -6.775
  519   1HZ   LYS  69          2HZ       LYS  69  -1.853  -9.257  -9.257
  520   2HZ   LYS  69          1HZ       LYS  69  -2.704  -9.543  -9.543
  521   3HZ   LYS  69          3HZ       LYS  69  -3.474  -8.794  -8.794
  522    H    LYS  70           H        LYS  70   2.829  -6.727  -6.727
  523    HA   LYS  70           HA       LYS  70   2.703  -3.979  -3.979
  524   1HB   LYS  70          2HB       LYS  70   5.024  -5.585  -5.585
  525   2HB   LYS  70          1HB       LYS  70   4.490  -4.001  -4.001
  526   1HG   LYS  70          2HG       LYS  70   2.235  -5.351  -5.351
  527   2HG   LYS  70          1HG       LYS  70   3.382  -6.682  -6.682
  528   1HD   LYS  70          2HD       LYS  70   4.603  -5.473  -5.473
  529   2HD   LYS  70          1HD       LYS  70   3.543  -4.077  -4.077
  530   1HE   LYS  70          2HE       LYS  70   2.504  -6.791  -6.791
  531   2HE   LYS  70          1HE       LYS  70   3.068  -5.628  -5.628
  532   1HZ   LYS  70          3HZ       LYS  70   1.116  -4.710  -4.710
  533   2HZ   LYS  70          2HZ       LYS  70   0.563  -5.736  -5.736
  534   3HZ   LYS  70          1HZ       LYS  70   1.302  -4.267  -4.267
  535    H    LYS  71           H        LYS  71   5.579  -5.868  -5.868
  536    HA   LYS  71           HA       LYS  71   7.160  -3.845  -3.845
  537   1HB   LYS  71          2HB       LYS  71   7.427  -6.502  -6.502
  538   2HB   LYS  71          1HB       LYS  71   7.087  -6.327  -6.327
  539   1HG   LYS  71          2HG       LYS  71   9.419  -6.286  -6.286
  540   2HG   LYS  71          1HG       LYS  71   8.947  -4.599  -4.599
  541   1HD   LYS  71          2HD       LYS  71   9.204  -4.174  -4.174
  542   2HD   LYS  71          1HD       LYS  71   9.482  -5.886  -5.886
  543   1HE   LYS  71          2HE       LYS  71  11.644  -5.182  -5.182
  544   2HE   LYS  71          1HE       LYS  71  11.432  -5.506  -5.506
  545   1HZ   LYS  71          3HZ       LYS  71  10.694  -3.042  -3.042
  546   2HZ   LYS  71          2HZ       LYS  71  11.535  -2.921  -2.921
  547   3HZ   LYS  71          1HZ       LYS  71  12.345  -3.412  -3.412
  548    H    LEU  72           H        LEU  72   4.267  -5.101  -5.101
  549    HA   LEU  72           HA       LEU  72   4.740  -4.189  -4.189
  550   1HB   LEU  72          2HB       LEU  72   2.954  -5.862  -5.862
  551   2HB   LEU  72          1HB       LEU  72   1.969  -4.412  -4.412
  552    HG   LEU  72           HG       LEU  72   3.159  -5.751  -5.751
  553   1HD1  LEU  72          1HD1      LEU  72   0.494  -5.531  -5.531
  554   2HD1  LEU  72          3HD1      LEU  72   0.551  -5.291  -5.291
  555   3HD1  LEU  72          2HD1      LEU  72   1.171  -6.784  -6.784
  556   1HD2  LEU  72          1HD2      LEU  72   3.455  -3.292  -3.292
  557   2HD2  LEU  72          3HD2      LEU  72   2.346  -3.927  -3.927
  558   3HD2  LEU  72          2HD2      LEU  72   1.713  -3.106  -3.106
  559    H    VAL  73           H        VAL  73   2.294  -2.935  -2.935
  560    HA   VAL  73           HA       VAL  73   2.369  -0.377  -0.377
  561    HB   VAL  73           HB       VAL  73   0.645   0.202   0.202
  562   1HG1  VAL  73          1HG1      VAL  73   0.079  -1.686  -1.686
  563   2HG1  VAL  73          3HG1      VAL  73  -1.151  -0.784  -0.784
  564   3HG1  VAL  73          2HG1      VAL  73   0.069   0.076   0.076
  565   1HG2  VAL  73          2HG2      VAL  73   1.308  -2.171  -2.171
  566   2HG2  VAL  73          1HG2      VAL  73  -0.303  -1.478  -1.478
  567   3HG2  VAL  73          3HG2      VAL  73   0.005  -2.689  -2.689
  568    H    LYS  74           H        LYS  74   3.166  -1.641  -1.641
  569    HA   LYS  74           HA       LYS  74   3.688   0.674   0.674
  570   1HB   LYS  74          2HB       LYS  74   3.906  -1.748  -1.748
  571   2HB   LYS  74          1HB       LYS  74   5.534  -1.701  -1.701
  572   1HG   LYS  74          2HG       LYS  74   5.957   0.296   0.296
  573   2HG   LYS  74          1HG       LYS  74   4.411  -0.053  -0.053
  574   1HD   LYS  74          2HD       LYS  74   5.216  -1.869  -1.869
  575   2HD   LYS  74          1HD       LYS  74   6.261  -2.334  -2.334
  576   1HE   LYS  74          2HE       LYS  74   7.723  -1.722  -1.722
  577   2HE   LYS  74          1HE       LYS  74   7.705  -0.342  -0.342
  578   1HZ   LYS  74          2HZ       LYS  74   5.770   0.380   0.380
  579   2HZ   LYS  74          1HZ       LYS  74   6.650  -0.575  -0.575
  580   3HZ   LYS  74          3HZ       LYS  74   7.392   0.740   0.740
  581    H    ALA  75           H        ALA  75   5.753  -0.970  -0.970
  582    HA   ALA  75           HA       ALA  75   7.993   0.745   0.745
  583   1HB   ALA  75          2HB       ALA  75   7.151  -1.192  -1.192
  584   2HB   ALA  75          1HB       ALA  75   8.581  -0.180  -0.180
  585   3HB   ALA  75          3HB       ALA  75   8.484  -1.314  -1.314
  586    H    PHE  76           H        PHE  76   5.103   0.843   0.843
  587    HA   PHE  76           HA       PHE  76   5.884   2.841   2.841
  588   1HB   PHE  76          2HB       PHE  76   3.739   1.331   1.331
  589   2HB   PHE  76          1HB       PHE  76   3.062   2.670   2.670
  590    HD1  PHE  76           HD2      PHE  76   4.550   1.728   1.728
  591    HD2  PHE  76           HD1      PHE  76   2.371   4.663   4.663
  592    HE1  PHE  76           HE2      PHE  76   4.075   2.926   2.926
  593    HE2  PHE  76           HE1      PHE  76   1.899   5.866   5.866
  594    HZ   PHE  76           HZ       PHE  76   2.750   4.998   4.998
  595    H    LYS  77           H        LYS  77   3.964   3.135   3.135
  596    HA   LYS  77           HA       LYS  77   3.811   5.914   5.914
  597   1HB   LYS  77          2HB       LYS  77   3.931   4.007   4.007
  598   2HB   LYS  77          1HB       LYS  77   3.318   5.654   5.654
  599   1HG   LYS  77          2HG       LYS  77   1.738   4.726   4.726
  600   2HG   LYS  77          1HG       LYS  77   2.088   3.194   3.194
  601   1HD   LYS  77          2HD       LYS  77   1.010   5.674   5.674
  602   2HD   LYS  77          1HD       LYS  77   0.058   4.260   4.260
  603   1HE   LYS  77          2HE       LYS  77   1.305   2.873   2.873
  604   2HE   LYS  77          1HE       LYS  77   2.408   4.200   4.200
  605   1HZ   LYS  77          1HZ       LYS  77  -0.397   4.760   4.760
  606   2HZ   LYS  77          3HZ       LYS  77   0.274   3.585   3.585
  607   3HZ   LYS  77          2HZ       LYS  77   0.952   5.133   5.133
  608    H    LYS  78           H        LYS  78   6.494   3.849   3.849
  609    HA   LYS  78           HA       LYS  78   7.925   5.899   5.899
  610   1HB   LYS  78          2HB       LYS  78   8.168   3.005   3.005
  611   2HB   LYS  78          1HB       LYS  78   9.710   3.849   3.849
  612   1HG   LYS  78          2HG       LYS  78   7.826   4.498   4.498
  613   2HG   LYS  78          1HG       LYS  78   8.659   2.942   2.942
  614   1HD   LYS  78          2HD       LYS  78  10.794   3.992   3.992
  615   2HD   LYS  78          1HD       LYS  78  10.086   5.565   5.565
  616   1HE   LYS  78          2HE       LYS  78   9.580   5.983   5.983
  617   2HE   LYS  78          1HE       LYS  78   9.047   4.330   4.330
  618   1HZ   LYS  78          1HZ       LYS  78  11.909   5.044   5.044
  619   2HZ   LYS  78          3HZ       LYS  78  11.085   5.100   5.100
  620   3HZ   LYS  78          2HZ       LYS  78  11.233   3.634   3.634
  621    H    LYS  79           H        LYS  79   7.662   4.667   4.667
  622    HA   LYS  79           HA       LYS  79  10.204   5.859   5.859
  623   1HB   LYS  79          2HB       LYS  79   9.169   3.543   3.543
  624   2HB   LYS  79          1HB       LYS  79   8.375   4.560   4.560
  625   1HG   LYS  79          2HG       LYS  79  11.094   5.312   5.312
  626   2HG   LYS  79          1HG       LYS  79  11.037   3.549   3.549
  627   1HD   LYS  79          2HD       LYS  79   9.888   3.502   3.502
  628   2HD   LYS  79          1HD       LYS  79   9.331   5.168   5.168
  629   1HE   LYS  79          2HE       LYS  79  12.098   4.195   4.195
  630   2HE   LYS  79          1HE       LYS  79  11.018   5.169   5.169
  631   1HZ   LYS  79          3HZ       LYS  79  11.247   6.722   6.722
  632   2HZ   LYS  79          2HZ       LYS  79  12.764   5.975   5.975
  633   3HZ   LYS  79          1HZ       LYS  79  12.271   6.836   6.836
  634    H    PHE  80           H        PHE  80   6.747   6.353   6.353
  635    HA   PHE  80           HA       PHE  80   7.337   8.773   8.773
  636   1HB   PHE  80          2HB       PHE  80   4.733   7.258   7.258
  637   2HB   PHE  80          1HB       PHE  80   5.289   8.516   8.516
  638    HD1  PHE  80           HD2      PHE  80   6.987   8.033   8.033
  639    HD2  PHE  80           HD1      PHE  80   5.471   4.995   4.995
  640    HE1  PHE  80           HE2      PHE  80   7.927   6.315   6.315
  641    HE2  PHE  80           HE1      PHE  80   6.408   3.270   3.270
  642    HZ   PHE  80           HZ       PHE  80   7.638   3.931   3.931
  643    H    ALA  81           H        ALA  81   5.987   7.571   7.571
  644    HA   ALA  81           HA       ALA  81   5.127   8.682   8.682
  645   1HB   ALA  81          2HB       ALA  81   6.545  10.639  10.639
  646   2HB   ALA  81          1HB       ALA  81   4.921  11.320  11.320
  647   3HB   ALA  81          3HB       ALA  81   5.600  10.869  10.869
  648    H    CYS  82           H        CYS  82   3.560   7.538   7.538
  649    HA   CYS  82           HA       CYS  82   1.134   9.189   9.189
  650   1HB   CYS  82          2HB       CYS  82   1.585   6.737   6.737
  651   2HB   CYS  82          1HB       CYS  82   0.359   7.982   7.982
  652    HG   CYS  82           HG       CYS  82   2.352   9.612   9.612
  653    H    ASN  83           H        ASN  83  -0.726   7.129   7.129
  654    HA   ASN  83           HA       ASN  83  -0.589   5.597   5.597
  655   1HB   ASN  83          2HB       ASN  83  -2.322   6.976   6.976
  656   2HB   ASN  83          1HB       ASN  83  -2.726   7.318   7.318
  657   1HD2  ASN  83          2HD2      ASN  83  -4.968   4.612   4.612
  658   2HD2  ASN  83          1HD2      ASN  83  -3.851   5.613   5.613
  659    H    GLY  84           H        GLY  84  -0.508   3.480   3.480
  660   1HA   GLY  84          2HA       GLY  84  -1.653   2.401   2.401
  661   2HA   GLY  84          1HA       GLY  84  -0.249   1.723   1.723
  662    H    THR  85           H        THR  85  -3.509   1.385   1.385
  663    HA   THR  85           HA       THR  85  -3.838  -0.169  -0.169
  664    HB   THR  85           HB       THR  85  -6.183   0.240   0.240
  665    HG1  THR  85           HG1      THR  85  -5.685   1.293   1.293
  666   1HG2  THR  85          2HG2      THR  85  -4.673   2.750   2.750
  667   2HG2  THR  85          1HG2      THR  85  -6.369   2.731   2.731
  668   3HG2  THR  85          3HG2      THR  85  -5.130   2.139   2.139
  669    H    VAL  86           H        VAL  86  -5.124  -2.133  -2.133
  670    HA   VAL  86           HA       VAL  86  -4.796  -3.442  -3.442
  671    HB   VAL  86           HB       VAL  86  -3.420  -4.430  -4.430
  672   1HG1  VAL  86          3HG1      VAL  86  -5.533  -3.908  -3.908
  673   2HG1  VAL  86          2HG1      VAL  86  -5.645  -5.656  -5.656
  674   3HG1  VAL  86          1HG1      VAL  86  -4.154  -4.935  -4.935
  675   1HG2  VAL  86          3HG2      VAL  86  -5.679  -6.077  -6.077
  676   2HG2  VAL  86          2HG2      VAL  86  -4.026  -5.938  -5.938
  677   3HG2  VAL  86          1HG2      VAL  86  -4.348  -6.789  -6.789
  678    H    ILE  87           H        ILE  87  -6.731  -3.363  -3.363
  679    HA   ILE  87           HA       ILE  87  -9.116  -4.158  -4.158
  680    HB   ILE  87           HB       ILE  87 -10.486  -2.859  -2.859
  681   1HG1  ILE  87          2HG1      ILE  87  -8.650  -1.222  -1.222
  682   2HG1  ILE  87          1HG1      ILE  87  -8.082  -2.871  -2.871
  683   1HG2  ILE  87          2HG2      ILE  87  -8.185  -1.326  -1.326
  684   2HG2  ILE  87          1HG2      ILE  87  -9.659  -0.578  -0.578
  685   3HG2  ILE  87          3HG2      ILE  87  -9.739  -1.692  -1.692
  686   1HD1  ILE  87          3HD1      ILE  87 -10.399  -3.456  -3.456
  687   2HD1  ILE  87          2HD1      ILE  87 -10.769  -1.733  -1.733
  688   3HD1  ILE  87          1HD1      ILE  87  -9.526  -2.345  -2.345
  689    H    GLU  88           H        GLU  88 -10.711  -5.428  -5.428
  690    HA   GLU  88           HA       GLU  88  -9.547  -7.109  -7.109
  691   1HB   GLU  88          2HB       GLU  88 -10.503  -7.984  -7.984
  692   2HB   GLU  88          1HB       GLU  88 -12.040  -7.874  -7.874
  693   1HG   GLU  88          2HG       GLU  88 -10.413  -9.158  -9.158
  694   2HG   GLU  88          1HG       GLU  88  -9.901  -9.818  -9.818
  695    H    HIS  89           H        HIS  89 -10.075  -5.364  -5.364
  696    HA   HIS  89           HA       HIS  89 -12.625  -4.436  -4.436
  697   1HB   HIS  89          2HB       HIS  89 -10.207  -3.910  -3.910
  698   2HB   HIS  89          1HB       HIS  89 -10.801  -4.955  -4.955
  699    HD1  HIS  89           HD1      HIS  89 -12.294  -3.901  -3.901
  700    HD2  HIS  89           HD2      HIS  89 -11.902  -1.574  -1.574
  701    HE1  HIS  89           HE1      HIS  89 -13.472  -1.742  -1.742
  702    HE2  HIS  89           HE2      HIS  89 -13.165  -0.322  -0.322
  703    HA   PRO  90           HA       PRO  90 -14.594  -8.037  -8.037
  704   1HB   PRO  90          2HB       PRO  90 -16.849  -6.903  -6.903
  705   2HB   PRO  90          1HB       PRO  90 -16.514  -7.041  -7.041
  706   1HG   PRO  90          2HG       PRO  90 -16.207  -4.675  -4.675
  707   2HG   PRO  90          1HG       PRO  90 -16.857  -4.748  -4.748
  708   1HD   PRO  90          2HD       PRO  90 -14.296  -3.961  -3.961
  709   2HD   PRO  90          1HD       PRO  90 -14.777  -4.648  -4.648
  710    H    GLU  91           H        GLU  91 -13.764  -5.229  -5.229
  711    HA   GLU  91           HA       GLU  91 -14.512  -6.360  -6.360
  712   1HB   GLU  91          2HB       GLU  91 -13.828  -3.787  -3.787
  713   2HB   GLU  91          1HB       GLU  91 -12.695  -4.178  -4.178
  714   1HG   GLU  91          2HG       GLU  91 -15.614  -4.593  -4.593
  715   2HG   GLU  91          1HG       GLU  91 -14.932  -2.970  -2.970
  716    H    TYR  92           H        TYR  92 -11.719  -6.303  -6.303
  717    HA   TYR  92           HA       TYR  92 -10.152  -7.605  -7.605
  718   1HB   TYR  92          2HB       TYR  92  -8.824  -6.313  -6.313
  719   2HB   TYR  92          1HB       TYR  92  -8.207  -6.570  -6.570
  720    HD1  TYR  92           HD1      TYR  92 -10.369  -5.372  -5.372
  721    HD2  TYR  92           HD2      TYR  92  -8.568  -4.021  -4.021
  722    HE1  TYR  92           HE1      TYR  92 -10.952  -3.056  -3.056
  723    HE2  TYR  92           HE2      TYR  92  -9.145  -1.701  -1.701
  724    HH   TYR  92           HH       TYR  92 -11.325  -0.899  -0.899
  725    H    GLY  93           H        GLY  93 -10.529  -7.427  -7.427
  726   1HA   GLY  93          2HA       GLY  93 -10.953  -9.356  -9.356
  727   2HA   GLY  93          1HA       GLY  93 -10.201 -10.345 -10.345
  728    H    GLU  94           H        GLU  94  -9.654  -8.245  -8.245
  729    HA   GLU  94           HA       GLU  94  -7.929  -8.138  -8.138
  730   1HB   GLU  94          2HB       GLU  94  -7.763 -10.700 -10.700
  731   2HB   GLU  94          1HB       GLU  94  -6.189 -10.087 -10.087
  732   1HG   GLU  94          2HG       GLU  94  -5.521  -9.690  -9.690
  733   2HG   GLU  94          1HG       GLU  94  -7.175  -9.628  -9.628
  734    H    VAL  95           H        VAL  95  -7.355  -6.066  -6.066
  735    HA   VAL  95           HA       VAL  95  -4.842  -5.898  -5.898
  736    HB   VAL  95           HB       VAL  95  -5.668  -3.877  -3.877
  737   1HG1  VAL  95          3HG1      VAL  95  -5.617  -6.366  -6.366
  738   2HG1  VAL  95          2HG1      VAL  95  -7.370  -6.177  -6.177
  739   3HG1  VAL  95          1HG1      VAL  95  -6.362  -5.109  -5.109
  740   1HG2  VAL  95          1HG2      VAL  95  -7.777  -3.932  -3.932
  741   2HG2  VAL  95          3HG2      VAL  95  -7.801  -3.140  -3.140
  742   3HG2  VAL  95          2HG2      VAL  95  -8.467  -4.763  -4.763
  743    H    ILE  96           H        ILE  96  -3.559  -4.106  -4.106
  744    HA   ILE  96           HA       ILE  96  -4.147  -2.997  -2.997
  745    HB   ILE  96           HB       ILE  96  -1.746  -3.256  -3.256
  746   1HG1  ILE  96          2HG1      ILE  96  -2.416  -4.593  -4.593
  747   2HG1  ILE  96          1HG1      ILE  96  -0.757  -4.003  -4.003
  748   1HG2  ILE  96          1HG2      ILE  96  -2.040  -0.923  -0.923
  749   2HG2  ILE  96          3HG2      ILE  96  -0.506  -1.497  -1.497
  750   3HG2  ILE  96          2HG2      ILE  96  -1.742  -0.852  -0.852
  751   1HD1  ILE  96          2HD1      ILE  96  -2.170  -1.995  -1.995
  752   2HD1  ILE  96          1HD1      ILE  96  -2.832  -3.496  -3.496
  753   3HD1  ILE  96          3HD1      ILE  96  -1.100  -3.186  -3.186
  754    H    GLN  97           H        GLN  97  -4.999  -1.071  -1.071
  755    HA   GLN  97           HA       GLN  97  -5.389   0.732   0.732
  756   1HB   GLN  97          2HB       GLN  97  -7.056  -0.127  -0.127
  757   2HB   GLN  97          1HB       GLN  97  -6.797   1.599   1.599
  758   1HG   GLN  97          2HG       GLN  97  -7.461   1.874   1.874
  759   2HG   GLN  97          1HG       GLN  97  -7.952   0.180   0.180
  760   1HE2  GLN  97          2HE2      GLN  97 -11.102   1.045   1.045
  761   2HE2  GLN  97          1HE2      GLN  97 -10.078   0.106   0.106
  762    H    LEU  98           H        LEU  98  -3.876   2.223   2.223
  763    HA   LEU  98           HA       LEU  98  -2.565   3.376   3.376
  764   1HB   LEU  98          2HB       LEU  98  -1.994   3.198   3.198
  765   2HB   LEU  98          1HB       LEU  98  -1.481   4.676   4.676
  766    HG   LEU  98           HG       LEU  98   0.046   3.556   3.556
  767   1HD1  LEU  98          3HD1      LEU  98  -1.784   1.326   1.326
  768   2HD1  LEU  98          2HD1      LEU  98  -0.100   0.835   0.835
  769   3HD1  LEU  98          1HD1      LEU  98  -0.625   1.682   1.682
  770   1HD2  LEU  98          2HD2      LEU  98   0.675   3.677   3.677
  771   2HD2  LEU  98          1HD2      LEU  98   1.468   2.369   2.369
  772   3HD2  LEU  98          3HD2      LEU  98   0.110   2.017   2.017
  773    H    GLN  99           H        GLN  99  -2.313   5.800   5.800
  774    HA   GLN  99           HA       GLN  99  -4.890   7.012   7.012
  775   1HB   GLN  99          2HB       GLN  99  -3.051   7.290   7.290
  776   2HB   GLN  99          1HB       GLN  99  -3.575   8.837   8.837
  777   1HG   GLN  99          2HG       GLN  99  -5.673   6.807   6.807
  778   2HG   GLN  99          1HG       GLN  99  -4.918   7.509   7.509
  779   1HE2  GLN  99          2HE2      GLN  99  -7.098   9.897   9.897
  780   2HE2  GLN  99          1HE2      GLN  99  -6.317   8.477   8.477
  781    H    GLY 100           H        GLY 100  -5.051   8.835   8.835
  782   1HA   GLY 100          2HA       GLY 100  -4.384  10.610  10.610
  783   2HA   GLY 100          1HA       GLY 100  -2.741  10.379  10.379
  784    H    ASP 101           H        ASP 101  -2.398  10.912  10.912
  785    HA   ASP 101           HA       ASP 101  -2.877   8.668   8.668
  786   1HB   ASP 101          2HB       ASP 101  -1.895  10.139  10.139
  787   2HB   ASP 101          1HB       ASP 101  -3.262  10.883  10.883
  788    H    GLN 102           H        GLN 102  -1.546   7.113   7.113
  789    HA   GLN 102           HA       GLN 102   1.337   7.629   7.629
  790   1HB   GLN 102          2HB       GLN 102  -0.404   5.767   5.767
  791   2HB   GLN 102          1HB       GLN 102   1.249   5.278   5.278
  792   1HG   GLN 102          2HG       GLN 102   0.630   6.541   6.541
  793   2HG   GLN 102          1HG       GLN 102   2.148   6.865   6.865
  794   1HE2  GLN 102          2HE2      GLN 102  -0.857   9.633   9.633
  795   2HE2  GLN 102          1HE2      GLN 102  -1.222   7.944   7.944
  796    H    ARG 103           H        ARG 103  -0.926   6.534   6.534
  797    HA   ARG 103           HA       ARG 103  -0.254   4.035   4.035
  798   1HB   ARG 103          2HB       ARG 103  -0.927   4.842   4.842
  799   2HB   ARG 103          1HB       ARG 103  -2.089   5.170   5.170
  800   1HG   ARG 103          2HG       ARG 103  -2.113   7.268   7.268
  801   2HG   ARG 103          1HG       ARG 103  -0.494   7.429   7.429
  802   1HD   ARG 103          2HD       ARG 103   0.276   7.828   7.828
  803   2HD   ARG 103          1HD       ARG 103  -0.167   6.183   6.183
  804    HE   ARG 103           HE       ARG 103  -2.486   7.534   7.534
  805   1HH1  ARG 103          2HH1      ARG 103   0.749   8.100   8.100
  806   2HH1  ARG 103          1HH1      ARG 103   0.219   8.902   8.902
  807   1HH2  ARG 103          1HH2      ARG 103  -3.187   8.588   8.588
  808   2HH2  ARG 103          2HH2      ARG 103  -2.016   9.179   9.179
  809    H    LYS 104           H        LYS 104   1.581   6.969   6.969
  810    HA   LYS 104           HA       LYS 104   3.454   5.761   5.761
  811   1HB   LYS 104          2HB       LYS 104   2.582   8.337   8.337
  812   2HB   LYS 104          1HB       LYS 104   4.140   8.375   8.375
  813   1HG   LYS 104          2HG       LYS 104   5.063   7.285   7.285
  814   2HG   LYS 104          1HG       LYS 104   3.537   7.763   7.763
  815   1HD   LYS 104          2HD       LYS 104   5.025   9.821   9.821
  816   2HD   LYS 104          1HD       LYS 104   5.682   9.333   9.333
  817   1HE   LYS 104          2HE       LYS 104   2.908  10.387  10.387
  818   2HE   LYS 104          1HE       LYS 104   4.220  11.252  11.252
  819   1HZ   LYS 104          1HZ       LYS 104   3.875   8.843   8.843
  820   2HZ   LYS 104          3HZ       LYS 104   2.331   9.501   9.501
  821   3HZ   LYS 104          2HZ       LYS 104   3.532  10.403  10.403
  822    H    ASN 105           H        ASN 105   3.138   6.480   6.480
  823    HA   ASN 105           HA       ASN 105   5.964   6.073   6.073
  824   1HB   ASN 105          2HB       ASN 105   3.568   6.657   6.657
  825   2HB   ASN 105          1HB       ASN 105   5.138   6.252   6.252
  826   1HD2  ASN 105          2HD2      ASN 105   4.358   9.954   9.954
  827   2HD2  ASN 105          1HD2      ASN 105   3.180   8.692   8.692
  828    H    ILE 106           H        ILE 106   2.959   4.280   4.280
  829    HA   ILE 106           HA       ILE 106   3.890   2.181   2.181
  830    HB   ILE 106           HB       ILE 106   1.501   2.605   2.605
  831   1HG1  ILE 106          2HG1      ILE 106   0.828   0.248   0.248
  832   2HG1  ILE 106          1HG1      ILE 106   2.425  -0.162  -0.162
  833   1HG2  ILE 106          2HG2      ILE 106   1.743   3.082   3.082
  834   2HG2  ILE 106          1HG2      ILE 106   1.937   1.350   1.350
  835   3HG2  ILE 106          3HG2      ILE 106   0.427   1.975   1.975
  836   1HD1  ILE 106          1HD1      ILE 106   2.392   1.243   1.243
  837   2HD1  ILE 106          3HD1      ILE 106   1.704  -0.381  -0.381
  838   3HD1  ILE 106          2HD1      ILE 106   3.364  -0.125  -0.125
  839    H    CYS 107           H        CYS 107   3.635   2.432   2.432
  840    HA   CYS 107           HA       CYS 107   4.724  -0.082  -0.082
  841   1HB   CYS 107          2HB       CYS 107   5.423   1.036   1.036
  842   2HB   CYS 107          1HB       CYS 107   3.712   1.153   1.153
  843    HG   CYS 107           HG       CYS 107   4.546   3.484   3.484
  844    H    GLN 108           H        GLN 108   6.145   2.994   2.994
  845    HA   GLN 108           HA       GLN 108   8.862   2.251   2.251
  846   1HB   GLN 108          2HB       GLN 108   8.615   4.537   4.537
  847   2HB   GLN 108          1HB       GLN 108   7.408   4.569   4.569
  848   1HG   GLN 108          2HG       GLN 108   9.031   5.497   5.497
  849   2HG   GLN 108          1HG       GLN 108   9.616   3.848   3.848
  850   1HE2  GLN 108          2HE2      GLN 108  12.465   4.264   4.264
  851   2HE2  GLN 108          1HE2      GLN 108  11.389   3.151   3.151
  852    H    PHE 109           H        PHE 109   6.634   2.100   2.100
  853    HA   PHE 109           HA       PHE 109   8.563   1.511   1.511
  854   1HB   PHE 109          2HB       PHE 109   6.416   2.465   2.465
  855   2HB   PHE 109          1HB       PHE 109   5.565   1.115   1.115
  856    HD1  PHE 109           HD2      PHE 109   8.136   1.779   1.779
  857    HD2  PHE 109           HD1      PHE 109   4.816  -0.568  -0.568
  858    HE1  PHE 109           HE2      PHE 109   8.156   0.602   0.602
  859    HE2  PHE 109           HE1      PHE 109   4.829  -1.749  -1.749
  860    HZ   PHE 109           HZ       PHE 109   6.501  -1.165  -1.165
  861    H    LEU 110           H        LEU 110   6.348  -0.388  -0.388
  862    HA   LEU 110           HA       LEU 110   6.840  -2.905  -2.905
  863   1HB   LEU 110          2HB       LEU 110   5.795  -1.883  -1.883
  864   2HB   LEU 110          1HB       LEU 110   6.308  -3.557  -3.557
  865    HG   LEU 110           HG       LEU 110   4.651  -4.154  -4.154
  866   1HD1  LEU 110          1HD1      LEU 110   4.310  -1.209  -1.209
  867   2HD1  LEU 110          3HD1      LEU 110   3.220  -2.454  -2.454
  868   3HD1  LEU 110          2HD1      LEU 110   4.910  -2.435  -2.435
  869   1HD2  LEU 110          3HD2      LEU 110   3.908  -3.427  -3.427
  870   2HD2  LEU 110          2HD2      LEU 110   2.678  -3.701  -3.701
  871   3HD2  LEU 110          1HD2      LEU 110   3.171  -2.057  -2.057
  872    H    VAL 111           H        VAL 111   8.673  -0.978  -0.978
  873    HA   VAL 111           HA       VAL 111  10.466  -3.193  -3.193
  874    HB   VAL 111           HB       VAL 111  10.586  -0.323  -0.323
  875   1HG1  VAL 111          3HG1      VAL 111  12.724  -1.620  -1.620
  876   2HG1  VAL 111          2HG1      VAL 111  11.936  -2.755  -2.755
  877   3HG1  VAL 111          1HG1      VAL 111  12.155  -1.071  -1.071
  878   1HG2  VAL 111          3HG2      VAL 111   8.602  -2.017  -2.017
  879   2HG2  VAL 111          2HG2      VAL 111   9.237  -0.819  -0.819
  880   3HG2  VAL 111          1HG2      VAL 111   9.785  -2.493  -2.493
  881    H    GLU 112           H        GLU 112  10.328  -0.303  -0.303
  882    HA   GLU 112           HA       GLU 112  13.117  -0.103  -0.103
  883   1HB   GLU 112          2HB       GLU 112  10.647   1.026   1.026
  884   2HB   GLU 112          1HB       GLU 112  12.217   1.235   1.235
  885   1HG   GLU 112          2HG       GLU 112  12.272   1.916   1.916
  886   2HG   GLU 112          1HG       GLU 112  11.082   2.860   2.860
  887    H    ILE 113           H        ILE 113  10.403  -1.640  -1.640
  888    HA   ILE 113           HA       ILE 113  12.143  -2.641  -2.641
  889    HB   ILE 113           HB       ILE 113  10.192  -3.407  -3.407
  890   1HG1  ILE 113          2HG1      ILE 113   8.738  -2.967  -2.967
  891   2HG1  ILE 113          1HG1      ILE 113   9.059  -4.513  -4.513
  892   1HG2  ILE 113          2HG2      ILE 113  10.600  -0.830  -0.830
  893   2HG2  ILE 113          1HG2      ILE 113   9.026  -0.973  -0.973
  894   3HG2  ILE 113          3HG2      ILE 113   9.208  -1.406  -1.406
  895   1HD1  ILE 113          1HD1      ILE 113   7.669  -2.923  -2.923
  896   2HD1  ILE 113          3HD1      ILE 113   6.835  -2.775  -2.775
  897   3HD1  ILE 113          2HD1      ILE 113   7.110  -4.369  -4.369
  898    H    GLY 114           H        GLY 114  10.677  -3.721  -3.721
  899   1HA   GLY 114          2HA       GLY 114  11.446  -5.628  -5.628
  900   2HA   GLY 114          1HA       GLY 114  11.988  -6.321  -6.321
  901    H    LEU 115           H        LEU 115   8.848  -4.864  -4.864
  902    HA   LEU 115           HA       LEU 115   7.555  -7.284  -7.284
  903   1HB   LEU 115          2HB       LEU 115   6.989  -4.612  -4.612
  904   2HB   LEU 115          1HB       LEU 115   5.861  -5.116  -5.116
  905    HG   LEU 115           HG       LEU 115   4.809  -6.677  -6.677
  906   1HD1  LEU 115          1HD1      LEU 115   7.258  -6.303  -6.303
  907   2HD1  LEU 115          3HD1      LEU 115   5.747  -6.587  -6.587
  908   3HD1  LEU 115          2HD1      LEU 115   6.320  -7.761  -7.761
  909   1HD2  LEU 115          1HD2      LEU 115   4.692  -3.997  -3.997
  910   2HD2  LEU 115          3HD2      LEU 115   3.666  -5.163  -5.163
  911   3HD2  LEU 115          2HD2      LEU 115   5.116  -4.538  -4.538
  912    H    ALA 116           H        ALA 116   6.732  -5.178  -5.178
  913    HA   ALA 116           HA       ALA 116   5.817  -7.519  -7.519
  914   1HB   ALA 116          1HB       ALA 116   4.540  -5.296  -5.296
  915   2HB   ALA 116          3HB       ALA 116   5.683  -4.699  -4.699
  916   3HB   ALA 116          2HB       ALA 116   4.637  -6.067  -6.067
  917    H    LYS 117           H        LYS 117   6.255  -7.109  -7.109
  918    HA   LYS 117           HA       LYS 117   9.180  -6.864  -6.864
  919   1HB   LYS 117          2HB       LYS 117   7.477  -8.993  -8.993
  920   2HB   LYS 117          1HB       LYS 117   7.982  -8.259  -8.259
  921   1HG   LYS 117          2HG       LYS 117   9.462 -10.083 -10.083
  922   2HG   LYS 117          1HG       LYS 117  10.303  -8.535  -8.535
  923   1HD   LYS 117          2HD       LYS 117   9.187  -9.032  -9.032
  924   2HD   LYS 117          1HD       LYS 117  10.349 -10.265 -10.265
  925   1HE   LYS 117          2HE       LYS 117  11.688  -8.066  -8.066
  926   2HE   LYS 117          1HE       LYS 117  10.750  -7.394  -7.394
  927   1HZ   LYS 117          3HZ       LYS 117  12.056  -9.933  -9.933
  928   2HZ   LYS 117          2HZ       LYS 117  13.091  -8.613  -8.613
  929   3HZ   LYS 117          1HZ       LYS 117  11.902  -8.567  -8.567
  930    H    ASP 118           H        ASP 118  10.022  -5.937  -5.937
  931    HA   ASP 118           HA       ASP 118   8.723  -3.592  -3.592
  932   1HB   ASP 118          2HB       ASP 118  10.495  -3.294  -3.294
  933   2HB   ASP 118          1HB       ASP 118  11.191  -4.017  -4.017
  934    H    ASP 119           H        ASP 119   8.612  -6.830  -6.830
  935    HA   ASP 119           HA       ASP 119   7.328  -6.094  -6.094
  936   1HB   ASP 119          2HB       ASP 119   8.205  -8.619  -8.619
  937   2HB   ASP 119          1HB       ASP 119   6.866  -8.739  -8.739
  938    H    GLN 120           H        GLN 120   6.399  -6.836  -6.836
  939    HA   GLN 120           HA       GLN 120   3.623  -7.341  -7.341
  940   1HB   GLN 120          2HB       GLN 120   4.849  -7.138  -7.138
  941   2HB   GLN 120          1HB       GLN 120   3.281  -7.817  -7.817
  942   1HG   GLN 120          2HG       GLN 120   4.588  -9.506  -9.506
  943   2HG   GLN 120          1HG       GLN 120   6.006  -8.945  -8.945
  944   1HE2  GLN 120          2HE2      GLN 120   4.259 -10.004 -10.004
  945   2HE2  GLN 120          1HE2      GLN 120   4.655  -8.470  -8.470
  946    H    LEU 121           H        LEU 121   5.522  -4.677  -4.677
  947    HA   LEU 121           HA       LEU 121   4.081  -2.958  -2.958
  948   1HB   LEU 121          2HB       LEU 121   5.876  -2.524  -2.524
  949   2HB   LEU 121          1HB       LEU 121   5.049  -1.165  -1.165
  950    HG   LEU 121           HG       LEU 121   6.856  -3.036  -3.036
  951   1HD1  LEU 121          1HD1      LEU 121   7.478  -0.377  -0.377
  952   2HD1  LEU 121          3HD1      LEU 121   8.516  -1.207  -1.207
  953   3HD1  LEU 121          2HD1      LEU 121   8.184  -1.942  -1.942
  954   1HD2  LEU 121          3HD2      LEU 121   5.147  -0.767  -0.767
  955   2HD2  LEU 121          2HD2      LEU 121   5.847  -2.016  -2.016
  956   3HD2  LEU 121          1HD2      LEU 121   6.805  -0.607  -0.607
  957    H    LYS 122           H        LYS 122   1.872  -3.349  -3.349
  958    HA   LYS 122           HA       LYS 122   0.793  -2.336  -2.336
  959   1HB   LYS 122          2HB       LYS 122  -0.054  -4.459  -4.459
  960   2HB   LYS 122          1HB       LYS 122  -1.343  -3.502  -3.502
  961   1HG   LYS 122          2HG       LYS 122   0.795  -4.866  -4.866
  962   2HG   LYS 122          1HG       LYS 122  -0.757  -5.610  -5.610
  963   1HD   LYS 122          2HD       LYS 122  -1.907  -4.285  -4.285
  964   2HD   LYS 122          1HD       LYS 122  -0.847  -2.899  -2.899
  965   1HE   LYS 122          2HE       LYS 122   0.886  -4.000  -4.000
  966   2HE   LYS 122          1HE       LYS 122  -0.219  -5.341  -5.341
  967   1HZ   LYS 122          1HZ       LYS 122  -0.783  -2.525  -2.525
  968   2HZ   LYS 122          3HZ       LYS 122  -0.139  -3.679  -3.679
  969   3HZ   LYS 122          2HZ       LYS 122  -1.689  -3.892  -3.892
  970    H    VAL 123           H        VAL 123   1.096  -0.140  -0.140
  971    HA   VAL 123           HA       VAL 123  -0.541   0.689   0.689
  972    HB   VAL 123           HB       VAL 123   1.753   1.588   1.588
  973   1HG1  VAL 123          1HG1      VAL 123   1.169   1.850   1.850
  974   2HG1  VAL 123          3HG1      VAL 123   0.996   3.511   3.511
  975   3HG1  VAL 123          2HG1      VAL 123   2.513   2.647   2.647
  976   1HG2  VAL 123          2HG2      VAL 123  -0.030   2.798   2.798
  977   2HG2  VAL 123          1HG2      VAL 123   1.205   3.862   3.862
  978   3HG2  VAL 123          3HG2      VAL 123  -0.364   3.723   3.723
  979    H    HIS 124           H        HIS 124  -2.508   1.518   1.518
  980    HA   HIS 124           HA       HIS 124  -3.292   2.819   2.819
  981   1HB   HIS 124          2HB       HIS 124  -5.138   0.926   0.926
  982   2HB   HIS 124          1HB       HIS 124  -5.357   1.643   1.643
  983    HD1  HIS 124           HD1      HIS 124  -4.599   0.282   0.282
  984    HD2  HIS 124           HD2      HIS 124  -2.983  -1.055  -1.055
  985    HE1  HIS 124           HE1      HIS 124  -3.386  -1.847  -1.847
  986    HE2  HIS 124           HE2      HIS 124  -2.540  -2.706  -2.706
  987    H    GLY 125           H        GLY 125  -2.489   4.115   4.115
  988   1HA   GLY 125          2HA       GLY 125  -4.489   4.746   4.746
  989   2HA   GLY 125          1HA       GLY 125  -3.144   5.795   5.795
  990    H    PHE 126           HN       PHE 126  -6.477   4.974   4.974
  991    HA   PHE 126           HA       PHE 126  -8.184   6.179   6.179
  992   1HB   PHE 126          2HB       PHE 126  -6.561   8.030   8.030
  993   2HB   PHE 126          1HB       PHE 126  -6.935   8.775   8.775
  994    HD1  PHE 126           HD2      PHE 126  -9.685   7.572   7.572
  995    HD2  PHE 126           HD1      PHE 126  -7.785   9.394   9.394
  996    HE1  PHE 126           HE2      PHE 126 -11.885   8.245   8.245
  997    HE2  PHE 126           HE1      PHE 126  -9.985  10.071  10.071
  998    HZ   PHE 126           HZ       PHE 126 -12.035   9.497   9.497

  Start of MODEL   24
    1   1H    MET   1          1H        MET   1   6.363   7.515   7.515
    2   2H    MET   1          3H        MET   1   5.361   8.884   8.884
    3   3H    MET   1          2H        MET   1   6.370   8.801   8.801
    4    HA   MET   1           HA       MET   1   7.438  10.228  10.228
    5   1HB   MET   1          2HB       MET   1   5.935   9.068   9.068
    6   2HB   MET   1          1HB       MET   1   7.501   8.357   8.357
    7   1HG   MET   1          2HG       MET   1   8.376  10.775  10.775
    8   2HG   MET   1          1HG       MET   1   6.679  11.231  11.231
    9   1HE   MET   1          1HE       MET   1   5.556   8.928   8.928
   10   2HE   MET   1          3HE       MET   1   5.859   9.088   9.088
   11   3HE   MET   1          2HE       MET   1   5.158  10.432  10.432
   12    H    ARG   2           H        ARG   2   9.660  10.251  10.251
   13    HA   ARG   2           HA       ARG   2  11.071   8.127   8.127
   14   1HB   ARG   2          2HB       ARG   2  11.746  10.753  10.753
   15   2HB   ARG   2          1HB       ARG   2  13.051   9.576   9.576
   16   1HG   ARG   2          2HG       ARG   2  11.433  10.224  10.224
   17   2HG   ARG   2          1HG       ARG   2  12.853  11.162  11.162
   18   1HD   ARG   2          2HD       ARG   2  13.085   8.197   8.197
   19   2HD   ARG   2          1HD       ARG   2  13.039   9.110   9.110
   20    HE   ARG   2           HE       ARG   2  15.212   8.947   8.947
   21   1HH1  ARG   2          2HH1      ARG   2  13.655  11.042  11.042
   22   2HH1  ARG   2          1HH1      ARG   2  15.094  11.944  11.944
   23   1HH2  ARG   2          1HH2      ARG   2  17.106  10.131  10.131
   24   2HH2  ARG   2          2HH2      ARG   2  17.054  11.426  11.426
   25    H    GLY   3           H        GLY   3  10.587   9.073   9.073
   26   1HA   GLY   3          2HA       GLY   3  10.597   6.949   6.949
   27   2HA   GLY   3          1HA       GLY   3  12.248   6.792   6.792
   28    H    SER   4           H        SER   4  11.156   7.139   7.139
   29    HA   SER   4           HA       SER   4  12.259   9.749   9.749
   30   1HB   SER   4          2HB       SER   4  10.008   8.956   8.956
   31   2HB   SER   4          1HB       SER   4  10.897   7.771   7.771
   32    HG   SER   4           HG       SER   4  12.051   9.579   9.579
   33    H    HIS   5           H        HIS   5  14.105   7.853   7.853
   34    HA   HIS   5           HA       HIS   5  16.162   7.047   7.047
   35   1HB   HIS   5          2HB       HIS   5  15.720   9.095   9.095
   36   2HB   HIS   5          1HB       HIS   5  16.252   7.733   7.733
   37    HD1  HIS   5           HD1      HIS   5  18.267   9.688   9.688
   38    HD2  HIS   5           HD2      HIS   5  18.075   7.389   7.389
   39    HE1  HIS   5           HE1      HIS   5  20.545   9.862   9.862
   40    HE2  HIS   5           HE2      HIS   5  20.431   8.393   8.393
   41    H    HIS   6           H        HIS   6  14.581   6.742   6.742
   42    HA   HIS   6           HA       HIS   6  13.955   4.000   4.000
   43   1HB   HIS   6          2HB       HIS   6  16.628   4.281   4.281
   44   2HB   HIS   6          1HB       HIS   6  16.161   4.231   4.231
   45    HD1  HIS   6           HD1      HIS   6  17.741   1.991   1.991
   46    HD2  HIS   6           HD2      HIS   6  13.775   1.893   1.893
   47    HE1  HIS   6           HE1      HIS   6  17.112  -0.443  -0.443
   48    HE2  HIS   6           HE2      HIS   6  14.682  -0.473  -0.473
   49    H    HIS   7           H        HIS   7  14.958   6.526   6.526
   50    HA   HIS   7           HA       HIS   7  13.513   5.547   5.547
   51   1HB   HIS   7          2HB       HIS   7  14.741   8.175   8.175
   52   2HB   HIS   7          1HB       HIS   7  13.653   8.101   8.101
   53    HD1  HIS   7           HD1      HIS   7  14.437   6.667   6.667
   54    HD2  HIS   7           HD2      HIS   7  17.252   7.064   7.064
   55    HE1  HIS   7           HE1      HIS   7  16.617   5.921   5.921
   56    HE2  HIS   7           HE2      HIS   7  18.322   6.258   6.258
   57    H    HIS   8           H        HIS   8  11.704   6.845   6.845
   58    HA   HIS   8           HA       HIS   8   9.850   8.010   8.010
   59   1HB   HIS   8          2HB       HIS   8   9.576   5.353   5.353
   60   2HB   HIS   8          1HB       HIS   8   8.218   6.372   6.372
   61    HD1  HIS   8           HD1      HIS   8   9.798   4.733   4.733
   62    HD2  HIS   8           HD2      HIS   8   6.540   7.172   7.172
   63    HE1  HIS   8           HE1      HIS   8   8.375   4.694   4.694
   64    HE2  HIS   8           HE2      HIS   8   6.455   6.247   6.247
   65    H    HIS   9           H        HIS   9   9.817   6.862   6.862
   66    HA   HIS   9           HA       HIS   9   9.341   9.613   9.613
   67   1HB   HIS   9          2HB       HIS   9   7.432   7.383   7.383
   68   2HB   HIS   9          1HB       HIS   9   7.682   8.227   8.227
   69    HD1  HIS   9           HD1      HIS   9   7.482   9.694   9.694
   70    HD2  HIS   9           HD2      HIS   9   5.505   9.841   9.841
   71    HE1  HIS   9           HE1      HIS   9   5.717  11.465  11.465
   72    HE2  HIS   9           HE2      HIS   9   4.477  11.475  11.475
   73    H    HIS  10           H        HIS  10   9.146   9.450   9.450
   74    HA   HIS  10           HA       HIS  10  11.712   8.807   8.807
   75   1HB   HIS  10          2HB       HIS  10   9.149   9.258   9.258
   76   2HB   HIS  10          1HB       HIS  10  10.733   9.122   9.122
   77    HD1  HIS  10           HD1      HIS  10  12.196  10.855  10.855
   78    HD2  HIS  10           HD2      HIS  10   8.814  11.933  11.933
   79    HE1  HIS  10           HE1      HIS  10  12.130  13.367  13.367
   80    HE2  HIS  10           HE2      HIS  10  10.026  13.994  13.994
   81    H    THR  11           H        THR  11   8.648   7.193   7.193
   82    HA   THR  11           HA       THR  11  10.202   4.763   4.763
   83    HB   THR  11           HB       THR  11   7.375   5.069   5.069
   84    HG1  THR  11           HG1      THR  11   9.578   6.322   6.322
   85   1HG2  THR  11          2HG2      THR  11   9.287   3.179   3.179
   86   2HG2  THR  11          1HG2      THR  11   9.401   4.196   4.196
   87   3HG2  THR  11          3HG2      THR  11   7.859   3.463   3.463
   88    H    ASP  12           H        ASP  12  10.239   3.605   3.605
   89    HA   ASP  12           HA       ASP  12   8.241   3.534   3.534
   90   1HB   ASP  12          2HB       ASP  12  10.214   1.327   1.327
   91   2HB   ASP  12          1HB       ASP  12   9.416   1.642   1.642
   92    HA   PRO  13           HA       PRO  13   5.057   1.313   1.313
   93   1HB   PRO  13          2HB       PRO  13   4.120   0.885   0.885
   94   2HB   PRO  13          1HB       PRO  13   3.219   1.442   1.442
   95   1HG   PRO  13          2HG       PRO  13   3.970   3.161   3.161
   96   2HG   PRO  13          1HG       PRO  13   4.031   3.610   3.610
   97   1HD   PRO  13          2HD       PRO  13   6.253   2.877   2.877
   98   2HD   PRO  13          1HD       PRO  13   6.231   4.047   4.047
   99    H    MET  14           H        MET  14   6.887   0.113   0.113
  100    HA   MET  14           HA       MET  14   6.066  -2.621  -2.621
  101   1HB   MET  14          2HB       MET  14   8.009  -1.192  -1.192
  102   2HB   MET  14          1HB       MET  14   8.138  -2.936  -2.936
  103   1HG   MET  14          2HG       MET  14   6.433  -3.288  -3.288
  104   2HG   MET  14          1HG       MET  14   5.413  -2.140  -2.140
  105   1HE   MET  14          1HE       MET  14   4.291  -1.941  -1.941
  106   2HE   MET  14          3HE       MET  14   4.325  -0.188  -0.188
  107   3HE   MET  14          2HE       MET  14   4.774  -0.914  -0.914
  108    H    SER  15           H        SER  15   8.207  -0.615  -0.615
  109    HA   SER  15           HA       SER  15  10.347  -2.379  -2.379
  110   1HB   SER  15          2HB       SER  15  11.038  -0.829  -0.829
  111   2HB   SER  15          1HB       SER  15  10.235   0.149   0.149
  112    HG   SER  15           HG       SER  15   9.609  -0.170  -0.170
  113    H    ALA  16           H        ALA  16   7.304  -1.748  -1.748
  114    HA   ALA  16           HA       ALA  16   7.783  -4.191  -4.191
  115   1HB   ALA  16          3HB       ALA  16   6.800  -1.515  -1.515
  116   2HB   ALA  16          2HB       ALA  16   6.152  -2.944  -2.944
  117   3HB   ALA  16          1HB       ALA  16   7.888  -2.633  -2.633
  118    H    ILE  17           H        ILE  17   6.674  -5.212  -5.212
  119    HA   ILE  17           HA       ILE  17   3.816  -4.683  -4.683
  120    HB   ILE  17           HB       ILE  17   5.442  -6.745  -6.745
  121   1HG1  ILE  17          2HG1      ILE  17   4.553  -4.272  -4.272
  122   2HG1  ILE  17          1HG1      ILE  17   5.861  -4.078  -4.078
  123   1HG2  ILE  17          2HG2      ILE  17   2.717  -5.566  -5.566
  124   2HG2  ILE  17          1HG2      ILE  17   3.573  -6.663  -6.663
  125   3HG2  ILE  17          3HG2      ILE  17   3.071  -7.215  -7.215
  126   1HD1  ILE  17          1HD1      ILE  17   5.885  -6.030  -6.030
  127   2HD1  ILE  17          3HD1      ILE  17   6.636  -4.434  -4.434
  128   3HD1  ILE  17          2HD1      ILE  17   7.215  -5.663  -5.663
  129    H    GLN  18           H        GLN  18   2.220  -6.272  -6.272
  130    HA   GLN  18           HA       GLN  18   3.001  -8.262  -8.262
  131   1HB   GLN  18          2HB       GLN  18   1.217  -6.572  -6.572
  132   2HB   GLN  18          1HB       GLN  18   0.221  -7.327  -7.327
  133   1HG   GLN  18          2HG       GLN  18  -0.422  -8.936  -8.936
  134   2HG   GLN  18          1HG       GLN  18   1.236  -9.278  -9.278
  135   1HE2  GLN  18          2HE2      GLN  18  -1.239  -7.161  -7.161
  136   2HE2  GLN  18          1HE2      GLN  18  -1.715  -7.762  -7.762
  137    H    ASN  19           H        ASN  19   3.664 -10.027 -10.027
  138    HA   ASN  19           HA       ASN  19   1.597 -11.504 -11.504
  139   1HB   ASN  19          2HB       ASN  19   3.163 -10.007 -10.007
  140   2HB   ASN  19          1HB       ASN  19   4.210 -11.415 -11.415
  141   1HD2  ASN  19          2HD2      ASN  19   1.813 -11.670 -11.670
  142   2HD2  ASN  19          1HD2      ASN  19   2.824 -10.388 -10.388
  143    H    LEU  20           H        LEU  20   1.882 -12.706 -12.706
  144    HA   LEU  20           HA       LEU  20   3.541 -14.975 -14.975
  145   1HB   LEU  20          2HB       LEU  20   5.106 -13.126 -13.126
  146   2HB   LEU  20          1HB       LEU  20   4.280 -13.377 -13.377
  147    HG   LEU  20           HG       LEU  20   6.397 -14.618 -14.618
  148   1HD1  LEU  20          2HD1      LEU  20   4.428 -15.437 -15.437
  149   2HD1  LEU  20          1HD1      LEU  20   4.062 -16.515 -16.515
  150   3HD1  LEU  20          3HD1      LEU  20   5.583 -16.684 -16.684
  151   1HD2  LEU  20          2HD2      LEU  20   5.975 -15.008 -15.008
  152   2HD2  LEU  20          1HD2      LEU  20   6.909 -16.160 -16.160
  153   3HD2  LEU  20          3HD2      LEU  20   5.219 -16.493 -16.493
  154    H    HIS  21           H        HIS  21   1.390 -15.823 -15.823
  155    HA   HIS  21           HA       HIS  21   0.732 -16.374 -16.374
  156   1HB   HIS  21          2HB       HIS  21  -0.673 -14.442 -14.442
  157   2HB   HIS  21          1HB       HIS  21  -1.326 -15.377 -15.377
  158    HD1  HIS  21           HD1      HIS  21  -3.420 -16.606 -16.606
  159    HD2  HIS  21           HD2      HIS  21  -1.301 -15.722 -15.722
  160    HE1  HIS  21           HE1      HIS  21  -4.885 -17.368 -17.368
  161    HE2  HIS  21           HE2      HIS  21  -3.545 -16.900 -16.900
  162    H    SER  22           H        SER  22   1.810 -18.356 -18.356
  163    HA   SER  22           HA       SER  22  -0.247 -20.105 -20.105
  164   1HB   SER  22          2HB       SER  22   2.524 -19.601 -19.601
  165   2HB   SER  22          1HB       SER  22   1.985 -21.280 -21.280
  166    HG   SER  22           HG       SER  22   1.473 -20.276 -20.276
  167    H    PHE  23           H        PHE  23  -0.309 -20.213 -20.213
  168    HA   PHE  23           HA       PHE  23   1.372 -22.499 -22.499
  169   1HB   PHE  23          2HB       PHE  23   0.839 -19.950 -19.950
  170   2HB   PHE  23          1HB       PHE  23   0.716 -21.389 -21.389
  171    HD1  PHE  23           HD1      PHE  23   2.681 -22.926 -22.926
  172    HD2  PHE  23           HD2      PHE  23   2.926 -19.099 -19.099
  173    HE1  PHE  23           HE1      PHE  23   5.130 -22.976 -22.976
  174    HE2  PHE  23           HE2      PHE  23   5.375 -19.142 -19.142
  175    HZ   PHE  23           HZ       PHE  23   6.480 -21.083 -21.083
  176    H    ASP  24           H        ASP  24   0.369 -24.207 -24.207
  177    HA   ASP  24           HA       ASP  24  -1.312 -25.619 -25.619
  178   1HB   ASP  24          2HB       ASP  24  -1.543 -23.771 -23.771
  179   2HB   ASP  24          1HB       ASP  24  -2.922 -23.212 -23.212
  180    HA   PRO  25           HA       PRO  25  -3.401 -24.930 -24.930
  181   1HB   PRO  25          2HB       PRO  25  -3.552 -27.884 -27.884
  182   2HB   PRO  25          1HB       PRO  25  -3.050 -26.912 -26.912
  183   1HG   PRO  25          2HG       PRO  25  -1.255 -28.217 -28.217
  184   2HG   PRO  25          1HG       PRO  25  -0.905 -26.607 -26.607
  185   1HD   PRO  25          2HD       PRO  25  -1.640 -27.402 -27.402
  186   2HD   PRO  25          1HD       PRO  25  -0.501 -26.157 -26.157
  187    H    PHE  26           H        PHE  26  -4.305 -26.592 -26.592
  188    HA   PHE  26           HA       PHE  26  -7.138 -26.454 -26.454
  189   1HB   PHE  26          2HB       PHE  26  -7.326 -28.104 -28.104
  190   2HB   PHE  26          1HB       PHE  26  -6.854 -28.697 -28.697
  191    HD1  PHE  26           HD2      PHE  26  -4.386 -28.998 -28.998
  192    HD2  PHE  26           HD1      PHE  26  -5.929 -28.383 -28.383
  193    HE1  PHE  26           HE2      PHE  26  -2.313 -29.916 -29.916
  194    HE2  PHE  26           HE1      PHE  26  -3.859 -29.298 -29.298
  195    HZ   PHE  26           HZ       PHE  26  -2.048 -30.067 -30.067
  196    H    ALA  27           H        ALA  27  -6.010 -24.124 -24.124
  197    HA   ALA  27           HA       ALA  27  -6.349 -23.754 -23.754
  198   1HB   ALA  27          2HB       ALA  27  -4.717 -22.454 -22.454
  199   2HB   ALA  27          1HB       ALA  27  -6.059 -21.665 -21.665
  200   3HB   ALA  27          3HB       ALA  27  -5.836 -21.435 -21.435
  201    H    ASP  28           H        ASP  28  -8.553 -24.571 -24.571
  202    HA   ASP  28           HA       ASP  28 -10.659 -22.995 -22.995
  203   1HB   ASP  28          2HB       ASP  28 -10.591 -25.582 -25.582
  204   2HB   ASP  28          1HB       ASP  28 -11.217 -25.002 -25.002
  205    H    ALA  29           H        ALA  29 -12.028 -21.592 -21.592
  206    HA   ALA  29           HA       ALA  29 -11.108 -20.629 -20.629
  207   1HB   ALA  29          3HB       ALA  29 -12.636 -19.371 -19.371
  208   2HB   ALA  29          2HB       ALA  29 -12.696 -18.682 -18.682
  209   3HB   ALA  29          1HB       ALA  29 -11.151 -18.830 -18.830
  210    H    SER  30           H        SER  30 -12.092 -21.821 -21.821
  211    HA   SER  30           HA       SER  30 -14.835 -21.356 -21.356
  212   1HB   SER  30          2HB       SER  30 -14.884 -23.166 -23.166
  213   2HB   SER  30          1HB       SER  30 -14.229 -24.248 -24.248
  214    HG   SER  30           HG       SER  30 -16.352 -24.484 -24.484
  215    H    LYS  31           H        LYS  31 -12.433 -23.938 -23.938
  216    HA   LYS  31           HA       LYS  31 -12.193 -23.158 -23.158
  217   1HB   LYS  31          2HB       LYS  31 -14.193 -24.765 -24.765
  218   2HB   LYS  31          1HB       LYS  31 -12.986 -26.004 -26.004
  219   1HG   LYS  31          2HG       LYS  31 -12.034 -24.845 -24.845
  220   2HG   LYS  31          1HG       LYS  31 -13.781 -24.745 -24.745
  221   1HD   LYS  31          2HD       LYS  31 -13.538 -27.279 -27.279
  222   2HD   LYS  31          1HD       LYS  31 -12.007 -27.094 -27.094
  223   1HE   LYS  31          2HE       LYS  31 -13.733 -26.025 -26.025
  224   2HE   LYS  31          1HE       LYS  31 -14.757 -27.244 -27.244
  225   1HZ   LYS  31          1HZ       LYS  31 -12.054 -28.003 -28.003
  226   2HZ   LYS  31          3HZ       LYS  31 -13.260 -27.841 -27.841
  227   3HZ   LYS  31          2HZ       LYS  31 -13.457 -28.944 -28.944
  228    H    GLY  32           H        GLY  32 -10.104 -23.244 -23.244
  229   1HA   GLY  32          2HA       GLY  32  -8.510 -25.531 -25.531
  230   2HA   GLY  32          1HA       GLY  32  -8.020 -23.980 -23.980
  231    H    ASP  33           H        ASP  33  -7.622 -22.229 -22.229
  232    HA   ASP  33           HA       ASP  33  -6.485 -23.355 -23.355
  233   1HB   ASP  33          2HB       ASP  33  -5.347 -21.084 -21.084
  234   2HB   ASP  33          1HB       ASP  33  -4.660 -21.736 -21.736
  235    H    ASP  34           H        ASP  34  -8.719 -22.748 -22.748
  236    HA   ASP  34           HA       ASP  34  -8.905 -19.876 -19.876
  237   1HB   ASP  34          2HB       ASP  34 -10.794 -21.436 -21.436
  238   2HB   ASP  34          1HB       ASP  34 -11.248 -21.600 -21.600
  239    H    LEU  35           H        LEU  35  -7.122 -21.324 -21.324
  240    HA   LEU  35           HA       LEU  35  -8.520 -21.810 -21.810
  241   1HB   LEU  35          2HB       LEU  35  -7.189 -23.687 -23.687
  242   2HB   LEU  35          1HB       LEU  35  -5.774 -22.660 -22.660
  243    HG   LEU  35           HG       LEU  35  -5.746 -22.367 -22.367
  244   1HD1  LEU  35          3HD1      LEU  35  -8.161 -22.572 -22.572
  245   2HD1  LEU  35          2HD1      LEU  35  -8.062 -24.296 -24.296
  246   3HD1  LEU  35          1HD1      LEU  35  -7.231 -23.641 -23.641
  247   1HD2  LEU  35          3HD2      LEU  35  -4.898 -24.520 -24.520
  248   2HD2  LEU  35          2HD2      LEU  35  -4.619 -24.288 -24.288
  249   3HD2  LEU  35          1HD2      LEU  35  -5.958 -25.297 -25.297
  250    H    LEU  36           H        LEU  36  -8.715 -19.613 -19.613
  251    HA   LEU  36           HA       LEU  36  -8.098 -17.696 -17.696
  252   1HB   LEU  36          2HB       LEU  36  -5.502 -19.127 -19.127
  253   2HB   LEU  36          1HB       LEU  36  -6.144 -17.738 -17.738
  254    HG   LEU  36           HG       LEU  36  -7.433 -20.467 -20.467
  255   1HD1  LEU  36          1HD1      LEU  36  -5.497 -19.178 -19.178
  256   2HD1  LEU  36          3HD1      LEU  36  -6.679 -20.344 -20.344
  257   3HD1  LEU  36          2HD1      LEU  36  -5.512 -20.821 -20.821
  258   1HD2  LEU  36          3HD2      LEU  36  -8.069 -17.882 -17.882
  259   2HD2  LEU  36          2HD2      LEU  36  -9.126 -18.907 -18.907
  260   3HD2  LEU  36          1HD2      LEU  36  -8.617 -19.433 -19.433
  261    HA   PRO  37           HA       PRO  37  -6.071 -15.058 -15.058
  262   1HB   PRO  37          2HB       PRO  37  -4.704 -13.837 -13.837
  263   2HB   PRO  37          1HB       PRO  37  -5.613 -13.058 -13.058
  264   1HG   PRO  37          2HG       PRO  37  -6.697 -13.367 -13.367
  265   2HG   PRO  37          1HG       PRO  37  -7.668 -13.587 -13.587
  266   1HD   PRO  37          2HD       PRO  37  -6.559 -15.632 -15.632
  267   2HD   PRO  37          1HD       PRO  37  -8.077 -15.644 -15.644
  268    H    ALA  38           H        ALA  38  -4.492 -15.842 -15.842
  269    HA   ALA  38           HA       ALA  38  -2.074 -16.930 -16.930
  270   1HB   ALA  38          1HB       ALA  38  -3.401 -17.180 -17.180
  271   2HB   ALA  38          3HB       ALA  38  -1.652 -17.392 -17.392
  272   3HB   ALA  38          2HB       ALA  38  -2.702 -18.421 -18.421
  273    H    GLY  39           H        GLY  39  -0.153 -15.931 -15.931
  274   1HA   GLY  39          2HA       GLY  39   1.550 -14.514 -14.514
  275   2HA   GLY  39          1HA       GLY  39   0.481 -13.905 -13.905
  276    H    THR  40           H        THR  40  -0.509 -14.015 -14.015
  277    HA   THR  40           HA       THR  40  -0.665 -11.096 -11.096
  278    HB   THR  40           HB       THR  40  -1.870 -11.793 -11.793
  279    HG1  THR  40           HG1      THR  40  -2.463 -13.800 -13.800
  280   1HG2  THR  40          1HG2      THR  40  -3.073 -11.873 -11.873
  281   2HG2  THR  40          3HG2      THR  40  -4.018 -11.953 -11.953
  282   3HG2  THR  40          2HG2      THR  40  -3.047 -10.523 -10.523
  283    H    GLU  41           H        GLU  41   0.946 -13.745 -13.745
  284    HA   GLU  41           HA       GLU  41   2.678 -13.828 -13.828
  285   1HB   GLU  41          2HB       GLU  41   3.037 -11.376 -11.376
  286   2HB   GLU  41          1HB       GLU  41   3.603 -11.180 -11.180
  287   1HG   GLU  41          2HG       GLU  41   5.008 -13.182 -13.182
  288   2HG   GLU  41          1HG       GLU  41   4.477 -13.302 -13.302
  289    H    ASP  42           H        ASP  42  -0.127 -12.670 -12.670
  290    HA   ASP  42           HA       ASP  42  -1.196 -11.830 -11.830
  291   1HB   ASP  42          2HB       ASP  42  -0.113 -14.045 -14.045
  292   2HB   ASP  42          1HB       ASP  42   1.046 -13.038 -13.038
  293    H    TYR  43           H        TYR  43  -0.181  -9.716  -9.716
  294    HA   TYR  43           HA       TYR  43   1.900  -8.413  -8.413
  295   1HB   TYR  43          2HB       TYR  43  -0.482  -7.167  -7.167
  296   2HB   TYR  43          1HB       TYR  43   1.027  -6.354  -6.354
  297    HD1  TYR  43           HD2      TYR  43   2.756  -8.859  -8.859
  298    HD2  TYR  43           HD1      TYR  43  -0.318  -6.652  -6.652
  299    HE1  TYR  43           HE2      TYR  43   3.678  -9.510  -9.510
  300    HE2  TYR  43           HE1      TYR  43   0.597  -7.302  -7.302
  301    HH   TYR  43           HH       TYR  43   2.044  -9.296  -9.296
  302    H    ILE  44           H        ILE  44   1.393  -6.210  -6.210
  303    HA   ILE  44           HA       ILE  44  -0.565  -6.780  -6.780
  304    HB   ILE  44           HB       ILE  44   1.986  -5.178  -5.178
  305   1HG1  ILE  44          2HG1      ILE  44   2.579  -7.481  -7.481
  306   2HG1  ILE  44          1HG1      ILE  44   2.626  -7.033  -7.033
  307   1HG2  ILE  44          2HG2      ILE  44   0.116  -4.383  -4.383
  308   2HG2  ILE  44          1HG2      ILE  44   0.051  -5.983  -5.983
  309   3HG2  ILE  44          3HG2      ILE  44   1.495  -4.986  -4.986
  310   1HD1  ILE  44          2HD1      ILE  44   0.392  -8.030  -8.030
  311   2HD1  ILE  44          1HD1      ILE  44   0.446  -8.562  -8.562
  312   3HD1  ILE  44          3HD1      ILE  44   1.613  -9.191  -9.191
  313    H    HIS  45           H        HIS  45  -2.319  -5.664  -5.664
  314    HA   HIS  45           HA       HIS  45  -2.312  -3.215  -3.215
  315   1HB   HIS  45          2HB       HIS  45  -4.257  -5.050  -5.050
  316   2HB   HIS  45          1HB       HIS  45  -4.735  -3.398  -3.398
  317    HD1  HIS  45           HD1      HIS  45  -3.642  -5.410  -5.410
  318    HD2  HIS  45           HD2      HIS  45  -6.025  -2.161  -2.161
  319    HE1  HIS  45           HE1      HIS  45  -4.800  -4.734  -4.734
  320    HE2  HIS  45           HE2      HIS  45  -6.171  -2.713  -2.713
  321    H    ILE  46           H        ILE  46  -2.603  -1.148  -1.148
  322    HA   ILE  46           HA       ILE  46  -2.696  -0.470  -0.470
  323    HB   ILE  46           HB       ILE  46  -0.543   0.293   0.293
  324   1HG1  ILE  46          2HG1      ILE  46   0.640   0.324   0.324
  325   2HG1  ILE  46          1HG1      ILE  46  -0.789  -0.554  -0.554
  326   1HG2  ILE  46          1HG2      ILE  46  -1.843   2.109   2.109
  327   2HG2  ILE  46          3HG2      ILE  46  -0.089   2.192   2.192
  328   3HG2  ILE  46          2HG2      ILE  46  -1.148   2.474   2.474
  329   1HD1  ILE  46          1HD1      ILE  46   0.279  -1.693  -1.693
  330   2HD1  ILE  46          3HD1      ILE  46   1.517  -1.588  -1.588
  331   3HD1  ILE  46          2HD1      ILE  46   0.000  -2.436  -2.436
  332    H    ARG  47           H        ARG  47  -4.658   0.455   0.455
  333    HA   ARG  47           HA       ARG  47  -5.188   2.587   2.587
  334   1HB   ARG  47          2HB       ARG  47  -7.175   0.680   0.680
  335   2HB   ARG  47          1HB       ARG  47  -7.589   2.025   2.025
  336   1HG   ARG  47          2HG       ARG  47  -5.626   0.418   0.418
  337   2HG   ARG  47          1HG       ARG  47  -6.927  -0.621  -0.621
  338   1HD   ARG  47          2HD       ARG  47  -7.526   1.918   1.918
  339   2HD   ARG  47          1HD       ARG  47  -7.133   0.439   0.439
  340    HE   ARG  47           HE       ARG  47  -9.543   0.989   0.989
  341   1HH1  ARG  47          2HH1      ARG  47  -7.601  -1.392  -1.392
  342   2HH1  ARG  47          1HH1      ARG  47  -8.910  -2.509  -2.509
  343   1HH2  ARG  47          1HH2      ARG  47 -11.260  -0.484  -0.484
  344   2HH2  ARG  47          2HH2      ARG  47 -10.985  -1.995  -1.995
  345    H    ILE  48           H        ILE  48  -5.932   4.488   4.488
  346    HA   ILE  48           HA       ILE  48  -5.931   4.943   4.943
  347    HB   ILE  48           HB       ILE  48  -5.779   6.766   6.766
  348   1HG1  ILE  48          2HG1      ILE  48  -4.027   6.358   6.358
  349   2HG1  ILE  48          1HG1      ILE  48  -3.689   5.801   5.801
  350   1HG2  ILE  48          2HG2      ILE  48  -6.352   7.569   7.569
  351   2HG2  ILE  48          1HG2      ILE  48  -5.758   8.679   8.679
  352   3HG2  ILE  48          3HG2      ILE  48  -7.328   7.901   7.901
  353   1HD1  ILE  48          2HD1      ILE  48  -4.051   8.706   8.706
  354   2HD1  ILE  48          1HD1      ILE  48  -2.493   7.892   7.892
  355   3HD1  ILE  48          3HD1      ILE  48  -3.303   7.977   7.977
  356    H    GLN  49           H        GLN  49  -7.616   6.147   6.147
  357    HA   GLN  49           HA       GLN  49 -10.168   6.303   6.303
  358   1HB   GLN  49          2HB       GLN  49 -11.380   5.221   5.221
  359   2HB   GLN  49          1HB       GLN  49 -10.148   4.134   4.134
  360   1HG   GLN  49          2HG       GLN  49  -8.873   5.461   5.461
  361   2HG   GLN  49          1HG       GLN  49 -10.509   5.201   5.201
  362   1HE2  GLN  49          2HE2      GLN  49 -10.104   1.812   1.812
  363   2HE2  GLN  49          1HE2      GLN  49 -11.105   3.217   3.217
  364    H    GLN  50           H        GLN  50 -10.061   8.525   8.525
  365    HA   GLN  50           HA       GLN  50  -9.718   9.905   9.905
  366   1HB   GLN  50          2HB       GLN  50  -8.913  10.511  10.511
  367   2HB   GLN  50          1HB       GLN  50 -10.336  11.527  11.527
  368   1HG   GLN  50          2HG       GLN  50  -9.405  12.604  12.604
  369   2HG   GLN  50          1HG       GLN  50  -8.059  11.465  11.465
  370   1HE2  GLN  50          2HE2      GLN  50  -6.242  13.964  13.964
  371   2HE2  GLN  50          1HE2      GLN  50  -6.528  13.084  13.084
  372    H    ARG  51           H        ARG  51 -11.398  10.307  10.307
  373    HA   ARG  51           HA       ARG  51 -14.082  10.370  10.370
  374   1HB   ARG  51          2HB       ARG  51 -13.305  10.580  10.580
  375   2HB   ARG  51          1HB       ARG  51 -14.889  10.192  10.192
  376   1HG   ARG  51          2HG       ARG  51 -14.389   8.029   8.029
  377   2HG   ARG  51          1HG       ARG  51 -12.765   8.372   8.372
  378   1HD   ARG  51          2HD       ARG  51 -12.141   7.470   7.470
  379   2HD   ARG  51          1HD       ARG  51 -12.479   9.091   9.091
  380    HE   ARG  51           HE       ARG  51 -14.290   8.258   8.258
  381   1HH1  ARG  51          2HH1      ARG  51 -13.224   5.896   5.896
  382   2HH1  ARG  51          1HH1      ARG  51 -14.268   4.650   4.650
  383   1HH2  ARG  51          1HH2      ARG  51 -15.664   6.620   6.620
  384   2HH2  ARG  51          2HH2      ARG  51 -15.653   5.061   5.061
  385    H    ASN  52           H        ASN  52 -15.130  12.208  12.208
  386    HA   ASN  52           HA       ASN  52 -15.703  14.409  14.409
  387   1HB   ASN  52          2HB       ASN  52 -15.361  13.897  13.897
  388   2HB   ASN  52          1HB       ASN  52 -14.164  15.168  15.168
  389   1HD2  ASN  52          2HD2      ASN  52 -16.559  17.612  17.612
  390   2HD2  ASN  52          1HD2      ASN  52 -14.964  17.026  17.026
  391    H    GLY  53           H        GLY  53 -13.054  13.325  13.325
  392   1HA   GLY  53          2HA       GLY  53 -11.266  14.165  14.165
  393   2HA   GLY  53          1HA       GLY  53 -12.043  15.737  15.737
  394    H    ARG  54           H        ARG  54 -11.025  13.774  13.774
  395    HA   ARG  54           HA       ARG  54  -8.646  15.369  15.369
  396   1HB   ARG  54          2HB       ARG  54 -10.780  15.423  15.423
  397   2HB   ARG  54          1HB       ARG  54  -9.272  16.326  16.326
  398   1HG   ARG  54          2HG       ARG  54 -10.129  17.537  17.537
  399   2HG   ARG  54          1HG       ARG  54 -11.679  16.728  16.728
  400   1HD   ARG  54          2HD       ARG  54 -11.961  17.768  17.768
  401   2HD   ARG  54          1HD       ARG  54 -10.314  18.399  18.399
  402    HE   ARG  54           HE       ARG  54 -12.611  19.586  19.586
  403   1HH1  ARG  54          2HH1      ARG  54  -9.177  19.154  19.154
  404   2HH1  ARG  54          1HH1      ARG  54  -8.991  20.605  20.605
  405   1HH2  ARG  54          1HH2      ARG  54 -12.367  21.494  21.494
  406   2HH2  ARG  54          2HH2      ARG  54 -10.801  21.934  21.934
  407    H    LYS  55           H        LYS  55 -10.832  13.386  13.386
  408    HA   LYS  55           HA       LYS  55  -8.788  12.104  12.104
  409   1HB   LYS  55          2HB       LYS  55 -11.674  11.485  11.485
  410   2HB   LYS  55          1HB       LYS  55 -10.666  10.304  10.304
  411   1HG   LYS  55          2HG       LYS  55 -11.225  13.126  13.126
  412   2HG   LYS  55          1HG       LYS  55 -11.836  11.642  11.642
  413   1HD   LYS  55          2HD       LYS  55 -10.077  11.830  11.830
  414   2HD   LYS  55          1HD       LYS  55  -9.138  11.213  11.213
  415   1HE   LYS  55          2HE       LYS  55  -9.126  13.783  13.783
  416   2HE   LYS  55          1HE       LYS  55  -9.348  13.973  13.973
  417   1HZ   LYS  55          2HZ       LYS  55  -7.199  12.288  12.288
  418   2HZ   LYS  55          1HZ       LYS  55  -6.985  13.937  13.937
  419   3HZ   LYS  55          3HZ       LYS  55  -7.335  12.879  12.879
  420    H    THR  56           H        THR  56  -7.254  11.572  11.572
  421    HA   THR  56           HA       THR  56  -7.939   9.548   9.548
  422    HB   THR  56           HB       THR  56  -5.094  10.119  10.119
  423    HG1  THR  56           HG1      THR  56  -5.348  12.170  12.170
  424   1HG2  THR  56          3HG2      THR  56  -6.870   9.554   9.554
  425   2HG2  THR  56          2HG2      THR  56  -6.060  11.087  11.087
  426   3HG2  THR  56          1HG2      THR  56  -5.107   9.633   9.633
  427    H    LEU  57           H        LEU  57  -7.338   7.441   7.441
  428    HA   LEU  57           HA       LEU  57  -5.680   6.397   6.397
  429   1HB   LEU  57          2HB       LEU  57  -8.562   6.128   6.128
  430   2HB   LEU  57          1HB       LEU  57  -7.782   4.559   4.559
  431    HG   LEU  57           HG       LEU  57  -6.464   5.338   5.338
  432   1HD1  LEU  57          1HD1      LEU  57  -8.392   7.554   7.554
  433   2HD1  LEU  57          3HD1      LEU  57  -8.118   6.979   6.979
  434   3HD1  LEU  57          2HD1      LEU  57  -6.764   7.559   7.559
  435   1HD2  LEU  57          1HD2      LEU  57  -9.138   4.272   4.272
  436   2HD2  LEU  57          3HD2      LEU  57  -7.850   3.807   3.807
  437   3HD2  LEU  57          2HD2      LEU  57  -8.939   5.129   5.129
  438    H    THR  58           H        THR  58  -4.189   5.188   5.188
  439    HA   THR  58           HA       THR  58  -4.806   4.010   4.010
  440    HB   THR  58           HB       THR  58  -2.163   4.023   4.023
  441    HG1  THR  58           HG1      THR  58  -3.069   6.153   6.153
  442   1HG2  THR  58          2HG2      THR  58  -3.022   3.135   3.135
  443   2HG2  THR  58          1HG2      THR  58  -1.612   4.195   4.195
  444   3HG2  THR  58          3HG2      THR  58  -1.595   2.703   2.703
  445    H    THR  59           H        THR  59  -5.193   1.902   1.902
  446    HA   THR  59           HA       THR  59  -4.740   0.072   0.072
  447    HB   THR  59           HB       THR  59  -6.432  -1.267  -1.267
  448    HG1  THR  59           HG1      THR  59  -7.457   0.137   0.137
  449   1HG2  THR  59          3HG2      THR  59  -6.529  -0.364  -0.364
  450   2HG2  THR  59          2HG2      THR  59  -7.941   0.366   0.366
  451   3HG2  THR  59          1HG2      THR  59  -7.718  -1.383  -1.383
  452    H    VAL  60           H        VAL  60  -3.904  -2.002  -2.002
  453    HA   VAL  60           HA       VAL  60  -2.580  -2.355  -2.355
  454    HB   VAL  60           HB       VAL  60  -1.465  -3.099  -3.099
  455   1HG1  VAL  60          3HG1      VAL  60  -0.880  -4.694  -4.694
  456   2HG1  VAL  60          2HG1      VAL  60  -0.189  -3.356  -3.356
  457   3HG1  VAL  60          1HG1      VAL  60   0.517  -3.822  -3.822
  458   1HG2  VAL  60          3HG2      VAL  60  -1.138  -0.771  -0.771
  459   2HG2  VAL  60          2HG2      VAL  60  -0.960  -0.901  -0.901
  460   3HG2  VAL  60          1HG2      VAL  60   0.343  -1.435  -1.435
  461    H    GLN  61           H        GLN  61  -3.151  -4.144  -4.144
  462    HA   GLN  61           HA       GLN  61  -4.290  -6.364  -6.364
  463   1HB   GLN  61          2HB       GLN  61  -4.930  -6.453  -6.453
  464   2HB   GLN  61          1HB       GLN  61  -6.005  -6.500  -6.500
  465   1HG   GLN  61          2HG       GLN  61  -5.891  -4.045  -4.045
  466   2HG   GLN  61          1HG       GLN  61  -4.882  -4.039  -4.039
  467   1HE2  GLN  61          2HE2      GLN  61  -7.961  -5.596  -5.596
  468   2HE2  GLN  61          1HE2      GLN  61  -6.528  -6.346  -6.346
  469    H    GLY  62           H        GLY  62  -3.547  -8.407  -8.407
  470   1HA   GLY  62          2HA       GLY  62  -2.455 -10.010 -10.010
  471   2HA   GLY  62          1HA       GLY  62  -1.375  -8.705  -8.705
  472    H    ILE  63           H        ILE  63  -1.184  -7.757  -7.757
  473    HA   ILE  63           HA       ILE  63   1.136  -9.136  -9.136
  474    HB   ILE  63           HB       ILE  63  -0.650  -7.239  -7.239
  475   1HG1  ILE  63          2HG1      ILE  63   0.433  -5.988  -5.988
  476   2HG1  ILE  63          1HG1      ILE  63   1.551  -5.844  -5.844
  477   1HG2  ILE  63          3HG2      ILE  63   1.450  -8.919  -8.919
  478   2HG2  ILE  63          2HG2      ILE  63   1.808  -7.210  -7.210
  479   3HG2  ILE  63          1HG2      ILE  63   0.302  -7.885  -7.885
  480   1HD1  ILE  63          1HD1      ILE  63   2.656  -7.940  -7.940
  481   2HD1  ILE  63          3HD1      ILE  63   1.832  -7.325  -7.325
  482   3HD1  ILE  63          2HD1      ILE  63   2.992  -6.307  -6.307
  483    H    ALA  64           H        ALA  64   1.560 -10.579 -10.579
  484    HA   ALA  64           HA       ALA  64  -0.653 -12.368 -12.368
  485   1HB   ALA  64          2HB       ALA  64   1.710 -13.042 -13.042
  486   2HB   ALA  64          1HB       ALA  64   2.165 -12.842 -12.842
  487   3HB   ALA  64          3HB       ALA  64   0.919 -14.009 -14.009
  488    H    ASP  65           H        ASP  65  -1.646 -12.521 -12.521
  489    HA   ASP  65           HA       ASP  65  -1.290 -10.660 -10.660
  490   1HB   ASP  65          2HB       ASP  65  -3.329 -12.130 -12.130
  491   2HB   ASP  65          1HB       ASP  65  -2.497 -13.392 -13.392
  492    H    ASP  66           H        ASP  66   0.386 -13.579 -13.579
  493    HA   ASP  66           HA       ASP  66   1.288 -14.283 -14.283
  494   1HB   ASP  66          2HB       ASP  66   1.520 -15.439 -15.439
  495   2HB   ASP  66          1HB       ASP  66   3.106 -14.680 -14.680
  496    H    TYR  67           H        TYR  67   2.233 -11.760 -11.760
  497    HA   TYR  67           HA       TYR  67   4.813 -11.176 -11.176
  498   1HB   TYR  67          2HB       TYR  67   2.515  -9.293  -9.293
  499   2HB   TYR  67          1HB       TYR  67   4.186  -8.767  -8.767
  500    HD1  TYR  67           HD1      TYR  67   4.024 -11.977 -11.977
  501    HD2  TYR  67           HD2      TYR  67   3.504  -7.830  -7.830
  502    HE1  TYR  67           HE1      TYR  67   4.343 -12.388 -12.388
  503    HE2  TYR  67           HE2      TYR  67   3.818  -8.222  -8.222
  504    HH   TYR  67           HH       TYR  67   3.502 -10.258 -10.258
  505    H    ASP  68           H        ASP  68   5.466  -9.174  -9.174
  506    HA   ASP  68           HA       ASP  68   4.667  -9.692  -9.692
  507   1HB   ASP  68          2HB       ASP  68   7.039  -9.061  -9.061
  508   2HB   ASP  68          1HB       ASP  68   6.451  -7.411  -7.411
  509    H    LYS  69           H        LYS  69   2.399  -8.998  -8.998
  510    HA   LYS  69           HA       LYS  69   1.391  -6.657  -6.657
  511   1HB   LYS  69          2HB       LYS  69   0.077  -8.602  -8.602
  512   2HB   LYS  69          1HB       LYS  69   0.431  -8.098  -8.098
  513   1HG   LYS  69          2HG       LYS  69  -0.595  -5.813  -5.813
  514   2HG   LYS  69          1HG       LYS  69  -1.538  -7.082  -7.082
  515   1HD   LYS  69          2HD       LYS  69  -1.110  -7.066  -7.066
  516   2HD   LYS  69          1HD       LYS  69  -2.402  -6.123  -6.123
  517   1HE   LYS  69          2HE       LYS  69  -3.624  -7.989  -7.989
  518   2HE   LYS  69          1HE       LYS  69  -2.716  -8.559  -8.559
  519   1HZ   LYS  69          1HZ       LYS  69  -1.712  -8.977  -8.977
  520   2HZ   LYS  69          3HZ       LYS  69  -2.817 -10.050 -10.050
  521   3HZ   LYS  69          2HZ       LYS  69  -1.303  -9.811  -9.811
  522    H    LYS  70           H        LYS  70   2.319  -7.253  -7.253
  523    HA   LYS  70           HA       LYS  70   1.793  -4.785  -4.785
  524   1HB   LYS  70          2HB       LYS  70   4.069  -6.673  -6.673
  525   2HB   LYS  70          1HB       LYS  70   3.697  -5.262  -5.262
  526   1HG   LYS  70          2HG       LYS  70   1.275  -6.460  -6.460
  527   2HG   LYS  70          1HG       LYS  70   2.345  -7.862  -7.862
  528   1HD   LYS  70          2HD       LYS  70   3.501  -6.326  -6.326
  529   2HD   LYS  70          1HD       LYS  70   1.777  -6.051  -6.051
  530   1HE   LYS  70          2HE       LYS  70   1.357  -8.358  -8.358
  531   2HE   LYS  70          1HE       LYS  70   2.944  -8.803  -8.803
  532   1HZ   LYS  70          3HZ       LYS  70   3.259  -7.092  -7.092
  533   2HZ   LYS  70          2HZ       LYS  70   2.221  -8.356  -8.356
  534   3HZ   LYS  70          1HZ       LYS  70   3.762  -8.698  -8.698
  535    H    LYS  71           H        LYS  71   4.794  -5.799  -5.799
  536    HA   LYS  71           HA       LYS  71   5.824  -3.084  -3.084
  537   1HB   LYS  71          2HB       LYS  71   6.957  -5.728  -5.728
  538   2HB   LYS  71          1HB       LYS  71   7.764  -4.226  -4.226
  539   1HG   LYS  71          2HG       LYS  71   7.980  -3.642  -3.642
  540   2HG   LYS  71          1HG       LYS  71   7.122  -5.115  -5.115
  541   1HD   LYS  71          2HD       LYS  71   9.093  -6.116  -6.116
  542   2HD   LYS  71          1HD       LYS  71   9.909  -4.734  -4.734
  543   1HE   LYS  71          2HE       LYS  71   8.324  -6.553  -6.553
  544   2HE   LYS  71          1HE       LYS  71   9.899  -7.096  -7.096
  545   1HZ   LYS  71          2HZ       LYS  71  10.568  -4.703  -4.703
  546   2HZ   LYS  71          1HZ       LYS  71   9.242  -4.950  -4.950
  547   3HZ   LYS  71          3HZ       LYS  71  10.537  -6.038  -6.038
  548    H    LEU  72           H        LEU  72   3.992  -4.999  -4.999
  549    HA   LEU  72           HA       LEU  72   4.890  -4.130  -4.130
  550   1HB   LEU  72          2HB       LEU  72   2.950  -5.819  -5.819
  551   2HB   LEU  72          1HB       LEU  72   1.970  -4.458  -4.458
  552    HG   LEU  72           HG       LEU  72   2.243  -6.118  -6.118
  553   1HD1  LEU  72          2HD1      LEU  72   2.262  -3.479  -3.479
  554   2HD1  LEU  72          1HD1      LEU  72   3.857  -3.811  -3.811
  555   3HD1  LEU  72          3HD1      LEU  72   2.427  -4.558  -4.558
  556   1HD2  LEU  72          3HD2      LEU  72   4.547  -6.802  -6.802
  557   2HD2  LEU  72          2HD2      LEU  72   4.330  -6.662  -6.662
  558   3HD2  LEU  72          1HD2      LEU  72   5.156  -5.384  -5.384
  559    H    VAL  73           H        VAL  73   2.471  -2.694  -2.694
  560    HA   VAL  73           HA       VAL  73   2.378  -0.335  -0.335
  561    HB   VAL  73           HB       VAL  73   0.494   0.337   0.337
  562   1HG1  VAL  73          2HG1      VAL  73   0.341  -1.732  -1.732
  563   2HG1  VAL  73          1HG1      VAL  73  -1.111  -1.208  -1.208
  564   3HG1  VAL  73          3HG1      VAL  73  -0.143  -0.037  -0.037
  565   1HG2  VAL  73          3HG2      VAL  73   1.088  -1.558  -1.558
  566   2HG2  VAL  73          2HG2      VAL  73  -0.619  -1.408  -1.408
  567   3HG2  VAL  73          1HG2      VAL  73   0.372  -2.646  -2.646
  568    H    LYS  74           H        LYS  74   3.300  -1.397  -1.397
  569    HA   LYS  74           HA       LYS  74   3.567   1.101   1.101
  570   1HB   LYS  74          2HB       LYS  74   3.675  -1.012  -1.012
  571   2HB   LYS  74          1HB       LYS  74   5.189  -1.412  -1.412
  572   1HG   LYS  74          2HG       LYS  74   6.359   0.286   0.286
  573   2HG   LYS  74          1HG       LYS  74   4.865   1.050   1.050
  574   1HD   LYS  74          2HD       LYS  74   5.205  -1.757  -1.757
  575   2HD   LYS  74          1HD       LYS  74   6.377  -0.635  -0.635
  576   1HE   LYS  74          2HE       LYS  74   4.846   0.334   0.334
  577   2HE   LYS  74          1HE       LYS  74   3.620   0.342   0.342
  578   1HZ   LYS  74          3HZ       LYS  74   4.227  -2.279  -2.279
  579   2HZ   LYS  74          2HZ       LYS  74   3.562  -1.224  -1.224
  580   3HZ   LYS  74          1HZ       LYS  74   2.728  -1.548  -1.548
  581    H    ALA  75           H        ALA  75   5.840  -0.776  -0.776
  582    HA   ALA  75           HA       ALA  75   8.037   0.978   0.978
  583   1HB   ALA  75          3HB       ALA  75   7.862  -1.456  -1.456
  584   2HB   ALA  75          2HB       ALA  75   7.695  -0.574  -0.574
  585   3HB   ALA  75          1HB       ALA  75   9.130  -0.344  -0.344
  586    H    PHE  76           H        PHE  76   5.276   0.922   0.922
  587    HA   PHE  76           HA       PHE  76   6.138   2.768   2.768
  588   1HB   PHE  76          2HB       PHE  76   4.004   1.270   1.270
  589   2HB   PHE  76          1HB       PHE  76   3.282   2.641   2.641
  590    HD1  PHE  76           HD2      PHE  76   4.836   1.540   1.540
  591    HD2  PHE  76           HD1      PHE  76   2.632   4.590   4.590
  592    HE1  PHE  76           HE2      PHE  76   4.390   2.614   2.614
  593    HE2  PHE  76           HE1      PHE  76   2.181   5.673   5.673
  594    HZ   PHE  76           HZ       PHE  76   3.059   4.684   4.684
  595    H    LYS  77           H        LYS  77   4.468   3.212   3.212
  596    HA   LYS  77           HA       LYS  77   4.135   6.008   6.008
  597   1HB   LYS  77          2HB       LYS  77   4.376   4.343   4.343
  598   2HB   LYS  77          1HB       LYS  77   3.658   5.942   5.942
  599   1HG   LYS  77          2HG       LYS  77   1.712   5.147   5.147
  600   2HG   LYS  77          1HG       LYS  77   2.492   3.918   3.918
  601   1HD   LYS  77          2HD       LYS  77   1.666   2.475   2.475
  602   2HD   LYS  77          1HD       LYS  77   3.021   3.003   3.003
  603   1HE   LYS  77          2HE       LYS  77   0.739   4.792   4.792
  604   2HE   LYS  77          1HE       LYS  77   0.339   3.142   3.142
  605   1HZ   LYS  77          3HZ       LYS  77   2.577   3.394   3.394
  606   2HZ   LYS  77          2HZ       LYS  77   2.183   5.037   5.037
  607   3HZ   LYS  77          1HZ       LYS  77   1.110   3.943   3.943
  608    H    LYS  78           H        LYS  78   6.912   4.114   4.114
  609    HA   LYS  78           HA       LYS  78   8.320   6.260   6.260
  610   1HB   LYS  78          2HB       LYS  78   8.495   3.764   3.764
  611   2HB   LYS  78          1HB       LYS  78   9.503   3.625   3.625
  612   1HG   LYS  78          2HG       LYS  78  11.270   4.523   4.523
  613   2HG   LYS  78          1HG       LYS  78  10.308   5.810   5.810
  614   1HD   LYS  78          2HD       LYS  78   9.445   3.823   3.823
  615   2HD   LYS  78          1HD       LYS  78  10.993   3.111   3.111
  616   1HE   LYS  78          2HE       LYS  78  10.624   5.829   5.829
  617   2HE   LYS  78          1HE       LYS  78  11.124   4.372   4.372
  618   1HZ   LYS  78          3HZ       LYS  78  12.936   4.396   4.396
  619   2HZ   LYS  78          2HZ       LYS  78  12.635   6.058   6.058
  620   3HZ   LYS  78          1HZ       LYS  78  13.151   5.231   5.231
  621    H    LYS  79           H        LYS  79   7.898   5.005   5.005
  622    HA   LYS  79           HA       LYS  79  10.336   6.336   6.336
  623   1HB   LYS  79          2HB       LYS  79   9.907   3.943   3.943
  624   2HB   LYS  79          1HB       LYS  79   8.515   4.494   4.494
  625   1HG   LYS  79          2HG       LYS  79   9.942   5.805   5.805
  626   2HG   LYS  79          1HG       LYS  79  11.355   5.370   5.370
  627   1HD   LYS  79          2HD       LYS  79  11.233   3.105   3.105
  628   2HD   LYS  79          1HD       LYS  79   9.616   3.319   3.319
  629   1HE   LYS  79          2HE       LYS  79  11.267   3.207   3.207
  630   2HE   LYS  79          1HE       LYS  79  10.539   4.811   4.811
  631   1HZ   LYS  79          3HZ       LYS  79  13.005   4.377   4.377
  632   2HZ   LYS  79          2HZ       LYS  79  13.127   4.475   4.475
  633   3HZ   LYS  79          1HZ       LYS  79  12.463   5.760   5.760
  634    H    PHE  80           H        PHE  80   6.830   6.281   6.281
  635    HA   PHE  80           HA       PHE  80   7.075   8.699   8.699
  636   1HB   PHE  80          2HB       PHE  80   4.647   6.922   6.922
  637   2HB   PHE  80          1HB       PHE  80   5.081   8.116   8.116
  638    HD1  PHE  80           HD1      PHE  80   5.779   4.756   4.756
  639    HD2  PHE  80           HD2      PHE  80   6.580   7.583   7.583
  640    HE1  PHE  80           HE1      PHE  80   6.832   2.986   2.986
  641    HE2  PHE  80           HE2      PHE  80   7.634   5.821   5.821
  642    HZ   PHE  80           HZ       PHE  80   7.760   3.519   3.519
  643    H    ALA  81           H        ALA  81   5.935   7.478   7.478
  644    HA   ALA  81           HA       ALA  81   4.904   8.491   8.491
  645   1HB   ALA  81          2HB       ALA  81   6.317  10.489  10.489
  646   2HB   ALA  81          1HB       ALA  81   4.699  11.125  11.125
  647   3HB   ALA  81          3HB       ALA  81   5.199  10.727  10.727
  648    H    CYS  82           H        CYS  82   3.415   7.227   7.227
  649    HA   CYS  82           HA       CYS  82   0.917   8.790   8.790
  650   1HB   CYS  82          2HB       CYS  82   2.087   6.911   6.911
  651   2HB   CYS  82          1HB       CYS  82   0.336   7.039   7.039
  652    HG   CYS  82           HG       CYS  82   0.469   9.478   9.478
  653    H    ASN  83           H        ASN  83  -1.075   7.590   7.590
  654    HA   ASN  83           HA       ASN  83  -0.822   5.607   5.607
  655   1HB   ASN  83          2HB       ASN  83  -2.764   7.491   7.491
  656   2HB   ASN  83          1HB       ASN  83  -3.525   5.917   5.917
  657   1HD2  ASN  83          2HD2      ASN  83  -2.204   6.970   6.970
  658   2HD2  ASN  83          1HD2      ASN  83  -1.352   7.496   7.496
  659    H    GLY  84           H        GLY  84  -0.468   3.541   3.541
  660   1HA   GLY  84          2HA       GLY  84  -1.601   2.413   2.413
  661   2HA   GLY  84          1HA       GLY  84  -0.166   1.803   1.803
  662    H    THR  85           H        THR  85  -3.419   1.321   1.321
  663    HA   THR  85           HA       THR  85  -3.626  -0.338  -0.338
  664    HB   THR  85           HB       THR  85  -6.010   0.006   0.006
  665    HG1  THR  85           HG1      THR  85  -5.652   1.603   1.603
  666   1HG2  THR  85          3HG2      THR  85  -4.428   1.889   1.889
  667   2HG2  THR  85          2HG2      THR  85  -5.044   2.765   2.765
  668   3HG2  THR  85          1HG2      THR  85  -6.158   2.193   2.193
  669    H    VAL  86           H        VAL  86  -4.805  -2.331  -2.331
  670    HA   VAL  86           HA       VAL  86  -4.536  -3.524  -3.524
  671    HB   VAL  86           HB       VAL  86  -3.275  -4.608  -4.608
  672   1HG1  VAL  86          2HG1      VAL  86  -5.439  -4.085  -4.085
  673   2HG1  VAL  86          1HG1      VAL  86  -5.644  -5.806  -5.806
  674   3HG1  VAL  86          3HG1      VAL  86  -4.151  -5.218  -5.218
  675   1HG2  VAL  86          1HG2      VAL  86  -4.656  -5.801  -5.801
  676   2HG2  VAL  86          3HG2      VAL  86  -3.584  -6.662  -6.662
  677   3HG2  VAL  86          2HG2      VAL  86  -5.324  -6.642  -6.642
  678    H    ILE  87           H        ILE  87  -6.336  -3.892  -3.892
  679    HA   ILE  87           HA       ILE  87  -8.844  -4.402  -4.402
  680    HB   ILE  87           HB       ILE  87 -10.096  -3.184  -3.184
  681   1HG1  ILE  87          2HG1      ILE  87  -7.742  -1.782  -1.782
  682   2HG1  ILE  87          1HG1      ILE  87  -7.875  -3.467  -3.467
  683   1HG2  ILE  87          2HG2      ILE  87  -9.395  -2.032  -2.032
  684   2HG2  ILE  87          1HG2      ILE  87  -7.925  -1.495  -1.495
  685   3HG2  ILE  87          3HG2      ILE  87  -9.500  -0.932  -0.932
  686   1HD1  ILE  87          2HD1      ILE  87 -10.170  -1.559  -1.559
  687   2HD1  ILE  87          1HD1      ILE  87  -8.934  -1.721  -1.721
  688   3HD1  ILE  87          3HD1      ILE  87  -9.927  -3.110  -3.110
  689    H    GLU  88           H        GLU  88 -10.292  -5.845  -5.845
  690    HA   GLU  88           HA       GLU  88  -9.110  -7.543  -7.543
  691   1HB   GLU  88          2HB       GLU  88  -9.996  -8.365  -8.365
  692   2HB   GLU  88          1HB       GLU  88 -11.549  -8.346  -8.346
  693   1HG   GLU  88          2HG       GLU  88 -10.747  -9.888  -9.888
  694   2HG   GLU  88          1HG       GLU  88  -9.119  -9.820  -9.820
  695    H    HIS  89           H        HIS  89  -9.735  -5.857  -5.857
  696    HA   HIS  89           HA       HIS  89 -12.303  -5.018  -5.018
  697   1HB   HIS  89          2HB       HIS  89  -9.934  -4.499  -4.499
  698   2HB   HIS  89          1HB       HIS  89 -10.520  -5.638  -5.638
  699    HD1  HIS  89           HD1      HIS  89 -12.109  -4.753  -4.753
  700    HD2  HIS  89           HD2      HIS  89 -11.657  -2.178  -2.178
  701    HE1  HIS  89           HE1      HIS  89 -13.349  -2.661  -2.661
  702    HE2  HIS  89           HE2      HIS  89 -13.140  -1.150  -1.150
  703    HA   PRO  90           HA       PRO  90 -14.290  -8.676  -8.676
  704   1HB   PRO  90          2HB       PRO  90 -16.529  -7.585  -7.585
  705   2HB   PRO  90          1HB       PRO  90 -16.197  -7.598  -7.598
  706   1HG   PRO  90          2HG       PRO  90 -15.883  -5.375  -5.375
  707   2HG   PRO  90          1HG       PRO  90 -16.507  -5.320  -5.320
  708   1HD   PRO  90          2HD       PRO  90 -13.939  -4.623  -4.623
  709   2HD   PRO  90          1HD       PRO  90 -14.417  -5.129  -5.129
  710    H    GLU  91           H        GLU  91 -13.683  -5.922  -5.922
  711    HA   GLU  91           HA       GLU  91 -14.248  -7.400  -7.400
  712   1HB   GLU  91          2HB       GLU  91 -12.979  -4.678  -4.678
  713   2HB   GLU  91          1HB       GLU  91 -13.645  -5.363  -5.363
  714   1HG   GLU  91          2HG       GLU  91 -15.671  -5.450  -5.450
  715   2HG   GLU  91          1HG       GLU  91 -14.952  -3.841  -3.841
  716    H    TYR  92           H        TYR  92 -11.544  -6.827  -6.827
  717    HA   TYR  92           HA       TYR  92  -9.754  -7.927  -7.927
  718   1HB   TYR  92          2HB       TYR  92  -8.758  -6.314  -6.314
  719   2HB   TYR  92          1HB       TYR  92  -7.980  -6.617  -6.617
  720    HD1  TYR  92           HD1      TYR  92 -10.292  -5.941  -5.941
  721    HD2  TYR  92           HD2      TYR  92  -8.727  -3.955  -3.955
  722    HE1  TYR  92           HE1      TYR  92 -11.158  -3.806  -3.806
  723    HE2  TYR  92           HE2      TYR  92  -9.589  -1.812  -1.812
  724    HH   TYR  92           HH       TYR  92 -10.200  -0.997  -0.997
  725    H    GLY  93           H        GLY  93 -10.278  -7.751  -7.751
  726   1HA   GLY  93          2HA       GLY  93 -10.325  -9.603  -9.603
  727   2HA   GLY  93          1HA       GLY  93  -9.592 -10.581 -10.581
  728    H    GLU  94           H        GLU  94  -9.061  -8.698  -8.698
  729    HA   GLU  94           HA       GLU  94  -7.236  -8.370  -8.370
  730   1HB   GLU  94          2HB       GLU  94  -6.837 -10.853 -10.853
  731   2HB   GLU  94          1HB       GLU  94  -5.319 -10.008 -10.008
  732   1HG   GLU  94          2HG       GLU  94  -4.803  -9.928  -9.928
  733   2HG   GLU  94          1HG       GLU  94  -6.490  -9.888  -9.888
  734    H    VAL  95           H        VAL  95  -6.839  -6.248  -6.248
  735    HA   VAL  95           HA       VAL  95  -4.512  -5.760  -5.760
  736    HB   VAL  95           HB       VAL  95  -5.572  -3.779  -3.779
  737   1HG1  VAL  95          1HG1      VAL  95  -5.695  -6.355  -6.355
  738   2HG1  VAL  95          3HG1      VAL  95  -7.408  -5.933  -5.933
  739   3HG1  VAL  95          2HG1      VAL  95  -6.265  -4.991  -4.991
  740   1HG2  VAL  95          3HG2      VAL  95  -7.999  -4.816  -4.816
  741   2HG2  VAL  95          2HG2      VAL  95  -7.312  -3.192  -3.192
  742   3HG2  VAL  95          1HG2      VAL  95  -8.123  -3.784  -3.784
  743    H    ILE  96           H        ILE  96  -3.384  -3.834  -3.834
  744    HA   ILE  96           HA       ILE  96  -3.937  -2.889  -2.889
  745    HB   ILE  96           HB       ILE  96  -1.495  -3.101  -3.101
  746   1HG1  ILE  96          2HG1      ILE  96  -2.215  -4.619  -4.619
  747   2HG1  ILE  96          1HG1      ILE  96  -0.561  -4.015  -4.015
  748   1HG2  ILE  96          1HG2      ILE  96  -2.002  -0.822  -0.822
  749   2HG2  ILE  96          3HG2      ILE  96  -0.380  -1.495  -1.495
  750   3HG2  ILE  96          2HG2      ILE  96  -1.196  -0.829  -0.829
  751   1HD1  ILE  96          3HD1      ILE  96  -2.204  -2.181  -2.181
  752   2HD1  ILE  96          2HD1      ILE  96  -2.603  -3.806  -3.806
  753   3HD1  ILE  96          1HD1      ILE  96  -0.939  -3.232  -3.232
  754    H    GLN  97           H        GLN  97  -4.794  -0.961  -0.961
  755    HA   GLN  97           HA       GLN  97  -5.042   0.893   0.893
  756   1HB   GLN  97          2HB       GLN  97  -6.910  -0.023  -0.023
  757   2HB   GLN  97          1HB       GLN  97  -6.505   1.560   1.560
  758   1HG   GLN  97          2HG       GLN  97  -7.414   2.669   2.669
  759   2HG   GLN  97          1HG       GLN  97  -7.036   1.390   1.390
  760   1HE2  GLN  97          2HE2      GLN  97 -10.424   1.061   1.061
  761   2HE2  GLN  97          1HE2      GLN  97  -9.029   1.870   1.870
  762    H    LEU  98           H        LEU  98  -3.512   2.370   2.370
  763    HA   LEU  98           HA       LEU  98  -2.300   3.441   3.441
  764   1HB   LEU  98          2HB       LEU  98  -1.598   4.011   4.011
  765   2HB   LEU  98          1HB       LEU  98  -0.658   4.445   4.445
  766    HG   LEU  98           HG       LEU  98  -1.227   1.561   1.561
  767   1HD1  LEU  98          2HD1      LEU  98  -0.526   2.773   2.773
  768   2HD1  LEU  98          1HD1      LEU  98   1.075   2.642   2.642
  769   3HD1  LEU  98          3HD1      LEU  98   0.110   1.192   1.192
  770   1HD2  LEU  98          2HD2      LEU  98   0.287   3.004   3.004
  771   2HD2  LEU  98          1HD2      LEU  98   0.566   1.308   1.308
  772   3HD2  LEU  98          3HD2      LEU  98   1.485   2.566   2.566
  773    H    GLN  99           H        GLN  99  -2.055   5.801   5.801
  774    HA   GLN  99           HA       GLN  99  -4.525   7.123   7.123
  775   1HB   GLN  99          2HB       GLN  99  -3.052   7.119   7.119
  776   2HB   GLN  99          1HB       GLN  99  -2.783   8.716   8.716
  777   1HG   GLN  99          2HG       GLN  99  -5.547   8.095   8.095
  778   2HG   GLN  99          1HG       GLN  99  -5.027   7.759   7.759
  779   1HE2  GLN  99          1HE2      GLN  99  -5.541  10.184  10.184
  780   2HE2  GLN  99          2HE2      GLN  99  -5.318  11.554  11.554
  781    H    GLY 100           H        GLY 100  -4.614   9.017   9.017
  782   1HA   GLY 100          2HA       GLY 100  -3.898  10.745  10.745
  783   2HA   GLY 100          1HA       GLY 100  -2.267  10.478  10.478
  784    H    ASP 101           H        ASP 101  -2.536  11.121  11.121
  785    HA   ASP 101           HA       ASP 101  -2.845   8.891   8.891
  786   1HB   ASP 101          2HB       ASP 101  -1.739  10.371  10.371
  787   2HB   ASP 101          1HB       ASP 101  -3.128  11.106  11.106
  788    H    GLN 102           H        GLN 102  -1.582   7.198   7.198
  789    HA   GLN 102           HA       GLN 102   1.326   7.620   7.620
  790   1HB   GLN 102          2HB       GLN 102  -0.513   5.932   5.932
  791   2HB   GLN 102          1HB       GLN 102   0.898   5.067   5.067
  792   1HG   GLN 102          2HG       GLN 102   1.062   6.083   6.083
  793   2HG   GLN 102          1HG       GLN 102   2.377   6.445   6.445
  794   1HE2  GLN 102          2HE2      GLN 102  -0.331   9.464   9.464
  795   2HE2  GLN 102          1HE2      GLN 102  -0.851   7.849   7.849
  796    H    ARG 103           H        ARG 103  -0.865   6.833   6.833
  797    HA   ARG 103           HA       ARG 103  -0.375   4.392   4.392
  798   1HB   ARG 103          2HB       ARG 103  -0.796   5.437   5.437
  799   2HB   ARG 103          1HB       ARG 103  -1.974   5.881   5.881
  800   1HG   ARG 103          2HG       ARG 103  -0.848   8.020   8.020
  801   2HG   ARG 103          1HG       ARG 103   0.348   7.574   7.574
  802   1HD   ARG 103          2HD       ARG 103  -2.576   7.565   7.565
  803   2HD   ARG 103          1HD       ARG 103  -1.653   9.067   9.067
  804    HE   ARG 103           HE       ARG 103  -1.596   6.983   6.983
  805   1HH1  ARG 103          2HH1      ARG 103   0.377   9.426   9.426
  806   2HH1  ARG 103          1HH1      ARG 103   1.455   9.572   9.572
  807   1HH2  ARG 103          1HH2      ARG 103  -0.178   7.174   7.174
  808   2HH2  ARG 103          2HH2      ARG 103   1.141   8.294   8.294
  809    H    LYS 104           H        LYS 104   1.801   7.117   7.117
  810    HA   LYS 104           HA       LYS 104   3.696   5.695   5.695
  811   1HB   LYS 104          2HB       LYS 104   3.070   8.147   8.147
  812   2HB   LYS 104          1HB       LYS 104   4.015   8.493   8.493
  813   1HG   LYS 104          2HG       LYS 104   5.648   6.888   6.888
  814   2HG   LYS 104          1HG       LYS 104   4.895   8.062   8.062
  815   1HD   LYS 104          2HD       LYS 104   6.370   8.723   8.723
  816   2HD   LYS 104          1HD       LYS 104   7.026   8.877   8.877
  817   1HE   LYS 104          2HE       LYS 104   5.411  10.557  10.557
  818   2HE   LYS 104          1HE       LYS 104   4.551  10.302  10.302
  819   1HZ   LYS 104          1HZ       LYS 104   6.938  10.906  10.906
  820   2HZ   LYS 104          3HZ       LYS 104   7.018  11.764  11.764
  821   3HZ   LYS 104          2HZ       LYS 104   5.780  12.087  12.087
  822    H    ASN 105           H        ASN 105   3.109   6.524   6.524
  823    HA   ASN 105           HA       ASN 105   5.873   6.166   6.166
  824   1HB   ASN 105          2HB       ASN 105   3.340   6.945   6.945
  825   2HB   ASN 105          1HB       ASN 105   4.675   6.326   6.326
  826   1HD2  ASN 105          2HD2      ASN 105   4.657  10.108  10.108
  827   2HD2  ASN 105          1HD2      ASN 105   3.311   9.033   9.033
  828    H    ILE 106           H        ILE 106   2.816   4.398   4.398
  829    HA   ILE 106           HA       ILE 106   3.765   2.342   2.342
  830    HB   ILE 106           HB       ILE 106   1.365   2.800   2.800
  831   1HG1  ILE 106          2HG1      ILE 106   0.654   0.510   0.510
  832   2HG1  ILE 106          1HG1      ILE 106   2.086  -0.036  -0.036
  833   1HG2  ILE 106          3HG2      ILE 106   1.470   3.162   3.162
  834   2HG2  ILE 106          2HG2      ILE 106   1.762   1.441   1.441
  835   3HG2  ILE 106          1HG2      ILE 106   0.231   1.991   1.991
  836   1HD1  ILE 106          3HD1      ILE 106   2.589   1.425   1.425
  837   2HD1  ILE 106          2HD1      ILE 106   1.794  -0.140  -0.140
  838   3HD1  ILE 106          1HD1      ILE 106   3.354  -0.026  -0.026
  839    H    CYS 107           H        CYS 107   3.405   2.466   2.466
  840    HA   CYS 107           HA       CYS 107   4.346  -0.088  -0.088
  841   1HB   CYS 107          2HB       CYS 107   5.131   0.950   0.950
  842   2HB   CYS 107          1HB       CYS 107   3.440   1.232   1.232
  843    HG   CYS 107           HG       CYS 107   3.874   3.628   3.628
  844    H    GLN 108           H        GLN 108   5.999   2.843   2.843
  845    HA   GLN 108           HA       GLN 108   8.657   2.025   2.025
  846   1HB   GLN 108          2HB       GLN 108   7.381   4.179   4.179
  847   2HB   GLN 108          1HB       GLN 108   9.065   3.805   3.805
  848   1HG   GLN 108          2HG       GLN 108   8.307   4.203   4.203
  849   2HG   GLN 108          1HG       GLN 108   8.294   5.618   5.618
  850   1HE2  GLN 108          2HE2      GLN 108  11.894   3.703   3.703
  851   2HE2  GLN 108          1HE2      GLN 108  10.437   2.845   2.845
  852    H    PHE 109           H        PHE 109   6.782   2.141   2.141
  853    HA   PHE 109           HA       PHE 109   8.613   1.106   1.106
  854   1HB   PHE 109          2HB       PHE 109   6.418   2.053   2.053
  855   2HB   PHE 109          1HB       PHE 109   5.625   0.632   0.632
  856    HD1  PHE 109           HD2      PHE 109   8.273   1.499   1.499
  857    HD2  PHE 109           HD1      PHE 109   5.008  -1.025  -1.025
  858    HE1  PHE 109           HE2      PHE 109   8.439   0.393   0.393
  859    HE2  PHE 109           HE1      PHE 109   5.167  -2.134  -2.134
  860    HZ   PHE 109           HZ       PHE 109   6.884  -1.422  -1.422
  861    H    LEU 110           H        LEU 110   6.141  -0.709  -0.709
  862    HA   LEU 110           HA       LEU 110   6.798  -3.258  -3.258
  863   1HB   LEU 110          2HB       LEU 110   5.501  -2.144  -2.144
  864   2HB   LEU 110          1HB       LEU 110   5.956  -3.835  -3.835
  865    HG   LEU 110           HG       LEU 110   4.482  -4.349  -4.349
  866   1HD1  LEU 110          3HD1      LEU 110   4.351  -1.379  -1.379
  867   2HD1  LEU 110          2HD1      LEU 110   3.110  -2.456  -2.456
  868   3HD1  LEU 110          1HD1      LEU 110   4.787  -2.633  -2.633
  869   1HD2  LEU 110          2HD2      LEU 110   3.551  -3.692  -3.692
  870   2HD2  LEU 110          1HD2      LEU 110   2.450  -4.018  -4.018
  871   3HD2  LEU 110          3HD2      LEU 110   2.822  -2.354  -2.354
  872    H    VAL 111           H        VAL 111   8.372  -1.215  -1.215
  873    HA   VAL 111           HA       VAL 111  10.077  -3.391  -3.391
  874    HB   VAL 111           HB       VAL 111  10.020  -0.479  -0.479
  875   1HG1  VAL 111          1HG1      VAL 111  11.721  -2.778  -2.778
  876   2HG1  VAL 111          3HG1      VAL 111  11.211  -1.652  -1.652
  877   3HG1  VAL 111          2HG1      VAL 111  12.121  -1.065  -1.065
  878   1HG2  VAL 111          2HG2      VAL 111   8.073  -2.238  -2.238
  879   2HG2  VAL 111          1HG2      VAL 111   8.549  -0.975  -0.975
  880   3HG2  VAL 111          3HG2      VAL 111   9.158  -2.618  -2.618
  881    H    GLU 112           H        GLU 112  10.127  -0.710  -0.710
  882    HA   GLU 112           HA       GLU 112  12.989  -0.541  -0.541
  883   1HB   GLU 112          2HB       GLU 112  10.756   0.629   0.629
  884   2HB   GLU 112          1HB       GLU 112  12.458   0.912   0.912
  885   1HG   GLU 112          2HG       GLU 112  11.718   1.449   1.449
  886   2HG   GLU 112          1HG       GLU 112  10.874   2.459   2.459
  887    H    ILE 113           H        ILE 113  10.386  -1.869  -1.869
  888    HA   ILE 113           HA       ILE 113  12.269  -2.952  -2.952
  889    HB   ILE 113           HB       ILE 113  10.398  -3.698  -3.698
  890   1HG1  ILE 113          2HG1      ILE 113   8.712  -3.171  -3.171
  891   2HG1  ILE 113          1HG1      ILE 113   9.126  -4.753  -4.753
  892   1HG2  ILE 113          3HG2      ILE 113  10.820  -1.136  -1.136
  893   2HG2  ILE 113          2HG2      ILE 113   9.210  -1.226  -1.226
  894   3HG2  ILE 113          1HG2      ILE 113   9.455  -1.686  -1.686
  895   1HD1  ILE 113          1HD1      ILE 113   7.879  -3.117  -3.117
  896   2HD1  ILE 113          3HD1      ILE 113   6.872  -3.242  -3.242
  897   3HD1  ILE 113          2HD1      ILE 113   7.414  -4.703  -4.703
  898    H    GLY 114           H        GLY 114  10.899  -3.963  -3.963
  899   1HA   GLY 114          2HA       GLY 114  11.434  -5.913  -5.913
  900   2HA   GLY 114          1HA       GLY 114  12.095  -6.594  -6.594
  901    H    LEU 115           H        LEU 115   8.927  -5.143  -5.143
  902    HA   LEU 115           HA       LEU 115   7.703  -7.551  -7.551
  903   1HB   LEU 115          2HB       LEU 115   7.178  -4.916  -4.916
  904   2HB   LEU 115          1HB       LEU 115   5.997  -5.315  -5.315
  905    HG   LEU 115           HG       LEU 115   5.017  -7.001  -7.001
  906   1HD1  LEU 115          1HD1      LEU 115   7.479  -7.045  -7.045
  907   2HD1  LEU 115          3HD1      LEU 115   6.380  -6.351  -6.351
  908   3HD1  LEU 115          2HD1      LEU 115   6.028  -7.925  -7.925
  909   1HD2  LEU 115          1HD2      LEU 115   4.706  -4.362  -4.362
  910   2HD2  LEU 115          3HD2      LEU 115   3.808  -5.545  -5.545
  911   3HD2  LEU 115          2HD2      LEU 115   5.234  -4.763  -4.763
  912    H    ALA 116           H        ALA 116   6.572  -5.462  -5.462
  913    HA   ALA 116           HA       ALA 116   5.480  -7.772  -7.772
  914   1HB   ALA 116          2HB       ALA 116   4.379  -5.468  -5.468
  915   2HB   ALA 116          1HB       ALA 116   5.510  -4.974  -4.974
  916   3HB   ALA 116          3HB       ALA 116   4.355  -6.269  -6.269
  917    H    LYS 117           H        LYS 117   5.808  -6.992  -6.992
  918    HA   LYS 117           HA       LYS 117   8.720  -7.261  -7.261
  919   1HB   LYS 117          2HB       LYS 117   6.559  -8.957  -8.957
  920   2HB   LYS 117          1HB       LYS 117   7.492  -8.343  -8.343
  921   1HG   LYS 117          2HG       LYS 117   8.284 -10.525 -10.525
  922   2HG   LYS 117          1HG       LYS 117   9.514  -9.260  -9.260
  923   1HD   LYS 117          2HD       LYS 117   8.000  -9.343  -9.343
  924   2HD   LYS 117          1HD       LYS 117   8.760 -10.895 -10.895
  925   1HE   LYS 117          2HE       LYS 117  10.800  -9.233  -9.233
  926   2HE   LYS 117          1HE       LYS 117   9.977  -8.291  -8.291
  927   1HZ   LYS 117          3HZ       LYS 117  10.354 -11.103 -11.103
  928   2HZ   LYS 117          2HZ       LYS 117  11.773 -10.186 -10.186
  929   3HZ   LYS 117          1HZ       LYS 117  10.543  -9.745  -9.745
  930    H    ASP 118           H        ASP 118   9.651  -6.174  -6.174
  931    HA   ASP 118           HA       ASP 118   8.551  -3.693  -3.693
  932   1HB   ASP 118          2HB       ASP 118  10.346  -3.475  -3.475
  933   2HB   ASP 118          1HB       ASP 118  10.962  -4.189  -4.189
  934    H    ASP 119           H        ASP 119   8.289  -6.798  -6.798
  935    HA   ASP 119           HA       ASP 119   7.076  -5.756  -5.756
  936   1HB   ASP 119          2HB       ASP 119   7.293  -8.579  -8.579
  937   2HB   ASP 119          1HB       ASP 119   6.639  -8.160  -8.160
  938    H    GLN 120           H        GLN 120   6.057  -6.862  -6.862
  939    HA   GLN 120           HA       GLN 120   3.289  -7.193  -7.193
  940   1HB   GLN 120          2HB       GLN 120   4.643  -7.109  -7.109
  941   2HB   GLN 120          1HB       GLN 120   2.945  -7.480  -7.480
  942   1HG   GLN 120          2HG       GLN 120   3.633  -9.425  -9.425
  943   2HG   GLN 120          1HG       GLN 120   5.309  -9.082  -9.082
  944   1HE2  GLN 120          2HE2      GLN 120   2.809 -10.175 -10.175
  945   2HE2  GLN 120          1HE2      GLN 120   2.263  -9.109  -9.109
  946    H    LEU 121           H        LEU 121   5.274  -4.566  -4.566
  947    HA   LEU 121           HA       LEU 121   3.750  -2.852  -2.852
  948   1HB   LEU 121          2HB       LEU 121   5.599  -2.312  -2.312
  949   2HB   LEU 121          1HB       LEU 121   4.844  -1.017  -1.017
  950    HG   LEU 121           HG       LEU 121   6.566  -3.130  -3.130
  951   1HD1  LEU 121          3HD1      LEU 121   7.317  -0.498  -0.498
  952   2HD1  LEU 121          2HD1      LEU 121   8.270  -1.228  -1.228
  953   3HD1  LEU 121          1HD1      LEU 121   8.059  -2.081  -2.081
  954   1HD2  LEU 121          2HD2      LEU 121   4.953  -0.940  -0.940
  955   2HD2  LEU 121          1HD2      LEU 121   5.794  -2.200  -2.200
  956   3HD2  LEU 121          3HD2      LEU 121   6.645  -0.724  -0.724
  957    H    LYS 122           H        LYS 122   1.561  -3.055  -3.055
  958    HA   LYS 122           HA       LYS 122   0.631  -2.109  -2.109
  959   1HB   LYS 122          2HB       LYS 122  -0.380  -4.117  -4.117
  960   2HB   LYS 122          1HB       LYS 122  -1.608  -3.097  -3.097
  961   1HG   LYS 122          2HG       LYS 122   0.453  -4.607  -4.607
  962   2HG   LYS 122          1HG       LYS 122  -1.141  -5.252  -5.252
  963   1HD   LYS 122          2HD       LYS 122  -2.149  -4.018  -4.018
  964   2HD   LYS 122          1HD       LYS 122  -1.241  -2.568  -2.568
  965   1HE   LYS 122          2HE       LYS 122   0.688  -4.089  -4.089
  966   2HE   LYS 122          1HE       LYS 122  -0.737  -4.564  -4.564
  967   1HZ   LYS 122          3HZ       LYS 122  -0.057  -1.722  -1.722
  968   2HZ   LYS 122          2HZ       LYS 122   0.581  -2.588  -2.588
  969   3HZ   LYS 122          1HZ       LYS 122  -1.092  -2.379  -2.379
  970    H    VAL 123           H        VAL 123   1.111   0.092   0.092
  971    HA   VAL 123           HA       VAL 123  -0.598   1.145   1.145
  972    HB   VAL 123           HB       VAL 123   1.712   1.961   1.961
  973   1HG1  VAL 123          1HG1      VAL 123   1.264   1.962   1.962
  974   2HG1  VAL 123          3HG1      VAL 123   1.228   3.680   3.680
  975   3HG1  VAL 123          2HG1      VAL 123   2.640   2.708   2.708
  976   1HG2  VAL 123          2HG2      VAL 123  -0.486   3.966   3.966
  977   2HG2  VAL 123          1HG2      VAL 123   0.208   3.439   3.439
  978   3HG2  VAL 123          3HG2      VAL 123   1.163   4.424   4.424
  979    H    HIS 124           H        HIS 124  -2.613   1.800   1.800
  980    HA   HIS 124           HA       HIS 124  -3.272   2.732   2.732
  981   1HB   HIS 124          2HB       HIS 124  -5.063   1.399   1.399
  982   2HB   HIS 124          1HB       HIS 124  -5.598   2.021   2.021
  983    HD1  HIS 124           HD1      HIS 124  -5.295   0.527   0.527
  984    HD2  HIS 124           HD2      HIS 124  -3.299  -0.874  -0.874
  985    HE1  HIS 124           HE1      HIS 124  -4.466  -1.767  -1.767
  986    HE2  HIS 124           HE2      HIS 124  -3.179  -2.553  -2.553
  987    H    GLY 125           H        GLY 125  -3.532   3.402   3.402
  988   1HA   GLY 125          2HA       GLY 125  -4.082   5.330   5.330
  989   2HA   GLY 125          1HA       GLY 125  -3.808   6.175   6.175
  990    H    PHE 126           HN       PHE 126  -5.507   7.213   7.213
  991    HA   PHE 126           HA       PHE 126  -8.077   6.131   6.131
  992   1HB   PHE 126          2HB       PHE 126  -9.349   7.147   7.147
  993   2HB   PHE 126          1HB       PHE 126  -7.929   6.542   6.542
  994    HD1  PHE 126           HD1      PHE 126  -6.000   8.719   8.719
  995    HD2  PHE 126           HD2      PHE 126  -9.990   8.860   8.860
  996    HE1  PHE 126           HE1      PHE 126  -5.583  10.970  10.970
  997    HE2  PHE 126           HE2      PHE 126  -9.580  11.111  11.111
  998    HZ   PHE 126           HZ       PHE 126  -7.374  12.170  12.170

  Start of MODEL   25
    1   1H    MET   1          2H        MET   1   2.773 -15.264 -15.264
    2   2H    MET   1          1H        MET   1   4.370 -14.932 -14.932
    3   3H    MET   1          3H        MET   1   3.315 -15.857 -15.857
    4    HA   MET   1           HA       MET   1   2.028 -14.076 -14.076
    5   1HB   MET   1          2HB       MET   1   4.907 -13.178 -13.178
    6   2HB   MET   1          1HB       MET   1   3.695 -12.382 -12.382
    7   1HG   MET   1          2HG       MET   1   3.564 -15.041 -15.041
    8   2HG   MET   1          1HG       MET   1   5.285 -14.732 -14.732
    9   1HE   MET   1          3HE       MET   1   3.126 -15.341 -15.341
   10   2HE   MET   1          2HE       MET   1   3.118 -14.067 -14.067
   11   3HE   MET   1          1HE       MET   1   2.100 -13.923 -13.923
   12    H    ARG   2           H        ARG   2   4.271 -13.084 -13.084
   13    HA   ARG   2           HA       ARG   2   2.158 -11.387 -11.387
   14   1HB   ARG   2          2HB       ARG   2   3.887  -9.603  -9.603
   15   2HB   ARG   2          1HB       ARG   2   3.419  -9.798  -9.798
   16   1HG   ARG   2          2HG       ARG   2   5.444 -10.751 -10.751
   17   2HG   ARG   2          1HG       ARG   2   5.823 -11.214 -11.214
   18   1HD   ARG   2          2HD       ARG   2   5.917  -8.721  -8.721
   19   2HD   ARG   2          1HD       ARG   2   5.918  -8.480  -8.480
   20    HE   ARG   2           HE       ARG   2   7.928 -10.303 -10.303
   21   1HH1  ARG   2          2HH1      ARG   2   7.181  -6.976  -6.976
   22   2HH1  ARG   2          1HH1      ARG   2   8.841  -6.502  -6.502
   23   1HH2  ARG   2          1HH2      ARG   2  10.113  -9.680  -9.680
   24   2HH2  ARG   2          2HH2      ARG   2  10.506  -8.036  -8.036
   25    H    GLY   3           H        GLY   3   2.203 -13.405 -13.405
   26   1HA   GLY   3          2HA       GLY   3   3.481 -12.828 -12.828
   27   2HA   GLY   3          1HA       GLY   3   4.311 -14.141 -14.141
   28    H    SER   4           H        SER   4   2.696 -15.858 -15.858
   29    HA   SER   4           HA       SER   4   0.486 -16.281 -16.281
   30   1HB   SER   4          2HB       SER   4   1.186 -18.433 -18.433
   31   2HB   SER   4          1HB       SER   4   2.653 -17.459 -17.459
   32    HG   SER   4           HG       SER   4   3.065 -18.252 -18.252
   33    H    HIS   5           H        HIS   5  -0.489 -18.625 -18.625
   34    HA   HIS   5           HA       HIS   5  -1.778 -19.678 -19.678
   35   1HB   HIS   5          2HB       HIS   5   0.421 -20.283 -20.283
   36   2HB   HIS   5          1HB       HIS   5   0.401 -18.813 -18.813
   37    HD1  HIS   5           HD1      HIS   5  -1.664 -18.698 -18.698
   38    HD2  HIS   5           HD2      HIS   5  -0.699 -22.437 -22.437
   39    HE1  HIS   5           HE1      HIS   5  -2.706 -20.359 -20.359
   40    HE2  HIS   5           HE2      HIS   5  -2.182 -22.613 -22.613
   41    H    HIS   6           H        HIS   6  -3.511 -18.228 -18.228
   42    HA   HIS   6           HA       HIS   6  -3.621 -15.967 -15.967
   43   1HB   HIS   6          2HB       HIS   6  -4.999 -16.771 -16.771
   44   2HB   HIS   6          1HB       HIS   6  -6.100 -16.149 -16.149
   45    HD1  HIS   6           HD1      HIS   6  -2.668 -15.019 -15.019
   46    HD2  HIS   6           HD2      HIS   6  -6.467 -13.521 -13.521
   47    HE1  HIS   6           HE1      HIS   6  -2.536 -12.560 -12.560
   48    HE2  HIS   6           HE2      HIS   6  -4.826 -11.661 -11.661
   49    H    HIS   7           H        HIS   7  -6.131 -15.753 -15.753
   50    HA   HIS   7           HA       HIS   7  -6.546 -18.155 -18.155
   51   1HB   HIS   7          2HB       HIS   7  -7.816 -16.478 -16.478
   52   2HB   HIS   7          1HB       HIS   7  -6.058 -16.402 -16.402
   53    HD1  HIS   7           HD1      HIS   7  -9.080 -14.583 -14.583
   54    HD2  HIS   7           HD2      HIS   7  -4.997 -14.006 -14.006
   55    HE1  HIS   7           HE1      HIS   7  -8.671 -12.161 -12.161
   56    HE2  HIS   7           HE2      HIS   7  -6.180 -11.857 -11.857
   57    H    HIS   8           H        HIS   8  -8.085 -19.354 -19.354
   58    HA   HIS   8           HA       HIS   8 -10.663 -18.066 -18.066
   59   1HB   HIS   8          2HB       HIS   8  -9.355 -20.093 -20.093
   60   2HB   HIS   8          1HB       HIS   8 -10.947 -19.374 -19.374
   61    HD1  HIS   8           HD1      HIS   8 -10.495 -16.456 -16.456
   62    HD2  HIS   8           HD2      HIS   8  -7.743 -18.947 -18.947
   63    HE1  HIS   8           HE1      HIS   8  -9.147 -14.960 -14.960
   64    HE2  HIS   8           HE2      HIS   8  -7.555 -16.506 -16.506
   65    H    HIS   9           H        HIS   9  -9.697 -19.634 -19.634
   66    HA   HIS   9           HA       HIS   9 -11.899 -21.383 -21.383
   67   1HB   HIS   9          2HB       HIS   9 -10.681 -23.520 -23.520
   68   2HB   HIS   9          1HB       HIS   9 -10.606 -22.849 -22.849
   69    HD1  HIS   9           HD1      HIS   9  -8.515 -24.259 -24.259
   70    HD2  HIS   9           HD2      HIS   9  -8.021 -21.431 -21.431
   71    HE1  HIS   9           HE1      HIS   9  -6.031 -24.058 -24.058
   72    HE2  HIS   9           HE2      HIS   9  -5.760 -22.412 -22.412
   73    H    HIS  10           H        HIS  10 -12.380 -21.160 -21.160
   74    HA   HIS  10           HA       HIS  10 -10.236 -20.575 -20.575
   75   1HB   HIS  10          2HB       HIS  10 -13.215 -20.396 -20.396
   76   2HB   HIS  10          1HB       HIS  10 -11.930 -19.687 -19.687
   77    HD1  HIS  10           HD1      HIS  10 -10.728 -17.577 -17.577
   78    HD2  HIS  10           HD2      HIS  10 -14.013 -18.902 -18.902
   79    HE1  HIS  10           HE1      HIS  10 -11.304 -15.694 -15.694
   80    HE2  HIS  10           HE2      HIS  10 -13.245 -16.550 -16.550
   81    H    THR  11           H        THR  11  -9.666 -22.935 -22.935
   82    HA   THR  11           HA       THR  11 -11.412 -24.711 -24.711
   83    HB   THR  11           HB       THR  11  -8.853 -25.440 -25.440
   84    HG1  THR  11           HG1      THR  11  -9.891 -25.367 -25.367
   85   1HG2  THR  11          2HG2      THR  11 -11.048 -26.976 -26.976
   86   2HG2  THR  11          1HG2      THR  11 -10.357 -27.601 -27.601
   87   3HG2  THR  11          3HG2      THR  11  -9.322 -27.327 -27.327
   88    H    ASP  12           H        ASP  12  -8.687 -22.749 -22.749
   89    HA   ASP  12           HA       ASP  12  -7.276 -22.425 -22.425
   90   1HB   ASP  12          2HB       ASP  12  -9.146 -24.321 -24.321
   91   2HB   ASP  12          1HB       ASP  12  -7.925 -23.314 -23.314
   92    HA   PRO  13           HA       PRO  13  -5.288 -26.527 -26.527
   93   1HB   PRO  13          2HB       PRO  13  -3.153 -24.579 -24.579
   94   2HB   PRO  13          1HB       PRO  13  -3.737 -25.976 -25.976
   95   1HG   PRO  13          2HG       PRO  13  -4.365 -23.496 -23.496
   96   2HG   PRO  13          1HG       PRO  13  -5.543 -24.817 -24.817
   97   1HD   PRO  13          2HD       PRO  13  -5.359 -22.621 -22.621
   98   2HD   PRO  13          1HD       PRO  13  -6.796 -23.353 -23.353
   99    H    MET  14           H        MET  14  -4.361 -23.726 -23.726
  100    HA   MET  14           HA       MET  14  -2.031 -24.645 -24.645
  101   1HB   MET  14          2HB       MET  14  -4.123 -23.002 -23.002
  102   2HB   MET  14          1HB       MET  14  -2.383 -22.984 -22.984
  103   1HG   MET  14          2HG       MET  14  -2.482 -22.291 -22.291
  104   2HG   MET  14          1HG       MET  14  -4.022 -21.636 -21.636
  105   1HE   MET  14          2HE       MET  14  -3.954 -20.928 -20.928
  106   2HE   MET  14          1HE       MET  14  -2.450 -20.539 -20.539
  107   3HE   MET  14          3HE       MET  14  -3.397 -19.256 -19.256
  108    H    SER  15           H        SER  15  -5.354 -25.504 -25.504
  109    HA   SER  15           HA       SER  15  -5.156 -26.581 -26.581
  110   1HB   SER  15          2HB       SER  15  -7.180 -27.816 -27.816
  111   2HB   SER  15          1HB       SER  15  -7.291 -26.202 -26.202
  112    HG   SER  15           HG       SER  15  -6.493 -27.235 -27.235
  113    H    ALA  16           H        ALA  16  -4.155 -27.841 -27.841
  114    HA   ALA  16           HA       ALA  16  -3.671 -30.500 -30.500
  115   1HB   ALA  16          3HB       ALA  16  -4.569 -30.170 -30.170
  116   2HB   ALA  16          2HB       ALA  16  -3.025 -29.447 -29.447
  117   3HB   ALA  16          1HB       ALA  16  -3.093 -31.134 -31.134
  118    H    ILE  17           H        ILE  17  -2.194 -28.882 -28.882
  119    HA   ILE  17           HA       ILE  17   0.529 -29.496 -29.496
  120    HB   ILE  17           HB       ILE  17  -0.145 -26.789 -26.789
  121   1HG1  ILE  17          2HG1      ILE  17   0.360 -27.552 -27.552
  122   2HG1  ILE  17          1HG1      ILE  17  -1.174 -27.006 -27.006
  123   1HG2  ILE  17          2HG2      ILE  17   2.143 -27.706 -27.706
  124   2HG2  ILE  17          1HG2      ILE  17   2.342 -27.752 -27.752
  125   3HG2  ILE  17          3HG2      ILE  17   2.104 -26.209 -26.209
  126   1HD1  ILE  17          2HD1      ILE  17   1.345 -25.364 -25.364
  127   2HD1  ILE  17          1HD1      ILE  17   0.035 -25.256 -25.256
  128   3HD1  ILE  17          3HD1      ILE  17  -0.256 -24.830 -24.830
  129    H    GLN  18           H        GLN  18  -0.461 -31.108 -31.108
  130    HA   GLN  18           HA       GLN  18  -0.448 -30.258 -30.258
  131   1HB   GLN  18          2HB       GLN  18  -0.034 -33.084 -33.084
  132   2HB   GLN  18          1HB       GLN  18  -0.725 -32.554 -32.554
  133   1HG   GLN  18          2HG       GLN  18  -2.215 -31.506 -31.506
  134   2HG   GLN  18          1HG       GLN  18  -2.093 -33.264 -33.264
  135   1HE2  GLN  18          2HE2      GLN  18  -4.813 -33.491 -33.491
  136   2HE2  GLN  18          1HE2      GLN  18  -4.054 -33.911 -33.911
  137    H    ASN  19           H        ASN  19   1.072 -32.176 -32.176
  138    HA   ASN  19           HA       ASN  19   3.171 -32.681 -32.681
  139   1HB   ASN  19          2HB       ASN  19   3.493 -33.091 -33.091
  140   2HB   ASN  19          1HB       ASN  19   4.398 -31.581 -31.581
  141   1HD2  ASN  19          2HD2      ASN  19   6.288 -34.881 -34.881
  142   2HD2  ASN  19          1HD2      ASN  19   4.879 -34.699 -34.699
  143    H    LEU  20           H        LEU  20   3.568 -29.749 -29.749
  144    HA   LEU  20           HA       LEU  20   4.319 -27.661 -27.661
  145   1HB   LEU  20          2HB       LEU  20   3.070 -28.557 -28.557
  146   2HB   LEU  20          1HB       LEU  20   4.144 -27.174 -27.174
  147    HG   LEU  20           HG       LEU  20   2.789 -25.992 -25.992
  148   1HD1  LEU  20          1HD1      LEU  20   1.446 -28.622 -28.622
  149   2HD1  LEU  20          3HD1      LEU  20   0.416 -27.193 -27.193
  150   3HD1  LEU  20          2HD1      LEU  20   1.723 -27.417 -27.417
  151   1HD2  LEU  20          2HD2      LEU  20   1.502 -27.030 -27.030
  152   2HD2  LEU  20          1HD2      LEU  20   2.176 -25.434 -25.434
  153   3HD2  LEU  20          3HD2      LEU  20   0.646 -25.913 -25.913
  154    H    HIS  21           H        HIS  21   6.324 -29.259 -29.259
  155    HA   HIS  21           HA       HIS  21   8.167 -29.291 -29.291
  156   1HB   HIS  21          2HB       HIS  21   7.824 -31.053 -31.053
  157   2HB   HIS  21          1HB       HIS  21   9.087 -30.057 -30.057
  158    HD1  HIS  21           HD1      HIS  21  11.430 -30.503 -30.503
  159    HD2  HIS  21           HD2      HIS  21   8.613 -32.247 -32.247
  160    HE1  HIS  21           HE1      HIS  21  12.745 -31.929 -31.929
  161    HE2  HIS  21           HE2      HIS  21  11.013 -33.035 -33.035
  162    H    SER  22           H        SER  22  10.527 -28.662 -28.662
  163    HA   SER  22           HA       SER  22  10.777 -26.433 -26.433
  164   1HB   SER  22          2HB       SER  22  11.265 -25.830 -25.830
  165   2HB   SER  22          1HB       SER  22  11.178 -24.700 -24.700
  166    HG   SER  22           HG       SER  22   9.166 -24.505 -24.505
  167    H    PHE  23           H        PHE  23  13.056 -25.284 -25.284
  168    HA   PHE  23           HA       PHE  23  15.004 -27.199 -27.199
  169   1HB   PHE  23          2HB       PHE  23  14.399 -27.375 -27.375
  170   2HB   PHE  23          1HB       PHE  23  15.724 -26.217 -26.217
  171    HD1  PHE  23           HD2      PHE  23  15.110 -29.212 -29.212
  172    HD2  PHE  23           HD1      PHE  23  17.601 -27.316 -27.316
  173    HE1  PHE  23           HE2      PHE  23  16.722 -31.063 -31.063
  174    HE2  PHE  23           HE1      PHE  23  19.216 -29.164 -29.164
  175    HZ   PHE  23           HZ       PHE  23  18.778 -31.039 -31.039
  176    H    ASP  24           H        ASP  24  16.736 -26.198 -26.198
  177    HA   ASP  24           HA       ASP  24  17.230 -23.391 -23.391
  178   1HB   ASP  24          2HB       ASP  24  17.238 -24.415 -24.415
  179   2HB   ASP  24          1HB       ASP  24  17.450 -22.750 -22.750
  180    HA   PRO  25           HA       PRO  25  21.037 -26.206 -26.206
  181   1HB   PRO  25          2HB       PRO  25  21.472 -24.448 -24.448
  182   2HB   PRO  25          1HB       PRO  25  21.736 -26.186 -26.186
  183   1HG   PRO  25          2HG       PRO  25  19.646 -25.260 -25.260
  184   2HG   PRO  25          1HG       PRO  25  19.497 -26.694 -26.694
  185   1HD   PRO  25          2HD       PRO  25  18.581 -23.894 -23.894
  186   2HD   PRO  25          1HD       PRO  25  17.806 -25.431 -25.431
  187    H    PHE  26           H        PHE  26  20.445 -22.758 -22.758
  188    HA   PHE  26           HA       PHE  26  23.111 -22.246 -22.246
  189   1HB   PHE  26          2HB       PHE  26  22.227 -19.775 -19.775
  190   2HB   PHE  26          1HB       PHE  26  23.257 -20.818 -20.818
  191    HD1  PHE  26           HD1      PHE  26  21.982 -22.521 -22.521
  192    HD2  PHE  26           HD2      PHE  26  20.280 -18.962 -18.962
  193    HE1  PHE  26           HE1      PHE  26  20.284 -22.540 -22.540
  194    HE2  PHE  26           HE2      PHE  26  18.578 -18.974 -18.974
  195    HZ   PHE  26           HZ       PHE  26  18.578 -20.765 -20.765
  196    H    ALA  27           H        ALA  27  20.229 -20.185 -20.185
  197    HA   ALA  27           HA       ALA  27  19.357 -20.625 -20.625
  198   1HB   ALA  27          2HB       ALA  27  21.683 -18.789 -18.789
  199   2HB   ALA  27          1HB       ALA  27  20.385 -18.357 -18.357
  200   3HB   ALA  27          3HB       ALA  27  21.226 -19.897 -19.897
  201    H    ASP  28           H        ASP  28  17.371 -19.815 -19.815
  202    HA   ASP  28           HA       ASP  28  16.746 -17.610 -17.610
  203   1HB   ASP  28          2HB       ASP  28  15.235 -19.879 -19.879
  204   2HB   ASP  28          1HB       ASP  28  14.332 -18.379 -18.379
  205    H    ALA  29           H        ALA  29  15.624 -18.586 -18.586
  206    HA   ALA  29           HA       ALA  29  15.983 -15.815 -15.815
  207   1HB   ALA  29          2HB       ALA  29  13.553 -16.496 -16.496
  208   2HB   ALA  29          1HB       ALA  29  13.515 -17.240 -17.240
  209   3HB   ALA  29          3HB       ALA  29  13.823 -15.511 -15.511
  210    H    SER  30           H        SER  30  17.735 -16.432 -16.432
  211    HA   SER  30           HA       SER  30  17.206 -18.385 -18.385
  212   1HB   SER  30          2HB       SER  30  19.464 -17.937 -17.937
  213   2HB   SER  30          1HB       SER  30  19.944 -17.564 -17.564
  214    HG   SER  30           HG       SER  30  19.284 -19.615 -19.615
  215    H    LYS  31           H        LYS  31  17.657 -17.881 -17.881
  216    HA   LYS  31           HA       LYS  31  18.681 -15.388 -15.388
  217   1HB   LYS  31          2HB       LYS  31  16.202 -15.016 -15.016
  218   2HB   LYS  31          1HB       LYS  31  15.795 -15.545 -15.545
  219   1HG   LYS  31          2HG       LYS  31  17.686 -13.720 -13.720
  220   2HG   LYS  31          1HG       LYS  31  17.034 -13.041 -13.041
  221   1HD   LYS  31          2HD       LYS  31  14.825 -12.973 -12.973
  222   2HD   LYS  31          1HD       LYS  31  15.335 -13.878 -13.878
  223   1HE   LYS  31          2HE       LYS  31  16.215 -12.058 -12.058
  224   2HE   LYS  31          1HE       LYS  31  16.836 -11.403 -11.403
  225   1HZ   LYS  31          2HZ       LYS  31  14.142 -11.178 -11.178
  226   2HZ   LYS  31          1HZ       LYS  31  14.385 -10.822 -10.822
  227   3HZ   LYS  31          3HZ       LYS  31  15.194  -9.931  -9.931
  228    H    GLY  32           H        GLY  32  19.015 -18.169 -18.169
  229   1HA   GLY  32          2HA       GLY  32  19.754 -18.704 -18.704
  230   2HA   GLY  32          1HA       GLY  32  18.140 -18.225 -18.225
  231    H    ASP  33           H        ASP  33  17.183 -20.022 -20.022
  232    HA   ASP  33           HA       ASP  33  16.453 -22.075 -22.075
  233   1HB   ASP  33          2HB       ASP  33  18.806 -22.528 -22.528
  234   2HB   ASP  33          1HB       ASP  33  17.631 -23.837 -23.837
  235    H    ASP  34           H        ASP  34  15.154 -20.295 -20.295
  236    HA   ASP  34           HA       ASP  34  13.571 -22.225 -22.225
  237   1HB   ASP  34          2HB       ASP  34  15.498 -20.517 -20.517
  238   2HB   ASP  34          1HB       ASP  34  13.867 -20.139 -20.139
  239    H    LEU  35           H        LEU  35  11.990 -21.637 -21.637
  240    HA   LEU  35           HA       LEU  35  10.841 -18.955 -18.955
  241   1HB   LEU  35          2HB       LEU  35  11.802 -19.575 -19.575
  242   2HB   LEU  35          1HB       LEU  35  10.398 -20.614 -20.614
  243    HG   LEU  35           HG       LEU  35   8.923 -18.663 -18.663
  244   1HD1  LEU  35          1HD1      LEU  35  11.507 -17.329 -17.329
  245   2HD1  LEU  35          3HD1      LEU  35  10.319 -16.427 -16.427
  246   3HD1  LEU  35          2HD1      LEU  35   9.904 -17.019 -17.019
  247   1HD2  LEU  35          1HD2      LEU  35  10.932 -18.874 -18.874
  248   2HD2  LEU  35          3HD2      LEU  35   9.177 -19.035 -19.035
  249   3HD2  LEU  35          2HD2      LEU  35   9.912 -17.435 -17.435
  250    H    LEU  36           H        LEU  36   9.823 -20.151 -20.151
  251    HA   LEU  36           HA       LEU  36   7.841 -22.128 -22.128
  252   1HB   LEU  36          2HB       LEU  36   8.529 -20.415 -20.415
  253   2HB   LEU  36          1HB       LEU  36   7.069 -21.385 -21.385
  254    HG   LEU  36           HG       LEU  36   8.387 -23.420 -23.420
  255   1HD1  LEU  36          1HD1      LEU  36  10.679 -21.487 -21.487
  256   2HD1  LEU  36          3HD1      LEU  36  10.905 -23.176 -23.176
  257   3HD1  LEU  36          2HD1      LEU  36  10.243 -22.770 -22.770
  258   1HD2  LEU  36          3HD2      LEU  36   8.069 -22.031 -22.031
  259   2HD2  LEU  36          2HD2      LEU  36   8.888 -23.591 -23.591
  260   3HD2  LEU  36          1HD2      LEU  36   9.830 -22.100 -22.100
  261    HA   PRO  37           HA       PRO  37   4.238 -19.957 -19.957
  262   1HB   PRO  37          2HB       PRO  37   2.869 -21.024 -21.024
  263   2HB   PRO  37          1HB       PRO  37   2.381 -21.109 -21.109
  264   1HG   PRO  37          2HG       PRO  37   3.394 -23.244 -23.244
  265   2HG   PRO  37          1HG       PRO  37   3.811 -22.878 -22.878
  266   1HD   PRO  37          2HD       PRO  37   5.430 -22.509 -22.509
  267   2HD   PRO  37          1HD       PRO  37   5.953 -22.964 -22.964
  268    H    ALA  38           H        ALA  38   3.556 -17.914 -17.914
  269    HA   ALA  38           HA       ALA  38   3.933 -16.636 -16.636
  270   1HB   ALA  38          3HB       ALA  38   5.326 -15.757 -15.757
  271   2HB   ALA  38          2HB       ALA  38   3.855 -15.314 -15.314
  272   3HB   ALA  38          1HB       ALA  38   4.235 -14.546 -14.546
  273    H    GLY  39           H        GLY  39   2.357 -15.176 -15.176
  274   1HA   GLY  39          2HA       GLY  39  -0.204 -15.122 -15.122
  275   2HA   GLY  39          1HA       GLY  39  -0.177 -15.772 -15.772
  276    H    THR  40           H        THR  40   0.008 -14.394 -14.394
  277    HA   THR  40           HA       THR  40  -0.338 -11.546 -11.546
  278    HB   THR  40           HB       THR  40  -1.221 -11.510 -11.510
  279    HG1  THR  40           HG1      THR  40  -0.499 -13.656 -13.656
  280   1HG2  THR  40          3HG2      THR  40  -2.775 -12.956 -12.956
  281   2HG2  THR  40          2HG2      THR  40  -3.452 -12.261 -12.261
  282   3HG2  THR  40          1HG2      THR  40  -2.719 -11.212 -11.212
  283    H    GLU  41           H        GLU  41   1.867 -13.744 -13.744
  284    HA   GLU  41           HA       GLU  41   3.887 -13.487 -13.487
  285   1HB   GLU  41          2HB       GLU  41   3.377 -10.867 -10.867
  286   2HB   GLU  41          1HB       GLU  41   4.525 -10.834 -10.834
  287   1HG   GLU  41          2HG       GLU  41   6.092 -12.007 -12.007
  288   2HG   GLU  41          1HG       GLU  41   4.900 -12.943 -12.943
  289    H    ASP  42           H        ASP  42   1.188 -12.947 -12.947
  290    HA   ASP  42           HA       ASP  42   0.449 -12.434 -12.434
  291   1HB   ASP  42          2HB       ASP  42   2.618 -14.006 -14.006
  292   2HB   ASP  42          1HB       ASP  42   3.176 -12.575 -12.575
  293    H    TYR  43           H        TYR  43   0.081 -10.237 -10.237
  294    HA   TYR  43           HA       TYR  43   2.030  -8.216  -8.216
  295   1HB   TYR  43          2HB       TYR  43  -0.771  -8.121  -8.121
  296   2HB   TYR  43          1HB       TYR  43   0.131  -6.668  -6.668
  297    HD1  TYR  43           HD1      TYR  43   2.576  -8.853  -8.853
  298    HD2  TYR  43           HD2      TYR  43  -0.696  -6.595  -6.595
  299    HE1  TYR  43           HE1      TYR  43   3.593  -8.881  -8.881
  300    HE2  TYR  43           HE2      TYR  43   0.312  -6.602  -6.602
  301    HH   TYR  43           HH       TYR  43   3.300  -7.114  -7.114
  302    H    ILE  44           H        ILE  44   1.124  -6.186  -6.186
  303    HA   ILE  44           HA       ILE  44  -0.424  -6.980  -6.980
  304    HB   ILE  44           HB       ILE  44   2.086  -5.296  -5.296
  305   1HG1  ILE  44          2HG1      ILE  44   2.625  -7.646  -7.646
  306   2HG1  ILE  44          1HG1      ILE  44   2.998  -7.154  -7.154
  307   1HG2  ILE  44          2HG2      ILE  44   0.115  -6.071  -6.071
  308   2HG2  ILE  44          1HG2      ILE  44   1.748  -5.507  -5.507
  309   3HG2  ILE  44          3HG2      ILE  44   0.618  -4.451  -4.451
  310   1HD1  ILE  44          3HD1      ILE  44   0.414  -8.063  -8.063
  311   2HD1  ILE  44          2HD1      ILE  44   1.153  -9.166  -9.166
  312   3HD1  ILE  44          1HD1      ILE  44   1.869  -8.958  -8.958
  313    H    HIS  45           H        HIS  45  -2.175  -5.981  -5.981
  314    HA   HIS  45           HA       HIS  45  -2.320  -3.439  -3.439
  315   1HB   HIS  45          2HB       HIS  45  -4.164  -5.465  -5.465
  316   2HB   HIS  45          1HB       HIS  45  -4.771  -3.872  -3.872
  317    HD1  HIS  45           HD1      HIS  45  -3.735  -5.896  -5.896
  318    HD2  HIS  45           HD2      HIS  45  -5.765  -2.388  -2.388
  319    HE1  HIS  45           HE1      HIS  45  -4.787  -5.143  -5.143
  320    HE2  HIS  45           HE2      HIS  45  -5.961  -2.987  -2.987
  321    H    ILE  46           H        ILE  46  -2.637  -1.443  -1.443
  322    HA   ILE  46           HA       ILE  46  -2.347  -0.958  -0.958
  323    HB   ILE  46           HB       ILE  46  -1.958   0.937   0.937
  324   1HG1  ILE  46          2HG1      ILE  46  -0.248  -0.885  -0.885
  325   2HG1  ILE  46          1HG1      ILE  46   0.392   0.751   0.751
  326   1HG2  ILE  46          3HG2      ILE  46  -2.136   1.374   1.374
  327   2HG2  ILE  46          2HG2      ILE  46  -0.758   2.137   2.137
  328   3HG2  ILE  46          1HG2      ILE  46  -2.397   2.493   2.493
  329   1HD1  ILE  46          2HD1      ILE  46   0.021   0.381   0.381
  330   2HD1  ILE  46          1HD1      ILE  46   0.060  -1.323  -1.323
  331   3HD1  ILE  46          3HD1      ILE  46   1.440  -0.283  -0.283
  332    H    ARG  47           H        ARG  47  -3.689   1.566   1.566
  333    HA   ARG  47           HA       ARG  47  -5.822   2.318   2.318
  334   1HB   ARG  47          2HB       ARG  47  -6.382  -0.265  -0.265
  335   2HB   ARG  47          1HB       ARG  47  -7.149   0.541   0.541
  336   1HG   ARG  47          2HG       ARG  47  -7.680   1.626   1.626
  337   2HG   ARG  47          1HG       ARG  47  -8.416   0.080   0.080
  338   1HD   ARG  47          2HD       ARG  47  -9.301   1.164   1.164
  339   2HD   ARG  47          1HD       ARG  47  -8.705   2.704   2.704
  340    HE   ARG  47           HE       ARG  47 -10.401   1.360   1.360
  341   1HH1  ARG  47          2HH1      ARG  47 -10.383   3.402   3.402
  342   2HH1  ARG  47          1HH1      ARG  47 -11.940   4.085   4.085
  343   1HH2  ARG  47          1HH2      ARG  47 -12.447   2.258   2.258
  344   2HH2  ARG  47          2HH2      ARG  47 -13.112   3.436   3.436
  345    H    ILE  48           H        ILE  48  -6.360   4.167   4.167
  346    HA   ILE  48           HA       ILE  48  -6.070   4.583   4.583
  347    HB   ILE  48           HB       ILE  48  -5.788   6.400   6.400
  348   1HG1  ILE  48          2HG1      ILE  48  -4.231   6.075   6.075
  349   2HG1  ILE  48          1HG1      ILE  48  -3.796   5.386   5.386
  350   1HG2  ILE  48          2HG2      ILE  48  -6.530   7.311   7.311
  351   2HG2  ILE  48          1HG2      ILE  48  -5.844   8.363   8.363
  352   3HG2  ILE  48          3HG2      ILE  48  -7.414   7.603   7.603
  353   1HD1  ILE  48          2HD1      ILE  48  -4.064   8.338   8.338
  354   2HD1  ILE  48          1HD1      ILE  48  -2.546   7.449   7.449
  355   3HD1  ILE  48          3HD1      ILE  48  -3.369   7.535   7.535
  356    H    GLN  49           H        GLN  49  -7.686   5.867   5.867
  357    HA   GLN  49           HA       GLN  49 -10.264   6.094   6.094
  358   1HB   GLN  49          2HB       GLN  49 -11.459   5.073   5.073
  359   2HB   GLN  49          1HB       GLN  49 -10.283   3.942   3.942
  360   1HG   GLN  49          2HG       GLN  49  -8.866   5.189   5.189
  361   2HG   GLN  49          1HG       GLN  49 -10.490   5.112   5.112
  362   1HE2  GLN  49          2HE2      GLN  49 -10.400   1.718   1.718
  363   2HE2  GLN  49          1HE2      GLN  49 -11.267   3.211   3.211
  364    H    GLN  50           H        GLN  50 -10.333   8.277   8.277
  365    HA   GLN  50           HA       GLN  50  -9.808   9.703   9.703
  366   1HB   GLN  50          2HB       GLN  50  -9.130  10.278  10.278
  367   2HB   GLN  50          1HB       GLN  50 -10.542  11.297  11.297
  368   1HG   GLN  50          2HG       GLN  50  -9.494  12.327  12.327
  369   2HG   GLN  50          1HG       GLN  50  -8.110  11.251  11.251
  370   1HE2  GLN  50          2HE2      GLN  50  -6.518  13.762  13.762
  371   2HE2  GLN  50          1HE2      GLN  50  -6.567  12.737  12.737
  372    H    ARG  51           H        ARG  51 -11.466   9.990   9.990
  373    HA   ARG  51           HA       ARG  51 -14.176  10.141  10.141
  374   1HB   ARG  51          2HB       ARG  51 -13.703  10.272  10.272
  375   2HB   ARG  51          1HB       ARG  51 -14.951   9.423   9.423
  376   1HG   ARG  51          2HG       ARG  51 -12.749   8.037   8.037
  377   2HG   ARG  51          1HG       ARG  51 -12.309   8.509   8.509
  378   1HD   ARG  51          2HD       ARG  51 -13.707   7.018   7.018
  379   2HD   ARG  51          1HD       ARG  51 -15.043   7.590   7.590
  380    HE   ARG  51           HE       ARG  51 -13.549   5.230   5.230
  381   1HH1  ARG  51          2HH1      ARG  51 -14.993   7.856   7.856
  382   2HH1  ARG  51          1HH1      ARG  51 -15.224   6.917   6.917
  383   1HH2  ARG  51          1HH2      ARG  51 -13.851   3.993   3.993
  384   2HH2  ARG  51          2HH2      ARG  51 -14.575   4.723   4.723
  385    H    ASN  52           H        ASN  52 -15.113  12.039  12.039
  386    HA   ASN  52           HA       ASN  52 -15.748  14.216  14.216
  387   1HB   ASN  52          2HB       ASN  52 -15.458  13.559  13.559
  388   2HB   ASN  52          1HB       ASN  52 -14.021  14.572  14.572
  389   1HD2  ASN  52          2HD2      ASN  52 -16.154  17.154  17.154
  390   2HD2  ASN  52          1HD2      ASN  52 -14.902  16.058  16.058
  391    H    GLY  53           H        GLY  53 -13.191  13.239  13.239
  392   1HA   GLY  53          2HA       GLY  53 -11.435  14.156  14.156
  393   2HA   GLY  53          1HA       GLY  53 -12.247  15.701  15.701
  394    H    ARG  54           H        ARG  54 -10.857  13.507  13.507
  395    HA   ARG  54           HA       ARG  54  -8.521  15.034  15.034
  396   1HB   ARG  54          2HB       ARG  54  -9.026  16.178  16.178
  397   2HB   ARG  54          1HB       ARG  54 -10.269  16.615  16.615
  398   1HG   ARG  54          2HG       ARG  54 -11.820  15.063  15.063
  399   2HG   ARG  54          1HG       ARG  54 -10.570  14.545  14.545
  400   1HD   ARG  54          2HD       ARG  54 -11.886  17.244  17.244
  401   2HD   ARG  54          1HD       ARG  54 -11.954  16.106  16.106
  402    HE   ARG  54           HE       ARG  54  -9.316  16.647  16.647
  403   1HH1  ARG  54          2HH1      ARG  54 -12.147  18.675  18.675
  404   2HH1  ARG  54          1HH1      ARG  54 -11.316  19.954  19.954
  405   1HH2  ARG  54          1HH2      ARG  54  -8.222  18.329  18.329
  406   2HH2  ARG  54          2HH2      ARG  54  -9.088  19.759  19.759
  407    H    LYS  55           H        LYS  55 -10.935  12.914  12.914
  408    HA   LYS  55           HA       LYS  55  -9.097  11.702  11.702
  409   1HB   LYS  55          2HB       LYS  55 -11.807  10.799  10.799
  410   2HB   LYS  55          1HB       LYS  55 -10.907  10.008  10.008
  411   1HG   LYS  55          2HG       LYS  55 -11.668  12.908  12.908
  412   2HG   LYS  55          1HG       LYS  55 -12.730  11.620  11.620
  413   1HD   LYS  55          2HD       LYS  55 -11.662  11.767  11.767
  414   2HD   LYS  55          1HD       LYS  55 -10.279  11.025  11.025
  415   1HE   LYS  55          2HE       LYS  55  -9.331  13.162  13.162
  416   2HE   LYS  55          1HE       LYS  55 -10.787  13.994  13.994
  417   1HZ   LYS  55          3HZ       LYS  55  -9.036  12.358  12.358
  418   2HZ   LYS  55          2HZ       LYS  55  -8.960  14.043  14.043
  419   3HZ   LYS  55          1HZ       LYS  55 -10.354  13.303  13.303
  420    H    THR  56           H        THR  56  -7.524  11.500  11.500
  421    HA   THR  56           HA       THR  56  -7.933   9.333   9.333
  422    HB   THR  56           HB       THR  56  -5.155  10.120  10.120
  423    HG1  THR  56           HG1      THR  56  -5.635  12.146  12.146
  424   1HG2  THR  56          3HG2      THR  56  -6.828   9.469   9.469
  425   2HG2  THR  56          2HG2      THR  56  -5.860  10.915  10.915
  426   3HG2  THR  56          1HG2      THR  56  -5.073   9.403   9.403
  427    H    LEU  57           H        LEU  57  -7.397   7.232   7.232
  428    HA   LEU  57           HA       LEU  57  -5.687   6.369   6.369
  429   1HB   LEU  57          2HB       LEU  57  -8.582   5.903   5.903
  430   2HB   LEU  57          1HB       LEU  57  -7.636   4.463   4.463
  431    HG   LEU  57           HG       LEU  57  -7.242   6.922   6.922
  432   1HD1  LEU  57          2HD1      LEU  57  -9.431   4.875   4.875
  433   2HD1  LEU  57          1HD1      LEU  57  -8.903   5.923   5.923
  434   3HD1  LEU  57          3HD1      LEU  57  -9.596   6.626   6.626
  435   1HD2  LEU  57          1HD2      LEU  57  -6.431   4.115   4.115
  436   2HD2  LEU  57          3HD2      LEU  57  -5.698   5.521   5.521
  437   3HD2  LEU  57          2HD2      LEU  57  -7.055   4.700   4.700
  438    H    THR  58           H        THR  58  -4.121   5.542   5.542
  439    HA   THR  58           HA       THR  58  -4.677   4.031   4.031
  440    HB   THR  58           HB       THR  58  -2.104   4.175   4.175
  441    HG1  THR  58           HG1      THR  58  -3.085   6.224   6.224
  442   1HG2  THR  58          2HG2      THR  58  -2.708   3.360   3.360
  443   2HG2  THR  58          1HG2      THR  58  -1.107   3.893   3.893
  444   3HG2  THR  58          3HG2      THR  58  -1.837   2.465   2.465
  445    H    THR  59           H        THR  59  -4.841   1.859   1.859
  446    HA   THR  59           HA       THR  59  -4.541   0.186   0.186
  447    HB   THR  59           HB       THR  59  -6.194  -1.292  -1.292
  448    HG1  THR  59           HG1      THR  59  -6.992   1.400   1.400
  449   1HG2  THR  59          1HG2      THR  59  -6.596   0.514   0.514
  450   2HG2  THR  59          3HG2      THR  59  -8.046   0.186   0.186
  451   3HG2  THR  59          2HG2      THR  59  -7.132  -1.149  -1.149
  452    H    VAL  60           H        VAL  60  -3.813  -1.971  -1.971
  453    HA   VAL  60           HA       VAL  60  -2.336  -2.421  -2.421
  454    HB   VAL  60           HB       VAL  60  -1.431  -3.181  -3.181
  455   1HG1  VAL  60          2HG1      VAL  60  -0.776  -4.811  -4.811
  456   2HG1  VAL  60          1HG1      VAL  60  -0.010  -3.508  -3.508
  457   3HG1  VAL  60          3HG1      VAL  60   0.611  -3.960  -3.960
  458   1HG2  VAL  60          1HG2      VAL  60  -0.825  -0.907  -0.907
  459   2HG2  VAL  60          3HG2      VAL  60  -0.918  -0.963  -0.963
  460   3HG2  VAL  60          2HG2      VAL  60   0.507  -1.595  -1.595
  461    H    GLN  61           H        GLN  61  -2.972  -4.168  -4.168
  462    HA   GLN  61           HA       GLN  61  -4.166  -6.383  -6.383
  463   1HB   GLN  61          2HB       GLN  61  -4.929  -6.466  -6.466
  464   2HB   GLN  61          1HB       GLN  61  -5.951  -6.372  -6.372
  465   1HG   GLN  61          2HG       GLN  61  -5.638  -3.915  -3.915
  466   2HG   GLN  61          1HG       GLN  61  -4.735  -4.068  -4.068
  467   1HE2  GLN  61          2HE2      GLN  61  -7.974  -5.472  -5.472
  468   2HE2  GLN  61          1HE2      GLN  61  -6.527  -6.261  -6.261
  469    H    GLY  62           H        GLY  62  -3.482  -8.437  -8.437
  470   1HA   GLY  62          2HA       GLY  62  -2.459 -10.036 -10.036
  471   2HA   GLY  62          1HA       GLY  62  -1.394  -8.740  -8.740
  472    H    ILE  63           H        ILE  63  -1.124  -7.846  -7.846
  473    HA   ILE  63           HA       ILE  63   1.231  -9.311  -9.311
  474    HB   ILE  63           HB       ILE  63  -0.328  -7.246  -7.246
  475   1HG1  ILE  63          2HG1      ILE  63   0.776  -6.080  -6.080
  476   2HG1  ILE  63          1HG1      ILE  63   2.008  -6.072  -6.072
  477   1HG2  ILE  63          1HG2      ILE  63   1.808  -9.004  -9.004
  478   2HG2  ILE  63          3HG2      ILE  63   2.077  -7.289  -7.289
  479   3HG2  ILE  63          2HG2      ILE  63   0.614  -8.072  -8.072
  480   1HD1  ILE  63          3HD1      ILE  63   2.866  -8.205  -8.205
  481   2HD1  ILE  63          2HD1      ILE  63   1.900  -7.626  -7.626
  482   3HD1  ILE  63          1HD1      ILE  63   3.197  -6.623  -6.623
  483    H    ALA  64           H        ALA  64   1.669 -10.737 -10.737
  484    HA   ALA  64           HA       ALA  64  -0.534 -12.427 -12.427
  485   1HB   ALA  64          2HB       ALA  64   1.943 -13.054 -13.054
  486   2HB   ALA  64          1HB       ALA  64   2.204 -12.815 -12.815
  487   3HB   ALA  64          3HB       ALA  64   1.031 -14.008 -14.008
  488    H    ASP  65           H        ASP  65  -1.364 -12.747 -12.747
  489    HA   ASP  65           HA       ASP  65  -1.232 -10.576 -10.576
  490   1HB   ASP  65          2HB       ASP  65  -2.640 -12.063 -12.063
  491   2HB   ASP  65          1HB       ASP  65  -3.280 -11.810 -11.810
  492    H    ASP  66           H        ASP  66   0.825 -13.202 -13.202
  493    HA   ASP  66           HA       ASP  66   1.662 -13.345 -13.345
  494   1HB   ASP  66          2HB       ASP  66   1.400 -15.373 -15.373
  495   2HB   ASP  66          1HB       ASP  66   2.938 -14.854 -14.854
  496    H    TYR  67           H        TYR  67   2.114 -10.928 -10.928
  497    HA   TYR  67           HA       TYR  67   4.993 -10.887 -10.887
  498   1HB   TYR  67          2HB       TYR  67   2.739  -9.005  -9.005
  499   2HB   TYR  67          1HB       TYR  67   4.386  -8.393  -8.393
  500    HD1  TYR  67           HD1      TYR  67   4.037 -11.807 -11.807
  501    HD2  TYR  67           HD2      TYR  67   3.968  -7.738  -7.738
  502    HE1  TYR  67           HE1      TYR  67   4.365 -12.510 -12.510
  503    HE2  TYR  67           HE2      TYR  67   4.296  -8.422  -8.422
  504    HH   TYR  67           HH       TYR  67   5.145 -10.296 -10.296
  505    H    ASP  68           H        ASP  68   3.960 -11.242 -11.242
  506    HA   ASP  68           HA       ASP  68   4.668 -10.623 -10.623
  507   1HB   ASP  68          2HB       ASP  68   6.588  -9.514  -9.514
  508   2HB   ASP  68          1HB       ASP  68   5.815  -8.032  -8.032
  509    H    LYS  69           H        LYS  69   2.676  -8.788  -8.788
  510    HA   LYS  69           HA       LYS  69   0.945  -7.378  -7.378
  511   1HB   LYS  69          2HB       LYS  69   1.088  -9.096  -9.096
  512   2HB   LYS  69          1HB       LYS  69   0.512  -7.505  -7.505
  513   1HG   LYS  69          2HG       LYS  69  -1.504  -8.127  -8.127
  514   2HG   LYS  69          1HG       LYS  69  -0.896  -8.100  -8.100
  515   1HD   LYS  69          2HD       LYS  69  -1.540 -10.260 -10.260
  516   2HD   LYS  69          1HD       LYS  69  -0.003 -10.519 -10.519
  517   1HE   LYS  69          2HE       LYS  69  -2.753 -10.295 -10.295
  518   2HE   LYS  69          1HE       LYS  69  -1.637 -11.658 -11.658
  519   1HZ   LYS  69          3HZ       LYS  69  -0.131  -9.912  -9.912
  520   2HZ   LYS  69          2HZ       LYS  69  -1.603  -9.142  -9.142
  521   3HZ   LYS  69          1HZ       LYS  69  -1.340 -10.724 -10.724
  522    H    LYS  70           H        LYS  70   2.403  -6.982  -6.982
  523    HA   LYS  70           HA       LYS  70   2.174  -4.235  -4.235
  524   1HB   LYS  70          2HB       LYS  70   3.306  -6.268  -6.268
  525   2HB   LYS  70          1HB       LYS  70   4.554  -5.046  -5.046
  526   1HG   LYS  70          2HG       LYS  70   3.356  -4.505  -4.505
  527   2HG   LYS  70          1HG       LYS  70   2.864  -3.343  -3.343
  528   1HD   LYS  70          2HD       LYS  70   0.889  -4.040  -4.040
  529   2HD   LYS  70          1HD       LYS  70   0.880  -4.817  -4.817
  530   1HE   LYS  70          2HE       LYS  70   0.549  -6.739  -6.739
  531   2HE   LYS  70          1HE       LYS  70   2.223  -6.618  -6.618
  532   1HZ   LYS  70          3HZ       LYS  70   1.078  -5.110  -5.110
  533   2HZ   LYS  70          2HZ       LYS  70  -0.246  -6.100  -6.100
  534   3HZ   LYS  70          1HZ       LYS  70   1.205  -6.788  -6.788
  535    H    LYS  71           H        LYS  71   5.280  -5.916  -5.916
  536    HA   LYS  71           HA       LYS  71   6.813  -3.770  -3.770
  537   1HB   LYS  71          2HB       LYS  71   7.152  -6.507  -6.507
  538   2HB   LYS  71          1HB       LYS  71   7.379  -6.107  -6.107
  539   1HG   LYS  71          2HG       LYS  71   9.034  -4.369  -4.369
  540   2HG   LYS  71          1HG       LYS  71   8.909  -5.045  -5.045
  541   1HD   LYS  71          2HD       LYS  71   9.381  -7.037  -7.037
  542   2HD   LYS  71          1HD       LYS  71  10.682  -5.859  -5.859
  543   1HE   LYS  71          2HE       LYS  71  10.915  -6.393  -6.393
  544   2HE   LYS  71          1HE       LYS  71   9.486  -7.424  -7.424
  545   1HZ   LYS  71          1HZ       LYS  71  10.711  -8.830  -8.830
  546   2HZ   LYS  71          3HZ       LYS  71  12.097  -7.910  -7.910
  547   3HZ   LYS  71          2HZ       LYS  71  11.386  -8.816  -8.816
  548    H    LEU  72           H        LEU  72   4.352  -5.331  -5.331
  549    HA   LEU  72           HA       LEU  72   5.124  -4.450  -4.450
  550   1HB   LEU  72          2HB       LEU  72   3.289  -6.148  -6.148
  551   2HB   LEU  72          1HB       LEU  72   2.249  -4.739  -4.739
  552    HG   LEU  72           HG       LEU  72   3.692  -5.937  -5.937
  553   1HD1  LEU  72          1HD1      LEU  72   1.387  -6.745  -6.745
  554   2HD1  LEU  72          3HD1      LEU  72   0.781  -5.343  -5.343
  555   3HD1  LEU  72          2HD1      LEU  72   1.647  -6.615  -6.615
  556   1HD2  LEU  72          2HD2      LEU  72   2.343  -3.274  -3.274
  557   2HD2  LEU  72          1HD2      LEU  72   3.919  -3.641  -3.641
  558   3HD2  LEU  72          3HD2      LEU  72   2.446  -4.080  -4.080
  559    H    VAL  73           H        VAL  73   2.387  -3.165  -3.165
  560    HA   VAL  73           HA       VAL  73   2.514  -0.677  -0.677
  561    HB   VAL  73           HB       VAL  73   0.358  -1.755  -1.755
  562   1HG1  VAL  73          2HG1      VAL  73   1.238  -2.331  -2.331
  563   2HG1  VAL  73          1HG1      VAL  73   0.842  -0.665  -0.665
  564   3HG1  VAL  73          3HG1      VAL  73  -0.426  -1.761  -1.761
  565   1HG2  VAL  73          3HG2      VAL  73   1.065   0.950   0.950
  566   2HG2  VAL  73          2HG2      VAL  73  -0.541   0.254   0.254
  567   3HG2  VAL  73          1HG2      VAL  73  -0.016   0.775   0.775
  568    H    LYS  74           H        LYS  74   3.221  -1.795  -1.795
  569    HA   LYS  74           HA       LYS  74   3.547   0.579   0.579
  570   1HB   LYS  74          2HB       LYS  74   3.783  -1.661  -1.661
  571   2HB   LYS  74          1HB       LYS  74   5.342  -1.842  -1.842
  572   1HG   LYS  74          2HG       LYS  74   6.376  -0.721  -0.721
  573   2HG   LYS  74          1HG       LYS  74   5.227   0.614   0.614
  574   1HD   LYS  74          2HD       LYS  74   4.071  -0.097  -0.097
  575   2HD   LYS  74          1HD       LYS  74   4.132  -1.783  -1.783
  576   1HE   LYS  74          2HE       LYS  74   6.547  -0.412  -0.412
  577   2HE   LYS  74          1HE       LYS  74   5.326  -1.129  -1.129
  578   1HZ   LYS  74          3HZ       LYS  74   6.349  -2.789  -2.789
  579   2HZ   LYS  74          2HZ       LYS  74   7.402  -2.482  -2.482
  580   3HZ   LYS  74          1HZ       LYS  74   5.908  -3.219  -3.219
  581    H    ALA  75           H        ALA  75   5.888  -1.039  -1.039
  582    HA   ALA  75           HA       ALA  75   8.012   0.764   0.764
  583   1HB   ALA  75          2HB       ALA  75   7.319  -1.288  -1.288
  584   2HB   ALA  75          1HB       ALA  75   8.530  -0.089  -0.089
  585   3HB   ALA  75          3HB       ALA  75   8.777  -1.101  -1.101
  586    H    PHE  76           H        PHE  76   5.178   0.852   0.852
  587    HA   PHE  76           HA       PHE  76   5.941   2.879   2.879
  588   1HB   PHE  76          2HB       PHE  76   3.804   1.330   1.330
  589   2HB   PHE  76          1HB       PHE  76   3.117   2.702   2.702
  590    HD1  PHE  76           HD2      PHE  76   4.451   1.522   1.522
  591    HD2  PHE  76           HD1      PHE  76   2.642   4.772   4.772
  592    HE1  PHE  76           HE2      PHE  76   3.979   2.627   2.627
  593    HE2  PHE  76           HE1      PHE  76   2.169   5.879   5.879
  594    HZ   PHE  76           HZ       PHE  76   2.837   4.804   4.804
  595    H    LYS  77           H        LYS  77   4.322   3.029   3.029
  596    HA   LYS  77           HA       LYS  77   4.068   5.858   5.858
  597   1HB   LYS  77          2HB       LYS  77   4.113   4.001   4.001
  598   2HB   LYS  77          1HB       LYS  77   3.369   5.592   5.592
  599   1HG   LYS  77          2HG       LYS  77   1.833   4.665   4.665
  600   2HG   LYS  77          1HG       LYS  77   2.492   3.071   3.071
  601   1HD   LYS  77          2HD       LYS  77   0.451   3.369   3.369
  602   2HD   LYS  77          1HD       LYS  77   1.809   3.389   3.389
  603   1HE   LYS  77          2HE       LYS  77   1.441   6.051   6.051
  604   2HE   LYS  77          1HE       LYS  77  -0.178   5.410   5.410
  605   1HZ   LYS  77          3HZ       LYS  77   2.002   5.030   5.030
  606   2HZ   LYS  77          2HZ       LYS  77   1.035   6.418   6.418
  607   3HZ   LYS  77          1HZ       LYS  77   0.332   4.898   4.898
  608    H    LYS  78           H        LYS  78   6.753   3.858   3.858
  609    HA   LYS  78           HA       LYS  78   8.180   5.823   5.823
  610   1HB   LYS  78          2HB       LYS  78   8.101   3.181   3.181
  611   2HB   LYS  78          1HB       LYS  78   9.437   3.238   3.238
  612   1HG   LYS  78          2HG       LYS  78  10.842   3.904   3.904
  613   2HG   LYS  78          1HG       LYS  78   9.779   5.235   5.235
  614   1HD   LYS  78          2HD       LYS  78   8.456   3.652   3.652
  615   2HD   LYS  78          1HD       LYS  78   9.607   2.378   2.378
  616   1HE   LYS  78          2HE       LYS  78  10.232   3.200   3.200
  617   2HE   LYS  78          1HE       LYS  78  11.405   3.840   3.840
  618   1HZ   LYS  78          1HZ       LYS  78   9.074   5.500   5.500
  619   2HZ   LYS  78          3HZ       LYS  78  10.189   5.343   5.343
  620   3HZ   LYS  78          2HZ       LYS  78  10.688   5.944   5.944
  621    H    LYS  79           H        LYS  79   7.891   4.575   4.575
  622    HA   LYS  79           HA       LYS  79  10.482   5.641   5.641
  623   1HB   LYS  79          2HB       LYS  79   9.608   3.385   3.385
  624   2HB   LYS  79          1HB       LYS  79   8.447   4.273   4.273
  625   1HG   LYS  79          2HG       LYS  79  11.159   5.222   5.222
  626   2HG   LYS  79          1HG       LYS  79  10.986   3.504   3.504
  627   1HD   LYS  79          2HD       LYS  79   9.582   3.878   3.878
  628   2HD   LYS  79          1HD       LYS  79   8.899   5.339   5.339
  629   1HE   LYS  79          2HE       LYS  79  11.750   5.355   5.355
  630   2HE   LYS  79          1HE       LYS  79  10.491   5.465   5.465
  631   1HZ   LYS  79          2HZ       LYS  79   9.624   7.284   7.284
  632   2HZ   LYS  79          1HZ       LYS  79  11.282   7.398   7.398
  633   3HZ   LYS  79          3HZ       LYS  79  10.701   7.649   7.649
  634    H    PHE  80           H        PHE  80   7.028   6.158   6.158
  635    HA   PHE  80           HA       PHE  80   7.688   8.622   8.622
  636   1HB   PHE  80          2HB       PHE  80   5.009   7.242   7.242
  637   2HB   PHE  80          1HB       PHE  80   5.617   8.461   8.461
  638    HD1  PHE  80           HD1      PHE  80   5.759   4.933   4.933
  639    HD2  PHE  80           HD2      PHE  80   7.069   7.873   7.873
  640    HE1  PHE  80           HE1      PHE  80   6.524   3.154   3.154
  641    HE2  PHE  80           HE2      PHE  80   7.839   6.098   6.098
  642    HZ   PHE  80           HZ       PHE  80   7.568   3.734   3.734
  643    H    ALA  81           H        ALA  81   6.193   7.341   7.341
  644    HA   ALA  81           HA       ALA  81   5.429   8.408   8.408
  645   1HB   ALA  81          2HB       ALA  81   7.056  10.262  10.262
  646   2HB   ALA  81          1HB       ALA  81   5.568  11.090  11.090
  647   3HB   ALA  81          3HB       ALA  81   5.844  10.645  10.645
  648    H    CYS  82           H        CYS  82   3.786   7.447   7.447
  649    HA   CYS  82           HA       CYS  82   1.493   9.280   9.280
  650   1HB   CYS  82          2HB       CYS  82   1.781   6.847   6.847
  651   2HB   CYS  82          1HB       CYS  82   0.637   8.174   8.174
  652    HG   CYS  82           HG       CYS  82   3.636   8.810   8.810
  653    H    ASN  83           H        ASN  83  -0.562   7.508   7.508
  654    HA   ASN  83           HA       ASN  83  -0.503   5.749   5.749
  655   1HB   ASN  83          2HB       ASN  83  -1.939   7.365   7.365
  656   2HB   ASN  83          1HB       ASN  83  -2.469   7.831   7.831
  657   1HD2  ASN  83          2HD2      ASN  83  -4.997   5.361   5.361
  658   2HD2  ASN  83          1HD2      ASN  83  -3.830   6.213   6.213
  659    H    GLY  84           H        GLY  84  -0.741   3.684   3.684
  660   1HA   GLY  84          2HA       GLY  84  -2.373   3.086   3.086
  661   2HA   GLY  84          1HA       GLY  84  -0.860   2.257   2.257
  662    H    THR  85           H        THR  85  -3.774   1.431   1.431
  663    HA   THR  85           HA       THR  85  -3.874  -0.106  -0.106
  664    HB   THR  85           HB       THR  85  -6.253   0.005   0.005
  665    HG1  THR  85           HG1      THR  85  -7.437   0.582   0.582
  666   1HG2  THR  85          2HG2      THR  85  -5.232   2.731   2.731
  667   2HG2  THR  85          1HG2      THR  85  -6.776   2.390   2.390
  668   3HG2  THR  85          3HG2      THR  85  -5.266   2.036   2.036
  669    H    VAL  86           H        VAL  86  -5.506  -2.042  -2.042
  670    HA   VAL  86           HA       VAL  86  -4.832  -3.353  -3.353
  671    HB   VAL  86           HB       VAL  86  -3.484  -4.256  -4.256
  672   1HG1  VAL  86          1HG1      VAL  86  -5.622  -3.843  -3.843
  673   2HG1  VAL  86          3HG1      VAL  86  -5.746  -5.581  -5.581
  674   3HG1  VAL  86          2HG1      VAL  86  -4.270  -4.898  -4.898
  675   1HG2  VAL  86          3HG2      VAL  86  -5.548  -5.985  -5.985
  676   2HG2  VAL  86          2HG2      VAL  86  -3.827  -5.842  -5.842
  677   3HG2  VAL  86          1HG2      VAL  86  -4.362  -6.685  -6.685
  678    H    ILE  87           H        ILE  87  -6.921  -2.713  -2.713
  679    HA   ILE  87           HA       ILE  87  -9.271  -3.749  -3.749
  680    HB   ILE  87           HB       ILE  87 -10.578  -2.633  -2.633
  681   1HG1  ILE  87          2HG1      ILE  87  -8.533  -1.150  -1.150
  682   2HG1  ILE  87          1HG1      ILE  87  -8.199  -2.870  -2.870
  683   1HG2  ILE  87          2HG2      ILE  87  -9.832  -1.327  -1.327
  684   2HG2  ILE  87          1HG2      ILE  87  -8.362  -0.879  -0.879
  685   3HG2  ILE  87          3HG2      ILE  87  -9.933  -0.325  -0.325
  686   1HD1  ILE  87          1HD1      ILE  87 -10.616  -3.109  -3.109
  687   2HD1  ILE  87          3HD1      ILE  87 -10.632  -1.351  -1.351
  688   3HD1  ILE  87          2HD1      ILE  87  -9.516  -2.301  -2.301
  689    H    GLU  88           H        GLU  88 -10.807  -5.135  -5.135
  690    HA   GLU  88           HA       GLU  88  -9.572  -7.008  -7.008
  691   1HB   GLU  88          2HB       GLU  88 -10.527  -7.680  -7.680
  692   2HB   GLU  88          1HB       GLU  88 -12.074  -7.633  -7.633
  693   1HG   GLU  88          2HG       GLU  88 -11.031  -9.189  -9.189
  694   2HG   GLU  88          1HG       GLU  88  -9.714  -9.397  -9.397
  695    H    HIS  89           H        HIS  89 -10.110  -5.413  -5.413
  696    HA   HIS  89           HA       HIS  89 -12.674  -4.598  -4.598
  697   1HB   HIS  89          2HB       HIS  89 -10.262  -4.092  -4.092
  698   2HB   HIS  89          1HB       HIS  89 -10.801  -5.269  -5.269
  699    HD1  HIS  89           HD1      HIS  89 -12.339  -4.446  -4.446
  700    HD2  HIS  89           HD2      HIS  89 -12.009  -1.774  -1.774
  701    HE1  HIS  89           HE1      HIS  89 -13.569  -2.383  -2.383
  702    HE2  HIS  89           HE2      HIS  89 -13.268  -0.740  -0.740
  703    HA   PRO  90           HA       PRO  90 -14.532  -8.341  -8.341
  704   1HB   PRO  90          2HB       PRO  90 -16.755  -7.331  -7.331
  705   2HB   PRO  90          1HB       PRO  90 -16.482  -7.270  -7.270
  706   1HG   PRO  90          2HG       PRO  90 -16.143  -5.116  -5.116
  707   2HG   PRO  90          1HG       PRO  90 -16.821  -5.013  -5.013
  708   1HD   PRO  90          2HD       PRO  90 -14.240  -4.299  -4.299
  709   2HD   PRO  90          1HD       PRO  90 -14.767  -4.741  -4.741
  710    H    GLU  91           H        GLU  91 -13.893  -5.645  -5.645
  711    HA   GLU  91           HA       GLU  91 -14.386  -7.158  -7.158
  712   1HB   GLU  91          2HB       GLU  91 -12.930  -4.528  -4.528
  713   2HB   GLU  91          1HB       GLU  91 -13.787  -5.189  -5.189
  714   1HG   GLU  91          2HG       GLU  91 -15.867  -5.072  -5.072
  715   2HG   GLU  91          1HG       GLU  91 -14.895  -3.976  -3.976
  716    H    TYR  92           H        TYR  92 -11.719  -6.622  -6.622
  717    HA   TYR  92           HA       TYR  92  -9.917  -7.873  -7.873
  718   1HB   TYR  92          2HB       TYR  92  -8.907  -6.224  -6.224
  719   2HB   TYR  92          1HB       TYR  92  -8.122  -6.590  -6.590
  720    HD1  TYR  92           HD2      TYR  92 -10.331  -5.870  -5.870
  721    HD2  TYR  92           HD1      TYR  92  -8.857  -3.874  -3.874
  722    HE1  TYR  92           HE2      TYR  92 -11.117  -3.727  -3.727
  723    HE2  TYR  92           HE1      TYR  92  -9.639  -1.724  -1.724
  724    HH   TYR  92           HH       TYR  92 -11.303  -0.895  -0.895
  725    H    GLY  93           H        GLY  93 -10.607  -7.571  -7.571
  726   1HA   GLY  93          2HA       GLY  93 -10.781  -9.379  -9.379
  727   2HA   GLY  93          1HA       GLY  93  -9.987 -10.406 -10.406
  728    H    GLU  94           H        GLU  94  -9.609  -8.541  -8.541
  729    HA   GLU  94           HA       GLU  94  -7.849  -8.099  -8.099
  730   1HB   GLU  94          2HB       GLU  94  -7.645 -10.658 -10.658
  731   2HB   GLU  94          1HB       GLU  94  -6.232 -10.179 -10.179
  732   1HG   GLU  94          2HG       GLU  94  -5.000  -9.812  -9.812
  733   2HG   GLU  94          1HG       GLU  94  -6.326  -9.025  -9.025
  734    H    VAL  95           H        VAL  95  -7.306  -6.048  -6.048
  735    HA   VAL  95           HA       VAL  95  -4.821  -5.883  -5.883
  736    HB   VAL  95           HB       VAL  95  -5.684  -3.987  -3.987
  737   1HG1  VAL  95          1HG1      VAL  95  -5.733  -6.536  -6.536
  738   2HG1  VAL  95          3HG1      VAL  95  -7.479  -6.286  -6.286
  739   3HG1  VAL  95          2HG1      VAL  95  -6.467  -5.327  -5.327
  740   1HG2  VAL  95          2HG2      VAL  95  -8.282  -4.775  -4.775
  741   2HG2  VAL  95          1HG2      VAL  95  -7.513  -3.188  -3.188
  742   3HG2  VAL  95          3HG2      VAL  95  -8.211  -3.868  -3.868
  743    H    ILE  96           H        ILE  96  -3.535  -4.135  -4.135
  744    HA   ILE  96           HA       ILE  96  -4.087  -2.928  -2.928
  745    HB   ILE  96           HB       ILE  96  -1.819  -2.784  -2.784
  746   1HG1  ILE  96          2HG1      ILE  96  -2.385  -4.393  -4.393
  747   2HG1  ILE  96          1HG1      ILE  96  -0.769  -4.112  -4.112
  748   1HG2  ILE  96          3HG2      ILE  96  -2.177  -0.920  -0.920
  749   2HG2  ILE  96          2HG2      ILE  96  -0.662  -1.163  -1.163
  750   3HG2  ILE  96          1HG2      ILE  96  -2.057  -0.474  -0.474
  751   1HD1  ILE  96          1HD1      ILE  96  -1.889  -2.326  -2.326
  752   2HD1  ILE  96          3HD1      ILE  96  -1.197  -3.895  -3.895
  753   3HD1  ILE  96          2HD1      ILE  96  -0.206  -2.681  -2.681
  754    H    GLN  97           H        GLN  97  -4.123  -0.598  -0.598
  755    HA   GLN  97           HA       GLN  97  -5.099   0.951   0.951
  756   1HB   GLN  97          2HB       GLN  97  -6.732  -0.030  -0.030
  757   2HB   GLN  97          1HB       GLN  97  -6.490   1.667   1.667
  758   1HG   GLN  97          2HG       GLN  97  -7.102   2.066   2.066
  759   2HG   GLN  97          1HG       GLN  97  -7.789   0.445   0.445
  760   1HE2  GLN  97          2HE2      GLN  97 -10.750   1.670   1.670
  761   2HE2  GLN  97          1HE2      GLN  97  -9.896   0.578   0.578
  762    H    LEU  98           H        LEU  98  -3.338   2.273   2.273
  763    HA   LEU  98           HA       LEU  98  -2.271   3.584   3.584
  764   1HB   LEU  98          2HB       LEU  98  -1.518   4.143   4.143
  765   2HB   LEU  98          1HB       LEU  98  -0.583   4.460   4.460
  766    HG   LEU  98           HG       LEU  98  -1.277   1.632   1.632
  767   1HD1  LEU  98          1HD1      LEU  98  -0.255   3.092   3.092
  768   2HD1  LEU  98          3HD1      LEU  98   1.229   2.643   2.643
  769   3HD1  LEU  98          2HD1      LEU  98   0.127   1.391   1.391
  770   1HD2  LEU  98          1HD2      LEU  98   0.072   2.733   2.733
  771   2HD2  LEU  98          3HD2      LEU  98   0.449   1.135   1.135
  772   3HD2  LEU  98          2HD2      LEU  98   1.401   2.533   2.533
  773    H    GLN  99           H        GLN  99  -2.116   5.900   5.900
  774    HA   GLN  99           HA       GLN  99  -4.560   7.186   7.186
  775   1HB   GLN  99          2HB       GLN  99  -2.849   7.440   7.440
  776   2HB   GLN  99          1HB       GLN  99  -3.121   9.008   9.008
  777   1HG   GLN  99          2HG       GLN  99  -5.376   7.138   7.138
  778   2HG   GLN  99          1HG       GLN  99  -4.733   8.271   8.271
  779   1HE2  GLN  99          2HE2      GLN  99  -7.382  10.243  10.243
  780   2HE2  GLN  99          1HE2      GLN  99  -6.964   9.073   9.073
  781    H    GLY 100           H        GLY 100  -4.640   9.045   9.045
  782   1HA   GLY 100          2HA       GLY 100  -3.890  10.750  10.750
  783   2HA   GLY 100          1HA       GLY 100  -2.256  10.434  10.434
  784    H    ASP 101           H        ASP 101  -2.337  11.019  11.019
  785    HA   ASP 101           HA       ASP 101  -2.788   8.714   8.714
  786   1HB   ASP 101          2HB       ASP 101  -1.760  10.183  10.183
  787   2HB   ASP 101          1HB       ASP 101  -3.206  10.834  10.834
  788    H    GLN 102           H        GLN 102  -1.399   7.191   7.191
  789    HA   GLN 102           HA       GLN 102   1.471   7.692   7.692
  790   1HB   GLN 102          2HB       GLN 102  -0.284   5.853   5.853
  791   2HB   GLN 102          1HB       GLN 102   1.259   5.180   5.180
  792   1HG   GLN 102          2HG       GLN 102   1.106   6.263   6.263
  793   2HG   GLN 102          1HG       GLN 102   2.476   6.687   6.687
  794   1HE2  GLN 102          2HE2      GLN 102  -0.486   9.497   9.497
  795   2HE2  GLN 102          1HE2      GLN 102  -0.860   7.833   7.833
  796    H    ARG 103           H        ARG 103  -0.604   6.942   6.942
  797    HA   ARG 103           HA       ARG 103  -0.118   4.472   4.472
  798   1HB   ARG 103          2HB       ARG 103  -0.502   5.527   5.527
  799   2HB   ARG 103          1HB       ARG 103  -1.706   5.957   5.957
  800   1HG   ARG 103          2HG       ARG 103  -0.573   8.098   8.098
  801   2HG   ARG 103          1HG       ARG 103   0.617   7.665   7.665
  802   1HD   ARG 103          2HD       ARG 103  -2.352   7.958   7.958
  803   2HD   ARG 103          1HD       ARG 103  -1.125   9.141   9.141
  804    HE   ARG 103           HE       ARG 103  -1.779   6.701   6.701
  805   1HH1  ARG 103          2HH1      ARG 103   0.663   9.142   9.142
  806   2HH1  ARG 103          1HH1      ARG 103   1.468   8.834   8.834
  807   1HH2  ARG 103          1HH2      ARG 103  -0.719   6.295   6.295
  808   2HH2  ARG 103          2HH2      ARG 103   0.684   7.218   7.218
  809    H    LYS 104           H        LYS 104   2.039   7.198   7.198
  810    HA   LYS 104           HA       LYS 104   3.981   5.836   5.836
  811   1HB   LYS 104          2HB       LYS 104   3.448   8.231   8.231
  812   2HB   LYS 104          1HB       LYS 104   4.094   8.627   8.627
  813   1HG   LYS 104          2HG       LYS 104   5.966   7.075   7.075
  814   2HG   LYS 104          1HG       LYS 104   5.487   8.567   8.567
  815   1HD   LYS 104          2HD       LYS 104   6.566   8.349   8.349
  816   2HD   LYS 104          1HD       LYS 104   7.466   8.907   8.907
  817   1HE   LYS 104          2HE       LYS 104   5.385  10.565  10.565
  818   2HE   LYS 104          1HE       LYS 104   5.356  10.268  10.268
  819   1HZ   LYS 104          1HZ       LYS 104   7.952  10.743  10.743
  820   2HZ   LYS 104          3HZ       LYS 104   7.276  11.740  11.740
  821   3HZ   LYS 104          2HZ       LYS 104   6.835  11.937  11.937
  822    H    ASN 105           H        ASN 105   3.314   6.550   6.550
  823    HA   ASN 105           HA       ASN 105   6.068   6.118   6.118
  824   1HB   ASN 105          2HB       ASN 105   3.543   6.989   6.989
  825   2HB   ASN 105          1HB       ASN 105   4.771   6.222   6.222
  826   1HD2  ASN 105          2HD2      ASN 105   5.100  10.049  10.049
  827   2HD2  ASN 105          1HD2      ASN 105   3.671   9.096   9.096
  828    H    ILE 106           H        ILE 106   2.962   4.436   4.436
  829    HA   ILE 106           HA       ILE 106   3.756   2.315   2.315
  830    HB   ILE 106           HB       ILE 106   1.396   2.823   2.823
  831   1HG1  ILE 106          2HG1      ILE 106   0.638   0.552   0.552
  832   2HG1  ILE 106          1HG1      ILE 106   2.109  -0.010  -0.010
  833   1HG2  ILE 106          1HG2      ILE 106   1.837   3.166   3.166
  834   2HG2  ILE 106          3HG2      ILE 106   1.843   1.410   1.410
  835   3HG2  ILE 106          2HG2      ILE 106   0.391   2.241   2.241
  836   1HD1  ILE 106          1HD1      ILE 106   2.550   1.377   1.377
  837   2HD1  ILE 106          3HD1      ILE 106   1.622  -0.117  -0.117
  838   3HD1  ILE 106          2HD1      ILE 106   3.226  -0.135  -0.135
  839    H    CYS 107           H        CYS 107   3.618   2.500   2.500
  840    HA   CYS 107           HA       CYS 107   4.698  -0.044  -0.044
  841   1HB   CYS 107          2HB       CYS 107   5.410   0.940   0.940
  842   2HB   CYS 107          1HB       CYS 107   3.710   1.190   1.190
  843    HG   CYS 107           HG       CYS 107   4.227   3.677   3.677
  844    H    GLN 108           H        GLN 108   6.086   3.012   3.012
  845    HA   GLN 108           HA       GLN 108   8.816   2.363   2.363
  846   1HB   GLN 108          2HB       GLN 108   8.386   4.654   4.654
  847   2HB   GLN 108          1HB       GLN 108   7.336   4.521   4.521
  848   1HG   GLN 108          2HG       GLN 108   9.123   5.514   5.514
  849   2HG   GLN 108          1HG       GLN 108   9.589   3.831   3.831
  850   1HE2  GLN 108          2HE2      GLN 108  12.451   4.039   4.039
  851   2HE2  GLN 108          1HE2      GLN 108  11.420   3.105   3.105
  852    H    PHE 109           H        PHE 109   6.614   2.116   2.116
  853    HA   PHE 109           HA       PHE 109   8.544   1.360   1.360
  854   1HB   PHE 109          2HB       PHE 109   6.325   2.262   2.262
  855   2HB   PHE 109          1HB       PHE 109   5.560   0.837   0.837
  856    HD1  PHE 109           HD2      PHE 109   8.114   1.756   1.756
  857    HD2  PHE 109           HD1      PHE 109   4.987  -0.889  -0.889
  858    HE1  PHE 109           HE2      PHE 109   8.269   0.623   0.623
  859    HE2  PHE 109           HE1      PHE 109   5.137  -2.027  -2.027
  860    HZ   PHE 109           HZ       PHE 109   6.780  -1.269  -1.269
  861    H    LEU 110           H        LEU 110   6.259  -0.455  -0.455
  862    HA   LEU 110           HA       LEU 110   6.758  -3.022  -3.022
  863   1HB   LEU 110          2HB       LEU 110   5.871  -1.847  -1.847
  864   2HB   LEU 110          1HB       LEU 110   6.330  -3.538  -3.538
  865    HG   LEU 110           HG       LEU 110   4.591  -4.113  -4.113
  866   1HD1  LEU 110          2HD1      LEU 110   4.903  -2.159  -2.159
  867   2HD1  LEU 110          1HD1      LEU 110   3.981  -1.186  -1.186
  868   3HD1  LEU 110          3HD1      LEU 110   3.214  -2.547  -2.547
  869   1HD2  LEU 110          1HD2      LEU 110   4.077  -3.149  -3.149
  870   2HD2  LEU 110          3HD2      LEU 110   2.857  -3.871  -3.871
  871   3HD2  LEU 110          2HD2      LEU 110   3.027  -2.117  -2.117
  872    H    VAL 111           H        VAL 111   8.659  -1.005  -1.005
  873    HA   VAL 111           HA       VAL 111  10.521  -3.190  -3.190
  874    HB   VAL 111           HB       VAL 111  10.357  -0.347  -0.347
  875   1HG1  VAL 111          3HG1      VAL 111  12.504  -2.395  -2.395
  876   2HG1  VAL 111          2HG1      VAL 111  12.291  -0.896  -0.896
  877   3HG1  VAL 111          1HG1      VAL 111  12.704  -0.842  -0.842
  878   1HG2  VAL 111          2HG2      VAL 111   8.884  -2.293  -2.293
  879   2HG2  VAL 111          1HG2      VAL 111   9.693  -1.242  -1.242
  880   3HG2  VAL 111          3HG2      VAL 111  10.362  -2.831  -2.831
  881    H    GLU 112           H        GLU 112  10.281  -0.145  -0.145
  882    HA   GLU 112           HA       GLU 112  12.951   0.160   0.160
  883   1HB   GLU 112          2HB       GLU 112  11.533   2.026   2.026
  884   2HB   GLU 112          1HB       GLU 112  10.327   1.119   1.119
  885   1HG   GLU 112          2HG       GLU 112  11.252   1.610   1.610
  886   2HG   GLU 112          1HG       GLU 112  12.862   1.163   1.163
  887    H    ILE 113           H        ILE 113  10.413  -1.903  -1.903
  888    HA   ILE 113           HA       ILE 113  12.109  -2.669  -2.669
  889    HB   ILE 113           HB       ILE 113  10.200  -3.426  -3.426
  890   1HG1  ILE 113          2HG1      ILE 113   8.679  -3.105  -3.105
  891   2HG1  ILE 113          1HG1      ILE 113   9.056  -4.617  -4.617
  892   1HG2  ILE 113          3HG2      ILE 113  10.463  -0.806  -0.806
  893   2HG2  ILE 113          2HG2      ILE 113   8.763  -1.148  -1.148
  894   3HG2  ILE 113          1HG2      ILE 113   9.422  -1.397  -1.397
  895   1HD1  ILE 113          3HD1      ILE 113   7.653  -2.945  -2.945
  896   2HD1  ILE 113          2HD1      ILE 113   6.775  -2.983  -2.983
  897   3HD1  ILE 113          1HD1      ILE 113   7.160  -4.489  -4.489
  898    H    GLY 114           H        GLY 114  10.557  -3.813  -3.813
  899   1HA   GLY 114          2HA       GLY 114  11.410  -5.715  -5.715
  900   2HA   GLY 114          1HA       GLY 114  11.901  -6.402  -6.402
  901    H    LEU 115           H        LEU 115   8.784  -4.944  -4.944
  902    HA   LEU 115           HA       LEU 115   7.474  -7.382  -7.382
  903   1HB   LEU 115          2HB       LEU 115   6.916  -4.694  -4.694
  904   2HB   LEU 115          1HB       LEU 115   5.765  -5.213  -5.213
  905    HG   LEU 115           HG       LEU 115   4.762  -6.779  -6.779
  906   1HD1  LEU 115          2HD1      LEU 115   7.242  -6.370  -6.370
  907   2HD1  LEU 115          1HD1      LEU 115   5.751  -6.718  -6.718
  908   3HD1  LEU 115          3HD1      LEU 115   6.347  -7.849  -7.849
  909   1HD2  LEU 115          1HD2      LEU 115   4.583  -4.128  -4.128
  910   2HD2  LEU 115          3HD2      LEU 115   3.667  -5.293  -5.293
  911   3HD2  LEU 115          2HD2      LEU 115   5.152  -4.595  -4.595
  912    H    ALA 116           H        ALA 116   6.661  -5.188  -5.188
  913    HA   ALA 116           HA       ALA 116   5.828  -7.506  -7.506
  914   1HB   ALA 116          2HB       ALA 116   4.409  -5.387  -5.387
  915   2HB   ALA 116          1HB       ALA 116   5.499  -4.647  -4.647
  916   3HB   ALA 116          3HB       ALA 116   4.542  -6.057  -6.057
  917    H    LYS 117           H        LYS 117   6.361  -7.419  -7.419
  918    HA   LYS 117           HA       LYS 117   9.201  -6.745  -6.745
  919   1HB   LYS 117          2HB       LYS 117   7.649  -8.997  -8.997
  920   2HB   LYS 117          1HB       LYS 117   8.205  -8.221  -8.221
  921   1HG   LYS 117          2HG       LYS 117   9.737  -9.966  -9.966
  922   2HG   LYS 117          1HG       LYS 117  10.496  -8.374  -8.374
  923   1HD   LYS 117          2HD       LYS 117   9.371  -8.633  -8.633
  924   2HD   LYS 117          1HD       LYS 117  10.186 -10.160 -10.160
  925   1HE   LYS 117          2HE       LYS 117  12.107  -8.563  -8.563
  926   2HE   LYS 117          1HE       LYS 117  11.311  -7.411  -7.411
  927   1HZ   LYS 117          1HZ       LYS 117  11.829 -10.067 -10.067
  928   2HZ   LYS 117          3HZ       LYS 117  13.180  -9.079  -9.079
  929   3HZ   LYS 117          2HZ       LYS 117  11.925  -8.554  -8.554
  930    H    ASP 118           H        ASP 118   9.961  -5.697  -5.697
  931    HA   ASP 118           HA       ASP 118   8.464  -3.481  -3.481
  932   1HB   ASP 118          2HB       ASP 118  10.174  -3.079  -3.079
  933   2HB   ASP 118          1HB       ASP 118  10.927  -3.619  -3.619
  934    H    ASP 119           H        ASP 119   8.538  -6.710  -6.710
  935    HA   ASP 119           HA       ASP 119   7.234  -6.056  -6.056
  936   1HB   ASP 119          2HB       ASP 119   8.005  -8.612  -8.612
  937   2HB   ASP 119          1HB       ASP 119   6.919  -8.643  -8.643
  938    H    GLN 120           H        GLN 120   6.309  -6.879  -6.879
  939    HA   GLN 120           HA       GLN 120   3.585  -7.536  -7.536
  940   1HB   GLN 120          2HB       GLN 120   4.667  -7.033  -7.033
  941   2HB   GLN 120          1HB       GLN 120   3.235  -7.948  -7.948
  942   1HG   GLN 120          2HG       GLN 120   4.759  -9.569  -9.569
  943   2HG   GLN 120          1HG       GLN 120   6.106  -8.715  -8.715
  944   1HE2  GLN 120          2HE2      GLN 120   4.491  -9.655  -9.655
  945   2HE2  GLN 120          1HE2      GLN 120   4.542  -8.165  -8.165
  946    H    LEU 121           H        LEU 121   5.378  -4.744  -4.744
  947    HA   LEU 121           HA       LEU 121   3.715  -3.055  -3.055
  948   1HB   LEU 121          2HB       LEU 121   5.610  -2.549  -2.549
  949   2HB   LEU 121          1HB       LEU 121   4.721  -1.238  -1.238
  950    HG   LEU 121           HG       LEU 121   6.586  -3.092  -3.092
  951   1HD1  LEU 121          1HD1      LEU 121   7.027  -0.323  -0.323
  952   2HD1  LEU 121          3HD1      LEU 121   8.085  -1.106  -1.106
  953   3HD1  LEU 121          2HD1      LEU 121   7.890  -1.799  -1.799
  954   1HD2  LEU 121          2HD2      LEU 121   4.806  -0.857  -0.857
  955   2HD2  LEU 121          1HD2      LEU 121   5.291  -2.289  -2.289
  956   3HD2  LEU 121          3HD2      LEU 121   6.396  -0.922  -0.922
  957    H    LYS 122           H        LYS 122   1.605  -2.748  -2.748
  958    HA   LYS 122           HA       LYS 122   0.701  -2.058  -2.058
  959   1HB   LYS 122          2HB       LYS 122  -0.555  -4.017  -4.017
  960   2HB   LYS 122          1HB       LYS 122  -1.484  -3.219  -3.219
  961   1HG   LYS 122          2HG       LYS 122   0.986  -4.853  -4.853
  962   2HG   LYS 122          1HG       LYS 122  -0.665  -5.429  -5.429
  963   1HD   LYS 122          2HD       LYS 122   0.523  -3.079  -3.079
  964   2HD   LYS 122          1HD       LYS 122   0.530  -4.721  -4.721
  965   1HE   LYS 122          2HE       LYS 122  -1.670  -2.774  -2.774
  966   2HE   LYS 122          1HE       LYS 122  -1.361  -4.014  -4.014
  967   1HZ   LYS 122          1HZ       LYS 122  -2.392  -4.597  -4.597
  968   2HZ   LYS 122          3HZ       LYS 122  -3.374  -4.399  -4.399
  969   3HZ   LYS 122          2HZ       LYS 122  -2.266  -5.672  -5.672
  970    H    VAL 123           H        VAL 123   0.927   0.133   0.133
  971    HA   VAL 123           HA       VAL 123  -0.806   0.976   0.976
  972    HB   VAL 123           HB       VAL 123   1.416   1.981   1.981
  973   1HG1  VAL 123          1HG1      VAL 123   0.984   1.978   1.978
  974   2HG1  VAL 123          3HG1      VAL 123   0.731   3.678   3.678
  975   3HG1  VAL 123          2HG1      VAL 123   2.253   2.894   2.894
  976   1HG2  VAL 123          1HG2      VAL 123  -0.755   3.228   3.228
  977   2HG2  VAL 123          3HG2      VAL 123   0.773   4.093   4.093
  978   3HG2  VAL 123          2HG2      VAL 123  -0.446   4.218   4.218
  979    H    HIS 124           H        HIS 124  -2.853   1.577   1.577
  980    HA   HIS 124           HA       HIS 124  -3.661   2.651   2.651
  981   1HB   HIS 124          2HB       HIS 124  -5.379   0.972   0.972
  982   2HB   HIS 124          1HB       HIS 124  -5.818   1.573   1.573
  983    HD1  HIS 124           HD1      HIS 124  -5.160   0.171   0.171
  984    HD2  HIS 124           HD2      HIS 124  -3.386  -1.099  -1.099
  985    HE1  HIS 124           HE1      HIS 124  -4.059  -2.021  -2.021
  986    HE2  HIS 124           HE2      HIS 124  -3.166  -2.852  -2.852
  987    H    GLY 125           H        GLY 125  -3.115   4.727   4.727
  988   1HA   GLY 125          2HA       GLY 125  -4.440   5.719   5.719
  989   2HA   GLY 125          1HA       GLY 125  -3.783   6.704   6.704
  990    H    PHE 126           HN       PHE 126  -6.515   6.079   6.079
  991    HA   PHE 126           HA       PHE 126  -8.599   5.731   5.731
  992   1HB   PHE 126          2HB       PHE 126  -9.999   6.769   6.769
  993   2HB   PHE 126          1HB       PHE 126  -8.664   6.094   6.094
  994    HD1  PHE 126           HD1      PHE 126  -6.556   7.998   7.998
  995    HD2  PHE 126           HD2      PHE 126 -10.747   8.687   8.687
  996    HE1  PHE 126           HE1      PHE 126  -6.129  10.210  10.210
  997    HE2  PHE 126           HE2      PHE 126 -10.328  10.902  10.902
  998    HZ   PHE 126           HZ       PHE 126  -8.015  11.665  11.665

  Start of MODEL   26
    1   1H    MET   1          2H        MET   1  14.991  11.366  11.366
    2   2H    MET   1          1H        MET   1  13.399  11.030  11.030
    3   3H    MET   1          3H        MET   1  14.634   9.855   9.855
    4    HA   MET   1           HA       MET   1  14.809   9.601   9.601
    5   1HB   MET   1          2HB       MET   1  13.132   8.340   8.340
    6   2HB   MET   1          1HB       MET   1  11.917   9.503   9.503
    7   1HG   MET   1          2HG       MET   1  12.186   8.833   8.833
    8   2HG   MET   1          1HG       MET   1  13.506   7.751   7.751
    9   1HE   MET   1          1HE       MET   1  12.132   6.044   6.044
   10   2HE   MET   1          3HE       MET   1  10.596   5.318   5.318
   11   3HE   MET   1          2HE       MET   1  10.638   6.969   6.969
   12    H    ARG   2           H        ARG   2  15.144  12.183  12.183
   13    HA   ARG   2           HA       ARG   2  12.944  13.126  13.126
   14   1HB   ARG   2          2HB       ARG   2  14.738  14.535  14.535
   15   2HB   ARG   2          1HB       ARG   2  14.282  15.396  15.396
   16   1HG   ARG   2          2HG       ARG   2  11.875  14.453  14.453
   17   2HG   ARG   2          1HG       ARG   2  12.694  14.720  14.720
   18   1HD   ARG   2          2HD       ARG   2  13.330  16.987  16.987
   19   2HD   ARG   2          1HD       ARG   2  11.699  16.648  16.648
   20    HE   ARG   2           HE       ARG   2  11.459  16.413  16.413
   21   1HH1  ARG   2          2HH1      ARG   2  12.764  18.905  18.905
   22   2HH1  ARG   2          1HH1      ARG   2  12.367  20.192  20.192
   23   1HH2  ARG   2          1HH2      ARG   2  10.936  18.105  18.105
   24   2HH2  ARG   2          2HH2      ARG   2  11.330  19.737  19.737
   25    H    GLY   3           H        GLY   3  15.112  11.348  11.348
   26   1HA   GLY   3          2HA       GLY   3  15.795  12.488  12.488
   27   2HA   GLY   3          1HA       GLY   3  17.152  12.728  12.728
   28    H    SER   4           H        SER   4  18.459  11.391  11.391
   29    HA   SER   4           HA       SER   4  17.835   8.767   8.767
   30   1HB   SER   4          2HB       SER   4  20.121   8.524   8.524
   31   2HB   SER   4          1HB       SER   4  19.769  10.235  10.235
   32    HG   SER   4           HG       SER   4  20.614  10.528  10.528
   33    H    HIS   5           H        HIS   5  17.632   6.958   6.958
   34    HA   HIS   5           HA       HIS   5  19.269   6.417   6.417
   35   1HB   HIS   5          2HB       HIS   5  17.187   7.843   7.843
   36   2HB   HIS   5          1HB       HIS   5  16.322   6.321   6.321
   37    HD1  HIS   5           HD1      HIS   5  16.671   7.747   7.747
   38    HD2  HIS   5           HD2      HIS   5  19.086   4.675   4.675
   39    HE1  HIS   5           HE1      HIS   5  17.685   6.692   6.692
   40    HE2  HIS   5           HE2      HIS   5  19.074   4.782   4.782
   41    H    HIS   6           H        HIS   6  19.718   4.315   4.315
   42    HA   HIS   6           HA       HIS   6  18.743   2.518   2.518
   43   1HB   HIS   6          2HB       HIS   6  20.692   2.498   2.498
   44   2HB   HIS   6          1HB       HIS   6  19.652   1.113   1.113
   45    HD1  HIS   6           HD1      HIS   6  21.263  -0.687  -0.687
   46    HD2  HIS   6           HD2      HIS   6  20.623   2.225   2.225
   47    HE1  HIS   6           HE1      HIS   6  22.335  -1.574  -1.574
   48    HE2  HIS   6           HE2      HIS   6  22.005   0.241   0.241
   49    H    HIS   7           H        HIS   7  17.001   1.249   1.249
   50    HA   HIS   7           HA       HIS   7  15.028   1.392   1.392
   51   1HB   HIS   7          2HB       HIS   7  14.942   0.076   0.076
   52   2HB   HIS   7          1HB       HIS   7  13.581   0.169   0.169
   53    HD1  HIS   7           HD1      HIS   7  14.516   1.672   1.672
   54    HD2  HIS   7           HD2      HIS   7  13.443   3.241   3.241
   55    HE1  HIS   7           HE1      HIS   7  13.774   4.031   4.031
   56    HE2  HIS   7           HE2      HIS   7  13.210   4.987   4.987
   57    H    HIS   8           H        HIS   8  14.348  -0.261  -0.261
   58    HA   HIS   8           HA       HIS   8  14.435  -2.210  -2.210
   59   1HB   HIS   8          2HB       HIS   8  14.574  -2.952  -2.952
   60   2HB   HIS   8          1HB       HIS   8  15.430  -4.116  -4.116
   61    HD1  HIS   8           HD1      HIS   8  12.245  -2.285  -2.285
   62    HD2  HIS   8           HD2      HIS   8  13.581  -6.125  -6.125
   63    HE1  HIS   8           HE1      HIS   8  10.301  -3.799  -3.799
   64    HE2  HIS   8           HE2      HIS   8  11.160  -6.126  -6.126
   65    H    HIS   9           H        HIS   9  15.956  -4.082  -4.082
   66    HA   HIS   9           HA       HIS   9  17.935  -4.722  -4.722
   67   1HB   HIS   9          2HB       HIS   9  19.268  -3.204  -3.204
   68   2HB   HIS   9          1HB       HIS   9  19.901  -4.584  -4.584
   69    HD1  HIS   9           HD1      HIS   9  18.724  -3.911  -3.911
   70    HD2  HIS   9           HD2      HIS   9  17.778  -6.853  -6.853
   71    HE1  HIS   9           HE1      HIS   9  17.695  -5.783  -5.783
   72    HE2  HIS   9           HE2      HIS   9  17.205  -7.585  -7.585
   73    H    HIS  10           H        HIS  10  17.120  -2.993  -2.993
   74    HA   HIS  10           HA       HIS  10  19.067  -0.797  -0.797
   75   1HB   HIS  10          2HB       HIS  10  17.384   0.113   0.113
   76   2HB   HIS  10          1HB       HIS  10  16.898   0.130   0.130
   77    HD1  HIS  10           HD1      HIS  10  14.629  -0.749  -0.749
   78    HD2  HIS  10           HD2      HIS  10  16.288  -2.334  -2.334
   79    HE1  HIS  10           HE1      HIS  10  12.834  -2.196  -2.196
   80    HE2  HIS  10           HE2      HIS  10  13.891  -3.214  -3.214
   81    H    THR  11           H        THR  11  17.685  -3.547  -3.547
   82    HA   THR  11           HA       THR  11  18.895  -3.078  -3.078
   83    HB   THR  11           HB       THR  11  18.580  -5.745  -5.745
   84    HG1  THR  11           HG1      THR  11  17.050  -6.390  -6.390
   85   1HG2  THR  11          1HG2      THR  11  17.143  -3.650  -3.650
   86   2HG2  THR  11          3HG2      THR  11  15.959  -4.477  -4.477
   87   3HG2  THR  11          2HG2      THR  11  16.790  -5.355  -5.355
   88    H    ASP  12           H        ASP  12  20.401  -4.942  -4.942
   89    HA   ASP  12           HA       ASP  12  22.410  -5.828  -5.828
   90   1HB   ASP  12          2HB       ASP  12  23.075  -3.477  -3.477
   91   2HB   ASP  12          1HB       ASP  12  23.172  -3.850  -3.850
   92    HA   PRO  13           HA       PRO  13  21.565  -8.726  -8.726
   93   1HB   PRO  13          2HB       PRO  13  22.690 -10.507 -10.507
   94   2HB   PRO  13          1HB       PRO  13  21.300 -10.758 -10.758
   95   1HG   PRO  13          2HG       PRO  13  20.954 -10.128 -10.128
   96   2HG   PRO  13          1HG       PRO  13  19.898  -9.452  -9.452
   97   1HD   PRO  13          2HD       PRO  13  22.135  -8.161  -8.161
   98   2HD   PRO  13          1HD       PRO  13  20.603  -7.465  -7.465
   99    H    MET  14           H        MET  14  24.355  -8.197  -8.197
  100    HA   MET  14           HA       MET  14  26.241  -9.687  -9.687
  101   1HB   MET  14          2HB       MET  14  26.556  -8.773  -8.773
  102   2HB   MET  14          1HB       MET  14  26.764  -7.179  -7.179
  103   1HG   MET  14          2HG       MET  14  28.588  -8.518  -8.518
  104   2HG   MET  14          1HG       MET  14  28.595  -9.492  -9.492
  105   1HE   MET  14          3HE       MET  14  30.849  -9.192  -9.192
  106   2HE   MET  14          2HE       MET  14  30.220  -8.713  -8.713
  107   3HE   MET  14          1HE       MET  14  31.527  -7.792  -7.792
  108    H    SER  15           H        SER  15  24.725  -6.664  -6.664
  109    HA   SER  15           HA       SER  15  26.602  -5.318  -5.318
  110   1HB   SER  15          2HB       SER  15  24.753  -4.174  -4.174
  111   2HB   SER  15          1HB       SER  15  24.338  -4.458  -4.458
  112    HG   SER  15           HG       SER  15  23.122  -6.276  -6.276
  113    H    ALA  16           H        ALA  16  24.740  -8.153  -8.153
  114    HA   ALA  16           HA       ALA  16  26.345  -8.532  -8.532
  115   1HB   ALA  16          2HB       ALA  16  24.457  -7.218  -7.218
  116   2HB   ALA  16          1HB       ALA  16  23.336  -8.413  -8.413
  117   3HB   ALA  16          3HB       ALA  16  24.437  -8.858  -8.858
  118    H    ILE  17           H        ILE  17  27.182 -10.357 -10.357
  119    HA   ILE  17           HA       ILE  17  25.284 -12.516 -12.516
  120    HB   ILE  17           HB       ILE  17  28.205 -12.434 -12.434
  121   1HG1  ILE  17          2HG1      ILE  17  25.832 -11.651 -11.651
  122   2HG1  ILE  17          1HG1      ILE  17  26.988 -10.521 -10.521
  123   1HG2  ILE  17          2HG2      ILE  17  25.885 -14.107 -14.107
  124   2HG2  ILE  17          1HG2      ILE  17  27.484 -14.110 -14.110
  125   3HG2  ILE  17          3HG2      ILE  17  27.286 -14.648 -14.648
  126   1HD1  ILE  17          2HD1      ILE  17  28.668 -12.149 -12.149
  127   2HD1  ILE  17          1HD1      ILE  17  27.238 -12.286 -12.286
  128   3HD1  ILE  17          3HD1      ILE  17  27.948 -10.703 -10.703
  129    H    GLN  18           H        GLN  18  25.448 -14.508 -14.508
  130    HA   GLN  18           HA       GLN  18  27.331 -14.687 -14.687
  131   1HB   GLN  18          2HB       GLN  18  24.454 -15.301 -15.301
  132   2HB   GLN  18          1HB       GLN  18  25.402 -16.490 -16.490
  133   1HG   GLN  18          2HG       GLN  18  25.613 -15.168 -15.168
  134   2HG   GLN  18          1HG       GLN  18  25.987 -13.753 -13.753
  135   1HE2  GLN  18          2HE2      GLN  18  22.970 -12.437 -12.437
  136   2HE2  GLN  18          1HE2      GLN  18  24.696 -12.349 -12.349
  137    H    ASN  19           H        ASN  19  28.888 -16.126 -16.126
  138    HA   ASN  19           HA       ASN  19  28.341 -18.787 -18.787
  139   1HB   ASN  19          2HB       ASN  19  28.520 -17.406 -17.406
  140   2HB   ASN  19          1HB       ASN  19  30.224 -17.206 -17.206
  141   1HD2  ASN  19          2HD2      ASN  19  30.359 -20.013 -20.013
  142   2HD2  ASN  19          1HD2      ASN  19  30.286 -18.287 -18.287
  143    H    LEU  20           H        LEU  20  29.238 -19.153 -19.153
  144    HA   LEU  20           HA       LEU  20  32.080 -18.554 -18.554
  145   1HB   LEU  20          2HB       LEU  20  29.824 -19.085 -19.085
  146   2HB   LEU  20          1HB       LEU  20  31.316 -19.872 -19.872
  147    HG   LEU  20           HG       LEU  20  32.431 -17.601 -17.601
  148   1HD1  LEU  20          3HD1      LEU  20  29.560 -16.685 -16.685
  149   2HD1  LEU  20          2HD1      LEU  20  30.965 -15.650 -15.650
  150   3HD1  LEU  20          1HD1      LEU  20  30.759 -16.500 -16.500
  151   1HD2  LEU  20          1HD2      LEU  20  30.447 -18.471 -18.471
  152   2HD2  LEU  20          3HD2      LEU  20  32.179 -18.177 -18.177
  153   3HD2  LEU  20          2HD2      LEU  20  31.053 -16.820 -16.820
  154    H    HIS  21           H        HIS  21  29.989 -21.139 -21.139
  155    HA   HIS  21           HA       HIS  21  30.264 -23.395 -23.395
  156   1HB   HIS  21          2HB       HIS  21  32.690 -23.868 -23.868
  157   2HB   HIS  21          1HB       HIS  21  31.426 -23.089 -23.089
  158    HD1  HIS  21           HD1      HIS  21  31.570 -20.352 -20.352
  159    HD2  HIS  21           HD2      HIS  21  35.002 -22.457 -22.457
  160    HE1  HIS  21           HE1      HIS  21  33.461 -18.714 -18.714
  161    HE2  HIS  21           HE2      HIS  21  35.538 -20.038 -20.038
  162    H    SER  22           H        SER  22  30.141 -24.182 -24.182
  163    HA   SER  22           HA       SER  22  32.728 -24.785 -24.785
  164   1HB   SER  22          2HB       SER  22  31.574 -23.197 -23.197
  165   2HB   SER  22          1HB       SER  22  30.077 -24.125 -24.125
  166    HG   SER  22           HG       SER  22  30.765 -25.307 -25.307
  167    H    PHE  23           H        PHE  23  32.353 -26.659 -26.659
  168    HA   PHE  23           HA       PHE  23  31.086 -28.833 -28.833
  169   1HB   PHE  23          2HB       PHE  23  32.663 -29.669 -29.669
  170   2HB   PHE  23          1HB       PHE  23  32.804 -30.144 -30.144
  171    HD1  PHE  23           HD2      PHE  23  34.323 -28.995 -28.995
  172    HD2  PHE  23           HD1      PHE  23  33.973 -27.857 -27.857
  173    HE1  PHE  23           HE2      PHE  23  36.408 -27.702 -27.702
  174    HE2  PHE  23           HE1      PHE  23  36.057 -26.560 -26.560
  175    HZ   PHE  23           HZ       PHE  23  37.278 -26.482 -26.482
  176    H    ASP  24           H        ASP  24  30.300 -30.678 -30.678
  177    HA   ASP  24           HA       ASP  24  29.296 -30.098 -30.098
  178   1HB   ASP  24          2HB       ASP  24  27.709 -29.093 -29.093
  179   2HB   ASP  24          1HB       ASP  24  26.807 -30.298 -30.298
  180    HA   PRO  25           HA       PRO  25  29.497 -34.557 -34.557
  181   1HB   PRO  25          2HB       PRO  25  30.081 -34.740 -34.740
  182   2HB   PRO  25          1HB       PRO  25  30.930 -35.469 -35.469
  183   1HG   PRO  25          2HG       PRO  25  31.981 -33.404 -33.404
  184   2HG   PRO  25          1HG       PRO  25  32.150 -33.547 -33.547
  185   1HD   PRO  25          2HD       PRO  25  30.305 -31.811 -31.811
  186   2HD   PRO  25          1HD       PRO  25  31.201 -31.437 -31.437
  187    H    PHE  26           H        PHE  26  27.946 -32.953 -32.953
  188    HA   PHE  26           HA       PHE  26  25.753 -34.913 -34.913
  189   1HB   PHE  26          2HB       PHE  26  26.292 -33.540 -33.540
  190   2HB   PHE  26          1HB       PHE  26  25.563 -35.112 -35.112
  191    HD1  PHE  26           HD1      PHE  26  28.729 -33.267 -33.267
  192    HD2  PHE  26           HD2      PHE  26  26.896 -37.084 -37.084
  193    HE1  PHE  26           HE1      PHE  26  30.881 -34.351 -34.351
  194    HE2  PHE  26           HE2      PHE  26  29.045 -38.176 -38.176
  195    HZ   PHE  26           HZ       PHE  26  31.040 -36.808 -36.808
  196    H    ALA  27           H        ALA  27  26.580 -31.659 -31.659
  197    HA   ALA  27           HA       ALA  27  25.461 -29.679 -29.679
  198   1HB   ALA  27          2HB       ALA  27  25.281 -30.339 -30.339
  199   2HB   ALA  27          1HB       ALA  27  23.657 -30.922 -30.922
  200   3HB   ALA  27          3HB       ALA  27  24.053 -29.217 -29.217
  201    H    ASP  28           H        ASP  28  24.711 -31.587 -31.587
  202    HA   ASP  28           HA       ASP  28  21.940 -31.961 -31.961
  203   1HB   ASP  28          2HB       ASP  28  24.072 -32.825 -32.825
  204   2HB   ASP  28          1HB       ASP  28  23.483 -31.573 -31.573
  205    H    ALA  29           H        ALA  29  20.338 -30.603 -30.603
  206    HA   ALA  29           HA       ALA  29  20.801 -28.243 -28.243
  207   1HB   ALA  29          1HB       ALA  29  20.090 -28.133 -28.133
  208   2HB   ALA  29          3HB       ALA  29  19.530 -26.876 -26.876
  209   3HB   ALA  29          2HB       ALA  29  21.258 -27.168 -27.168
  210    H    SER  30           H        SER  30  19.194 -28.119 -28.119
  211    HA   SER  30           HA       SER  30  16.455 -28.319 -28.319
  212   1HB   SER  30          2HB       SER  30  16.203 -30.300 -30.300
  213   2HB   SER  30          1HB       SER  30  16.418 -30.607 -30.607
  214    HG   SER  30           HG       SER  30  17.888 -31.844 -31.844
  215    H    LYS  31           H        LYS  31  16.844 -26.209 -26.209
  216    HA   LYS  31           HA       LYS  31  17.150 -26.258 -26.258
  217   1HB   LYS  31          2HB       LYS  31  16.780 -23.867 -23.867
  218   2HB   LYS  31          1HB       LYS  31  17.328 -23.856 -23.856
  219   1HG   LYS  31          2HG       LYS  31  19.361 -25.034 -25.034
  220   2HG   LYS  31          1HG       LYS  31  18.810 -25.067 -25.067
  221   1HD   LYS  31          2HD       LYS  31  20.107 -23.202 -23.202
  222   2HD   LYS  31          1HD       LYS  31  18.608 -22.446 -22.446
  223   1HE   LYS  31          2HE       LYS  31  19.366 -22.283 -22.283
  224   2HE   LYS  31          1HE       LYS  31  20.658 -23.453 -23.453
  225   1HZ   LYS  31          3HZ       LYS  31  20.726 -21.010 -21.010
  226   2HZ   LYS  31          2HZ       LYS  31  21.090 -20.860 -20.860
  227   3HZ   LYS  31          1HZ       LYS  31  21.999 -21.901 -21.901
  228    H    GLY  32           H        GLY  32  14.751 -25.476 -25.476
  229   1HA   GLY  32          2HA       GLY  32  12.434 -26.128 -26.128
  230   2HA   GLY  32          1HA       GLY  32  12.756 -25.132 -25.132
  231    H    ASP  33           H        ASP  33  12.965 -24.825 -24.825
  232    HA   ASP  33           HA       ASP  33  11.526 -22.270 -22.270
  233   1HB   ASP  33          2HB       ASP  33  14.141 -22.824 -22.824
  234   2HB   ASP  33          1HB       ASP  33  13.046 -21.925 -21.925
  235    H    ASP  34           H        ASP  34  10.538 -24.950 -24.950
  236    HA   ASP  34           HA       ASP  34   9.972 -24.983 -24.983
  237   1HB   ASP  34          2HB       ASP  34   8.806 -26.708 -26.708
  238   2HB   ASP  34          1HB       ASP  34   8.730 -27.021 -27.021
  239    H    LEU  35           H        LEU  35   8.279 -24.215 -24.215
  240    HA   LEU  35           HA       LEU  35   6.090 -23.085 -23.085
  241   1HB   LEU  35          2HB       LEU  35   5.302 -25.090 -25.090
  242   2HB   LEU  35          1HB       LEU  35   5.895 -24.495 -24.495
  243    HG   LEU  35           HG       LEU  35   4.246 -22.706 -22.706
  244   1HD1  LEU  35          2HD1      LEU  35   3.579 -23.805 -23.805
  245   2HD1  LEU  35          1HD1      LEU  35   2.442 -22.825 -22.825
  246   3HD1  LEU  35          3HD1      LEU  35   3.999 -22.151 -22.151
  247   1HD2  LEU  35          3HD2      LEU  35   3.720 -25.074 -25.074
  248   2HD2  LEU  35          2HD2      LEU  35   2.354 -24.002 -24.002
  249   3HD2  LEU  35          1HD2      LEU  35   2.791 -25.239 -25.239
  250    H    LEU  36           H        LEU  36   6.722 -20.976 -20.976
  251    HA   LEU  36           HA       LEU  36   7.312 -19.747 -19.747
  252   1HB   LEU  36          2HB       LEU  36   7.510 -18.306 -18.306
  253   2HB   LEU  36          1HB       LEU  36   8.401 -18.029 -18.029
  254    HG   LEU  36           HG       LEU  36   8.808 -20.296 -20.296
  255   1HD1  LEU  36          3HD1      LEU  36   9.685 -17.892 -17.892
  256   2HD1  LEU  36          2HD1      LEU  36  10.856 -18.286 -18.286
  257   3HD1  LEU  36          1HD1      LEU  36  10.774 -19.264 -19.264
  258   1HD2  LEU  36          2HD2      LEU  36   9.774 -19.866 -19.866
  259   2HD2  LEU  36          1HD2      LEU  36   9.308 -21.359 -21.359
  260   3HD2  LEU  36          3HD2      LEU  36  10.861 -20.605 -20.605
  261    HA   PRO  37           HA       PRO  37   3.389 -17.746 -17.746
  262   1HB   PRO  37          2HB       PRO  37   4.033 -15.454 -15.454
  263   2HB   PRO  37          1HB       PRO  37   3.991 -17.032 -17.032
  264   1HG   PRO  37          2HG       PRO  37   6.340 -15.505 -15.505
  265   2HG   PRO  37          1HG       PRO  37   6.179 -16.394 -16.394
  266   1HD   PRO  37          2HD       PRO  37   7.454 -17.423 -17.423
  267   2HD   PRO  37          1HD       PRO  37   6.559 -18.434 -18.434
  268    H    ALA  38           H        ALA  38   3.194 -17.410 -17.410
  269    HA   ALA  38           HA       ALA  38   3.880 -14.687 -14.687
  270   1HB   ALA  38          3HB       ALA  38   4.865 -16.456 -16.456
  271   2HB   ALA  38          2HB       ALA  38   3.263 -17.131 -17.131
  272   3HB   ALA  38          1HB       ALA  38   3.680 -15.537 -15.537
  273    H    GLY  39           H        GLY  39   2.119 -13.552 -13.552
  274   1HA   GLY  39          2HA       GLY  39  -0.092 -13.189 -13.189
  275   2HA   GLY  39          1HA       GLY  39  -0.572 -14.489 -14.489
  276    H    THR  40           H        THR  40  -0.164 -14.027 -14.027
  277    HA   THR  40           HA       THR  40  -1.017 -11.267 -11.267
  278    HB   THR  40           HB       THR  40  -1.586 -12.519 -12.519
  279    HG1  THR  40           HG1      THR  40  -0.769 -14.525 -14.525
  280   1HG2  THR  40          2HG2      THR  40  -3.129 -11.388 -11.388
  281   2HG2  THR  40          1HG2      THR  40  -3.486 -13.053 -13.053
  282   3HG2  THR  40          3HG2      THR  40  -3.799 -12.508 -12.508
  283    H    GLU  41           H        GLU  41   1.298 -13.746 -13.746
  284    HA   GLU  41           HA       GLU  41   3.192 -13.719 -13.719
  285   1HB   GLU  41          2HB       GLU  41   3.107 -11.266 -11.266
  286   2HB   GLU  41          1HB       GLU  41   3.921 -11.002 -11.002
  287   1HG   GLU  41          2HG       GLU  41   5.719 -12.173 -12.173
  288   2HG   GLU  41          1HG       GLU  41   4.757 -13.436 -13.436
  289    H    ASP  42           H        ASP  42   0.539 -13.032 -13.032
  290    HA   ASP  42           HA       ASP  42  -0.301 -12.332 -12.332
  291   1HB   ASP  42          2HB       ASP  42   2.122 -13.842 -13.842
  292   2HB   ASP  42          1HB       ASP  42   1.883 -12.669 -12.669
  293    H    TYR  43           H        TYR  43   0.019 -10.124 -10.124
  294    HA   TYR  43           HA       TYR  43   2.000  -8.350  -8.350
  295   1HB   TYR  43          2HB       TYR  43  -0.722  -7.710  -7.710
  296   2HB   TYR  43          1HB       TYR  43   0.614  -6.579  -6.579
  297    HD1  TYR  43           HD2      TYR  43   2.744  -8.730  -8.730
  298    HD2  TYR  43           HD1      TYR  43  -0.912  -7.361  -7.361
  299    HE1  TYR  43           HE2      TYR  43   3.552  -9.349  -9.349
  300    HE2  TYR  43           HE1      TYR  43  -0.111  -7.980  -7.980
  301    HH   TYR  43           HH       TYR  43   1.522  -9.500  -9.500
  302    H    ILE  44           H        ILE  44   1.469  -6.323  -6.323
  303    HA   ILE  44           HA       ILE  44  -0.346  -6.919  -6.919
  304    HB   ILE  44           HB       ILE  44   2.243  -5.363  -5.363
  305   1HG1  ILE  44          2HG1      ILE  44   2.583  -7.784  -7.784
  306   2HG1  ILE  44          1HG1      ILE  44   3.034  -7.199  -7.199
  307   1HG2  ILE  44          1HG2      ILE  44   0.486  -4.486  -4.486
  308   2HG2  ILE  44          3HG2      ILE  44   0.389  -6.077  -6.077
  309   3HG2  ILE  44          2HG2      ILE  44   1.879  -5.140  -5.140
  310   1HD1  ILE  44          3HD1      ILE  44   0.548  -7.875  -7.875
  311   2HD1  ILE  44          2HD1      ILE  44   0.792  -8.950  -8.950
  312   3HD1  ILE  44          1HD1      ILE  44   1.861  -9.053  -9.053
  313    H    HIS  45           H        HIS  45  -2.109  -5.743  -5.743
  314    HA   HIS  45           HA       HIS  45  -2.203  -3.335  -3.335
  315   1HB   HIS  45          2HB       HIS  45  -4.062  -5.100  -5.100
  316   2HB   HIS  45          1HB       HIS  45  -4.468  -3.424  -3.424
  317    HD1  HIS  45           HD1      HIS  45  -3.519  -5.393  -5.393
  318    HD2  HIS  45           HD2      HIS  45  -6.138  -2.433  -2.433
  319    HE1  HIS  45           HE1      HIS  45  -4.916  -4.820  -4.820
  320    HE2  HIS  45           HE2      HIS  45  -6.552  -3.088  -3.088
  321    H    ILE  46           H        ILE  46  -2.412  -1.254  -1.254
  322    HA   ILE  46           HA       ILE  46  -2.255  -0.481  -0.481
  323    HB   ILE  46           HB       ILE  46  -0.221   0.149   0.149
  324   1HG1  ILE  46          2HG1      ILE  46   1.221   0.083   0.083
  325   2HG1  ILE  46          1HG1      ILE  46  -0.216  -0.481  -0.481
  326   1HG2  ILE  46          2HG2      ILE  46  -1.247   2.024   2.024
  327   2HG2  ILE  46          1HG2      ILE  46   0.451   2.085   2.085
  328   3HG2  ILE  46          3HG2      ILE  46  -0.828   2.350   2.350
  329   1HD1  ILE  46          3HD1      ILE  46   0.210  -2.036  -2.036
  330   2HD1  ILE  46          2HD1      ILE  46   1.675  -2.001  -2.001
  331   3HD1  ILE  46          1HD1      ILE  46   0.152  -2.548  -2.548
  332    H    ARG  47           H        ARG  47  -4.218   0.477   0.477
  333    HA   ARG  47           HA       ARG  47  -4.699   2.630   2.630
  334   1HB   ARG  47          2HB       ARG  47  -6.138   0.707   0.707
  335   2HB   ARG  47          1HB       ARG  47  -6.759   0.753   0.753
  336   1HG   ARG  47          2HG       ARG  47  -7.789   2.890   2.890
  337   2HG   ARG  47          1HG       ARG  47  -7.058   2.986   2.986
  338   1HD   ARG  47          2HD       ARG  47  -8.330   0.612   0.612
  339   2HD   ARG  47          1HD       ARG  47  -9.402   1.462   1.462
  340    HE   ARG  47           HE       ARG  47  -9.141   1.917   1.917
  341   1HH1  ARG  47          2HH1      ARG  47  -9.693   3.571   3.571
  342   2HH1  ARG  47          1HH1      ARG  47 -10.572   4.872   4.872
  343   1HH2  ARG  47          1HH2      ARG  47 -10.295   3.629   3.629
  344   2HH2  ARG  47          2HH2      ARG  47 -10.914   4.905   4.905
  345    H    ILE  48           H        ILE  48  -5.810   4.441   4.441
  346    HA   ILE  48           HA       ILE  48  -5.733   4.906   4.906
  347    HB   ILE  48           HB       ILE  48  -5.609   6.747   6.747
  348   1HG1  ILE  48          2HG1      ILE  48  -3.886   6.626   6.626
  349   2HG1  ILE  48          1HG1      ILE  48  -3.525   5.749   5.749
  350   1HG2  ILE  48          3HG2      ILE  48  -6.276   7.509   7.509
  351   2HG2  ILE  48          2HG2      ILE  48  -5.678   8.651   8.651
  352   3HG2  ILE  48          1HG2      ILE  48  -7.217   7.827   7.827
  353   1HD1  ILE  48          2HD1      ILE  48  -3.809   8.737   8.737
  354   2HD1  ILE  48          1HD1      ILE  48  -2.278   7.861   7.861
  355   3HD1  ILE  48          3HD1      ILE  48  -3.304   7.812   7.812
  356    H    GLN  49           H        GLN  49  -7.493   6.002   6.002
  357    HA   GLN  49           HA       GLN  49 -10.007   6.024   6.024
  358   1HB   GLN  49          2HB       GLN  49 -11.232   4.974   4.974
  359   2HB   GLN  49          1HB       GLN  49  -9.879   3.937   3.937
  360   1HG   GLN  49          2HG       GLN  49  -8.769   5.361   5.361
  361   2HG   GLN  49          1HG       GLN  49 -10.456   5.385   5.385
  362   1HE2  GLN  49          2HE2      GLN  49 -10.101   2.301   2.301
  363   2HE2  GLN  49          1HE2      GLN  49 -10.665   3.933   3.933
  364    H    GLN  50           H        GLN  50  -9.677   8.273   8.273
  365    HA   GLN  50           HA       GLN  50  -9.777   9.794   9.794
  366   1HB   GLN  50          2HB       GLN  50  -8.464  10.200  10.200
  367   2HB   GLN  50          1HB       GLN  50  -9.777  11.368  11.368
  368   1HG   GLN  50          2HG       GLN  50  -8.998  12.458  12.458
  369   2HG   GLN  50          1HG       GLN  50  -7.967  11.104  11.104
  370   1HE2  GLN  50          2HE2      GLN  50  -5.821  13.763  13.763
  371   2HE2  GLN  50          1HE2      GLN  50  -6.920  13.589  13.589
  372    H    ARG  51           H        ARG  51 -11.607  10.637  10.637
  373    HA   ARG  51           HA       ARG  51 -14.017  10.445  10.445
  374   1HB   ARG  51          2HB       ARG  51 -13.767  11.288  11.288
  375   2HB   ARG  51          1HB       ARG  51 -15.236  10.815  10.815
  376   1HG   ARG  51          2HG       ARG  51 -14.681   8.574   8.574
  377   2HG   ARG  51          1HG       ARG  51 -12.958   8.898   8.898
  378   1HD   ARG  51          2HD       ARG  51 -13.842   8.018   8.018
  379   2HD   ARG  51          1HD       ARG  51 -13.423   9.714   9.714
  380    HE   ARG  51           HE       ARG  51 -15.612  10.128  10.128
  381   1HH1  ARG  51          2HH1      ARG  51 -15.432   7.140   7.140
  382   2HH1  ARG  51          1HH1      ARG  51 -17.122   6.798   6.798
  383   1HH2  ARG  51          1HH2      ARG  51 -17.834   9.679   9.679
  384   2HH2  ARG  51          2HH2      ARG  51 -18.486   8.240   8.240
  385    H    ASN  52           H        ASN  52 -14.785  12.114  12.114
  386    HA   ASN  52           HA       ASN  52 -15.130  14.231  14.231
  387   1HB   ASN  52          2HB       ASN  52 -16.204  14.247  14.247
  388   2HB   ASN  52          1HB       ASN  52 -14.805  15.208  15.208
  389   1HD2  ASN  52          2HD2      ASN  52 -16.782  17.961  17.961
  390   2HD2  ASN  52          1HD2      ASN  52 -16.065  17.005  17.005
  391    H    GLY  53           H        GLY  53 -12.347  13.229  13.229
  392   1HA   GLY  53          2HA       GLY  53 -10.369  14.205  14.205
  393   2HA   GLY  53          1HA       GLY  53 -11.035  15.791  15.791
  394    H    ARG  54           H        ARG  54 -11.678  14.135  14.135
  395    HA   ARG  54           HA       ARG  54  -9.076  14.772  14.772
  396   1HB   ARG  54          2HB       ARG  54 -11.677  14.861  14.861
  397   2HB   ARG  54          1HB       ARG  54 -10.146  15.624  15.624
  398   1HG   ARG  54          2HG       ARG  54 -10.455  17.127  17.127
  399   2HG   ARG  54          1HG       ARG  54 -12.065  16.433  16.433
  400   1HD   ARG  54          2HD       ARG  54 -12.783  18.021  18.021
  401   2HD   ARG  54          1HD       ARG  54 -11.992  17.111  17.111
  402    HE   ARG  54           HE       ARG  54 -10.017  18.681  18.681
  403   1HH1  ARG  54          2HH1      ARG  54 -13.179  19.280  19.280
  404   2HH1  ARG  54          1HH1      ARG  54 -12.758  20.845  20.845
  405   1HH2  ARG  54          1HH2      ARG  54  -9.463  20.739  20.739
  406   2HH2  ARG  54          2HH2      ARG  54 -10.649  21.674  21.674
  407    H    LYS  55           H        LYS  55  -9.396  13.730  13.730
  408    HA   LYS  55           HA       LYS  55  -8.884  11.727  11.727
  409   1HB   LYS  55          2HB       LYS  55 -11.693  11.824  11.824
  410   2HB   LYS  55          1HB       LYS  55 -11.120  10.179  10.179
  411   1HG   LYS  55          2HG       LYS  55 -12.104  11.178  11.178
  412   2HG   LYS  55          1HG       LYS  55 -10.422  10.689  10.689
  413   1HD   LYS  55          2HD       LYS  55 -10.615  13.422  13.422
  414   2HD   LYS  55          1HD       LYS  55 -11.530  13.184  13.184
  415   1HE   LYS  55          2HE       LYS  55  -9.279  11.859  11.859
  416   2HE   LYS  55          1HE       LYS  55  -8.619  13.053  13.053
  417   1HZ   LYS  55          2HZ       LYS  55 -10.361  14.388  14.388
  418   2HZ   LYS  55          1HZ       LYS  55  -9.386  13.399  13.399
  419   3HZ   LYS  55          3HZ       LYS  55  -8.678  14.523  14.523
  420    H    THR  56           H        THR  56  -7.157  11.192  11.192
  421    HA   THR  56           HA       THR  56  -7.804   9.272   9.272
  422    HB   THR  56           HB       THR  56  -4.972   9.766   9.766
  423    HG1  THR  56           HG1      THR  56  -5.000  11.932  11.932
  424   1HG2  THR  56          3HG2      THR  56  -6.799   9.729   9.729
  425   2HG2  THR  56          2HG2      THR  56  -5.391  10.784  10.784
  426   3HG2  THR  56          1HG2      THR  56  -5.176   9.060   9.060
  427    H    LEU  57           H        LEU  57  -7.523   7.128   7.128
  428    HA   LEU  57           HA       LEU  57  -5.909   6.069   6.069
  429   1HB   LEU  57          2HB       LEU  57  -8.801   5.798   5.798
  430   2HB   LEU  57          1HB       LEU  57  -7.977   4.269   4.269
  431    HG   LEU  57           HG       LEU  57  -7.715   6.618   6.618
  432   1HD1  LEU  57          2HD1      LEU  57  -9.631   4.306   4.306
  433   2HD1  LEU  57          1HD1      LEU  57  -9.206   5.183   5.183
  434   3HD1  LEU  57          3HD1      LEU  57  -9.984   6.029   6.029
  435   1HD2  LEU  57          1HD2      LEU  57  -6.598   3.894   3.894
  436   2HD2  LEU  57          3HD2      LEU  57  -5.951   5.353   5.353
  437   3HD2  LEU  57          2HD2      LEU  57  -7.185   4.407   4.407
  438    H    THR  58           H        THR  58  -4.304   5.352   5.352
  439    HA   THR  58           HA       THR  58  -4.799   3.957   3.957
  440    HB   THR  58           HB       THR  58  -2.305   3.974   3.974
  441    HG1  THR  58           HG1      THR  58  -3.245   6.042   6.042
  442   1HG2  THR  58          2HG2      THR  58  -2.866   2.979   2.979
  443   2HG2  THR  58          1HG2      THR  58  -1.332   3.796   3.796
  444   3HG2  THR  58          3HG2      THR  58  -1.761   2.363   2.363
  445    H    THR  59           H        THR  59  -4.784   1.791   1.791
  446    HA   THR  59           HA       THR  59  -4.700  -0.067  -0.067
  447    HB   THR  59           HB       THR  59  -6.373  -1.359  -1.359
  448    HG1  THR  59           HG1      THR  59  -7.472  -0.038  -0.038
  449   1HG2  THR  59          1HG2      THR  59  -6.993   0.567   0.567
  450   2HG2  THR  59          3HG2      THR  59  -8.276  -0.274  -0.274
  451   3HG2  THR  59          2HG2      THR  59  -7.056  -1.197  -1.197
  452    H    VAL  60           H        VAL  60  -3.761  -2.051  -2.051
  453    HA   VAL  60           HA       VAL  60  -2.404  -2.411  -2.411
  454    HB   VAL  60           HB       VAL  60  -1.398  -3.253  -3.253
  455   1HG1  VAL  60          3HG1      VAL  60  -0.773  -4.740  -4.740
  456   2HG1  VAL  60          2HG1      VAL  60   0.052  -3.355  -3.355
  457   3HG1  VAL  60          1HG1      VAL  60   0.589  -3.999  -3.999
  458   1HG2  VAL  60          2HG2      VAL  60  -0.868  -0.897  -0.897
  459   2HG2  VAL  60          1HG2      VAL  60  -1.012  -0.996  -0.996
  460   3HG2  VAL  60          3HG2      VAL  60   0.455  -1.566  -1.566
  461    H    GLN  61           H        GLN  61  -2.931  -4.178  -4.178
  462    HA   GLN  61           HA       GLN  61  -4.086  -6.449  -6.449
  463   1HB   GLN  61          2HB       GLN  61  -4.777  -6.396  -6.396
  464   2HB   GLN  61          1HB       GLN  61  -5.818  -6.569  -6.569
  465   1HG   GLN  61          2HG       GLN  61  -6.061  -4.242  -4.242
  466   2HG   GLN  61          1HG       GLN  61  -4.734  -3.919  -3.919
  467   1HE2  GLN  61          2HE2      GLN  61  -7.907  -5.542  -5.542
  468   2HE2  GLN  61          1HE2      GLN  61  -7.120  -6.371  -6.371
  469    H    GLY  62           H        GLY  62  -3.317  -8.454  -8.454
  470   1HA   GLY  62          2HA       GLY  62  -2.251  -9.989  -9.989
  471   2HA   GLY  62          1HA       GLY  62  -1.195  -8.657  -8.657
  472    H    ILE  63           H        ILE  63  -0.988  -7.833  -7.833
  473    HA   ILE  63           HA       ILE  63   1.378  -9.206  -9.206
  474    HB   ILE  63           HB       ILE  63  -0.390  -7.433  -7.433
  475   1HG1  ILE  63          2HG1      ILE  63   0.515  -6.129  -6.129
  476   2HG1  ILE  63          1HG1      ILE  63   1.617  -5.862  -5.862
  477   1HG2  ILE  63          2HG2      ILE  63   1.877  -9.052  -9.052
  478   2HG2  ILE  63          1HG2      ILE  63   2.160  -7.339  -7.339
  479   3HG2  ILE  63          3HG2      ILE  63   0.749  -8.136  -8.136
  480   1HD1  ILE  63          1HD1      ILE  63   2.879  -7.893  -7.893
  481   2HD1  ILE  63          3HD1      ILE  63   2.048  -7.263  -7.263
  482   3HD1  ILE  63          2HD1      ILE  63   3.130  -6.219  -6.219
  483    H    ALA  64           H        ALA  64   1.847 -10.758 -10.758
  484    HA   ALA  64           HA       ALA  64  -0.317 -12.574 -12.574
  485   1HB   ALA  64          2HB       ALA  64   1.972 -13.257 -13.257
  486   2HB   ALA  64          1HB       ALA  64   2.568 -12.921 -12.921
  487   3HB   ALA  64          3HB       ALA  64   1.340 -14.163 -14.163
  488    H    ASP  65           H        ASP  65  -1.252 -12.855 -12.855
  489    HA   ASP  65           HA       ASP  65  -0.929 -10.993 -10.993
  490   1HB   ASP  65          2HB       ASP  65  -2.924 -12.569 -12.569
  491   2HB   ASP  65          1HB       ASP  65  -2.073 -13.733 -13.733
  492    H    ASP  66           H        ASP  66   0.841 -13.818 -13.818
  493    HA   ASP  66           HA       ASP  66   1.749 -14.537 -14.537
  494   1HB   ASP  66          2HB       ASP  66   2.745 -15.059 -15.059
  495   2HB   ASP  66          1HB       ASP  66   3.686 -15.566 -15.566
  496    H    TYR  67           H        TYR  67   2.571 -11.962 -11.962
  497    HA   TYR  67           HA       TYR  67   5.201 -11.412 -11.412
  498   1HB   TYR  67          2HB       TYR  67   2.850  -9.563  -9.563
  499   2HB   TYR  67          1HB       TYR  67   4.495  -8.961  -8.961
  500    HD1  TYR  67           HD2      TYR  67   4.327 -12.128 -12.128
  501    HD2  TYR  67           HD1      TYR  67   3.953  -7.932  -7.932
  502    HE1  TYR  67           HE2      TYR  67   4.686 -12.439 -12.439
  503    HE2  TYR  67           HE1      TYR  67   4.309  -8.230  -8.230
  504    HH   TYR  67           HH       TYR  67   5.511 -11.049 -11.049
  505    H    ASP  68           H        ASP  68   5.945  -9.454  -9.454
  506    HA   ASP  68           HA       ASP  68   5.866 -10.146 -10.146
  507   1HB   ASP  68          2HB       ASP  68   6.636  -7.720  -7.720
  508   2HB   ASP  68          1HB       ASP  68   7.632  -8.744  -8.744
  509    H    LYS  69           H        LYS  69   3.608  -8.240  -8.240
  510    HA   LYS  69           HA       LYS  69   1.582  -7.351  -7.351
  511   1HB   LYS  69          2HB       LYS  69   1.827  -9.604  -9.604
  512   2HB   LYS  69          1HB       LYS  69   1.276  -8.327  -8.327
  513   1HG   LYS  69          2HG       LYS  69  -0.496  -7.863  -7.863
  514   2HG   LYS  69          1HG       LYS  69  -0.069  -9.459  -9.459
  515   1HD   LYS  69          2HD       LYS  69  -1.255 -10.466 -10.466
  516   2HD   LYS  69          1HD       LYS  69  -0.448  -9.537  -9.537
  517   1HE   LYS  69          2HE       LYS  69  -2.125  -7.681  -7.681
  518   2HE   LYS  69          1HE       LYS  69  -3.076  -9.163  -9.163
  519   1HZ   LYS  69          3HZ       LYS  69  -2.168  -9.327  -9.327
  520   2HZ   LYS  69          2HZ       LYS  69  -2.241  -7.645  -7.645
  521   3HZ   LYS  69          1HZ       LYS  69  -3.630  -8.578  -8.578
  522    H    LYS  70           H        LYS  70   2.929  -7.487  -7.487
  523    HA   LYS  70           HA       LYS  70   2.166  -4.911  -4.911
  524   1HB   LYS  70          2HB       LYS  70   4.368  -6.704  -6.704
  525   2HB   LYS  70          1HB       LYS  70   4.032  -5.136  -5.136
  526   1HG   LYS  70          2HG       LYS  70   2.494  -6.080  -6.080
  527   2HG   LYS  70          1HG       LYS  70   1.567  -6.484  -6.484
  528   1HD   LYS  70          2HD       LYS  70   1.849  -8.603  -8.603
  529   2HD   LYS  70          1HD       LYS  70   3.438  -8.440  -8.440
  530   1HE   LYS  70          2HE       LYS  70   4.515  -8.338  -8.338
  531   2HE   LYS  70          1HE       LYS  70   3.195  -7.477  -7.477
  532   1HZ   LYS  70          2HZ       LYS  70   2.889 -10.312 -10.312
  533   2HZ   LYS  70          1HZ       LYS  70   3.688  -9.889  -9.889
  534   3HZ   LYS  70          3HZ       LYS  70   2.075  -9.432  -9.432
  535    H    LYS  71           H        LYS  71   5.462  -5.994  -5.994
  536    HA   LYS  71           HA       LYS  71   6.570  -3.425  -3.425
  537   1HB   LYS  71          2HB       LYS  71   7.635  -5.865  -5.865
  538   2HB   LYS  71          1HB       LYS  71   7.630  -5.609  -5.609
  539   1HG   LYS  71          2HG       LYS  71   9.628  -4.674  -4.674
  540   2HG   LYS  71          1HG       LYS  71   8.698  -3.271  -3.271
  541   1HD   LYS  71          2HD       LYS  71   9.063  -5.247  -5.247
  542   2HD   LYS  71          1HD       LYS  71  10.590  -4.619  -4.619
  543   1HE   LYS  71          2HE       LYS  71   8.382  -2.719  -2.719
  544   2HE   LYS  71          1HE       LYS  71   9.336  -3.405  -3.405
  545   1HZ   LYS  71          3HZ       LYS  71  10.645  -2.143  -2.143
  546   2HZ   LYS  71          2HZ       LYS  71  10.097  -1.208  -1.208
  547   3HZ   LYS  71          1HZ       LYS  71  11.264  -2.405  -2.405
  548    H    LEU  72           H        LEU  72   4.562  -5.211  -5.211
  549    HA   LEU  72           HA       LEU  72   5.260  -4.161  -4.161
  550   1HB   LEU  72          2HB       LEU  72   3.501  -5.964  -5.964
  551   2HB   LEU  72          1HB       LEU  72   2.393  -4.606  -4.606
  552    HG   LEU  72           HG       LEU  72   3.945  -5.553  -5.553
  553   1HD1  LEU  72          3HD1      LEU  72   1.963  -6.903  -6.903
  554   2HD1  LEU  72          2HD1      LEU  72   0.971  -5.472  -5.472
  555   3HD1  LEU  72          1HD1      LEU  72   1.844  -6.215  -6.215
  556   1HD2  LEU  72          2HD2      LEU  72   2.371  -3.081  -3.081
  557   2HD2  LEU  72          1HD2      LEU  72   3.849  -3.296  -3.296
  558   3HD2  LEU  72          3HD2      LEU  72   2.300  -3.809  -3.809
  559    H    VAL  73           H        VAL  73   2.538  -3.024  -3.024
  560    HA   VAL  73           HA       VAL  73   2.555  -0.488  -0.488
  561    HB   VAL  73           HB       VAL  73   0.681  -0.007  -0.007
  562   1HG1  VAL  73          1HG1      VAL  73   0.383  -1.796  -1.796
  563   2HG1  VAL  73          3HG1      VAL  73  -0.969  -1.048  -1.048
  564   3HG1  VAL  73          2HG1      VAL  73   0.241  -0.039  -0.039
  565   1HG2  VAL  73          2HG2      VAL  73   1.205  -2.139  -2.139
  566   2HG2  VAL  73          1HG2      VAL  73  -0.486  -1.930  -1.930
  567   3HG2  VAL  73          3HG2      VAL  73   0.548  -3.012  -3.012
  568    H    LYS  74           H        LYS  74   3.598  -1.777  -1.777
  569    HA   LYS  74           HA       LYS  74   3.749   0.555   0.555
  570   1HB   LYS  74          2HB       LYS  74   4.113  -1.696  -1.696
  571   2HB   LYS  74          1HB       LYS  74   5.625  -1.814  -1.814
  572   1HG   LYS  74          2HG       LYS  74   6.566   0.004   0.004
  573   2HG   LYS  74          1HG       LYS  74   5.034   0.222   0.222
  574   1HD   LYS  74          2HD       LYS  74   5.797  -2.512  -2.512
  575   2HD   LYS  74          1HD       LYS  74   7.187  -1.514  -1.514
  576   1HE   LYS  74          2HE       LYS  74   6.286  -1.118  -1.118
  577   2HE   LYS  74          1HE       LYS  74   4.894  -0.367  -0.367
  578   1HZ   LYS  74          2HZ       LYS  74   5.131  -3.296  -3.296
  579   2HZ   LYS  74          1HZ       LYS  74   4.396  -2.279  -2.279
  580   3HZ   LYS  74          3HZ       LYS  74   3.752  -2.415  -2.415
  581    H    ALA  75           H        ALA  75   6.072  -0.835  -0.835
  582    HA   ALA  75           HA       ALA  75   8.102   1.092   1.092
  583   1HB   ALA  75          1HB       ALA  75   7.572  -1.020  -1.020
  584   2HB   ALA  75          3HB       ALA  75   8.684   0.267   0.267
  585   3HB   ALA  75          2HB       ALA  75   9.014  -0.706  -0.706
  586    H    PHE  76           H        PHE  76   5.285   0.991   0.991
  587    HA   PHE  76           HA       PHE  76   5.926   3.036   3.036
  588   1HB   PHE  76          2HB       PHE  76   3.867   1.395   1.395
  589   2HB   PHE  76          1HB       PHE  76   3.123   2.735   2.735
  590    HD1  PHE  76           HD1      PHE  76   4.563   1.665   1.665
  591    HD2  PHE  76           HD2      PHE  76   2.443   4.718   4.718
  592    HE1  PHE  76           HE1      PHE  76   4.028   2.737   2.737
  593    HE2  PHE  76           HE2      PHE  76   1.898   5.797   5.797
  594    HZ   PHE  76           HZ       PHE  76   2.691   4.806   4.806
  595    H    LYS  77           H        LYS  77   4.042   3.224   3.224
  596    HA   LYS  77           HA       LYS  77   3.705   5.995   5.995
  597   1HB   LYS  77          2HB       LYS  77   3.917   4.141   4.141
  598   2HB   LYS  77          1HB       LYS  77   3.171   5.733   5.733
  599   1HG   LYS  77          2HG       LYS  77   1.237   4.804   4.804
  600   2HG   LYS  77          1HG       LYS  77   1.941   4.235   4.235
  601   1HD   LYS  77          2HD       LYS  77   1.261   2.245   2.245
  602   2HD   LYS  77          1HD       LYS  77   2.910   2.335   2.335
  603   1HE   LYS  77          2HE       LYS  77   1.944   1.970   1.970
  604   2HE   LYS  77          1HE       LYS  77   1.543   3.685   3.685
  605   1HZ   LYS  77          1HZ       LYS  77  -0.319   1.859   1.859
  606   2HZ   LYS  77          3HZ       LYS  77  -0.265   1.799   1.799
  607   3HZ   LYS  77          2HZ       LYS  77  -0.623   3.253   3.253
  608    H    LYS  78           H        LYS  78   6.518   4.129   4.129
  609    HA   LYS  78           HA       LYS  78   7.805   6.267   6.267
  610   1HB   LYS  78          2HB       LYS  78   8.687   3.471   3.471
  611   2HB   LYS  78          1HB       LYS  78   9.713   4.626   4.626
  612   1HG   LYS  78          2HG       LYS  78   7.151   4.412   4.412
  613   2HG   LYS  78          1HG       LYS  78   7.903   2.826   2.826
  614   1HD   LYS  78          2HD       LYS  78   9.585   3.321   3.321
  615   2HD   LYS  78          1HD       LYS  78   9.675   5.004   5.004
  616   1HE   LYS  78          2HE       LYS  78   7.229   4.911   4.911
  617   2HE   LYS  78          1HE       LYS  78   8.169   3.787   3.787
  618   1HZ   LYS  78          1HZ       LYS  78   9.374   6.371   6.371
  619   2HZ   LYS  78          3HZ       LYS  78   8.146   6.349   6.349
  620   3HZ   LYS  78          2HZ       LYS  78   9.545   5.427   5.427
  621    H    LYS  79           H        LYS  79   7.611   5.034   5.034
  622    HA   LYS  79           HA       LYS  79  10.063   6.439   6.439
  623   1HB   LYS  79          2HB       LYS  79   9.682   4.055   4.055
  624   2HB   LYS  79          1HB       LYS  79   8.355   4.633   4.633
  625   1HG   LYS  79          2HG       LYS  79  10.026   6.152   6.152
  626   2HG   LYS  79          1HG       LYS  79  11.282   5.246   5.246
  627   1HD   LYS  79          2HD       LYS  79  10.600   3.202   3.202
  628   2HD   LYS  79          1HD       LYS  79   9.213   4.006   4.006
  629   1HE   LYS  79          2HE       LYS  79  11.120   3.678   3.678
  630   2HE   LYS  79          1HE       LYS  79  10.647   5.365   5.365
  631   1HZ   LYS  79          2HZ       LYS  79  12.741   4.351   4.351
  632   2HZ   LYS  79          1HZ       LYS  79  13.151   4.573   4.573
  633   3HZ   LYS  79          3HZ       LYS  79  12.571   5.875   5.875
  634    H    PHE  80           H        PHE  80   6.587   6.488   6.488
  635    HA   PHE  80           HA       PHE  80   6.889   8.859   8.859
  636   1HB   PHE  80          2HB       PHE  80   4.466   7.067   7.067
  637   2HB   PHE  80          1HB       PHE  80   4.779   8.344   8.344
  638    HD1  PHE  80           HD2      PHE  80   5.567   4.923   4.923
  639    HD2  PHE  80           HD1      PHE  80   6.310   8.002   8.002
  640    HE1  PHE  80           HE2      PHE  80   6.604   3.276   3.276
  641    HE2  PHE  80           HE1      PHE  80   7.351   6.362   6.362
  642    HZ   PHE  80           HZ       PHE  80   7.500   3.997   3.997
  643    H    ALA  81           H        ALA  81   5.747   7.726   7.726
  644    HA   ALA  81           HA       ALA  81   4.846   8.848   8.848
  645   1HB   ALA  81          3HB       ALA  81   6.130  10.826  10.826
  646   2HB   ALA  81          2HB       ALA  81   4.471  11.410  11.410
  647   3HB   ALA  81          1HB       ALA  81   5.169  11.078  11.078
  648    H    CYS  82           H        CYS  82   3.295   7.554   7.554
  649    HA   CYS  82           HA       CYS  82   0.773   9.053   9.053
  650   1HB   CYS  82          2HB       CYS  82   1.374   6.666   6.666
  651   2HB   CYS  82          1HB       CYS  82   0.011   7.771   7.771
  652    HG   CYS  82           HG       CYS  82   2.922   8.489   8.489
  653    H    ASN  83           H        ASN  83  -1.023   6.986   6.986
  654    HA   ASN  83           HA       ASN  83  -0.675   5.376   5.376
  655   1HB   ASN  83          2HB       ASN  83  -2.424   6.672   6.672
  656   2HB   ASN  83          1HB       ASN  83  -2.938   7.037   7.037
  657   1HD2  ASN  83          2HD2      ASN  83  -5.101   4.270   4.270
  658   2HD2  ASN  83          1HD2      ASN  83  -4.086   5.351   5.351
  659    H    GLY  84           H        GLY  84  -0.481   3.286   3.286
  660   1HA   GLY  84          2HA       GLY  84  -1.703   2.223   2.223
  661   2HA   GLY  84          1HA       GLY  84  -0.260   1.568   1.568
  662    H    THR  85           H        THR  85  -3.459   1.035   1.035
  663    HA   THR  85           HA       THR  85  -3.643  -0.631  -0.631
  664    HB   THR  85           HB       THR  85  -6.088  -0.272  -0.272
  665    HG1  THR  85           HG1      THR  85  -6.252   0.268   0.268
  666   1HG2  THR  85          1HG2      THR  85  -4.151   1.753   1.753
  667   2HG2  THR  85          3HG2      THR  85  -5.680   2.474   2.474
  668   3HG2  THR  85          2HG2      THR  85  -5.646   1.322   1.322
  669    H    VAL  86           H        VAL  86  -4.471  -2.687  -2.687
  670    HA   VAL  86           HA       VAL  86  -4.611  -3.698  -3.698
  671    HB   VAL  86           HB       VAL  86  -4.792  -5.661  -5.661
  672   1HG1  VAL  86          3HG1      VAL  86  -4.143  -5.687  -5.687
  673   2HG1  VAL  86          2HG1      VAL  86  -2.531  -5.631  -5.631
  674   3HG1  VAL  86          1HG1      VAL  86  -3.638  -6.938  -6.938
  675   1HG2  VAL  86          2HG2      VAL  86  -2.548  -3.711  -3.711
  676   2HG2  VAL  86          1HG2      VAL  86  -3.372  -4.499  -4.499
  677   3HG2  VAL  86          3HG2      VAL  86  -2.220  -5.404  -5.404
  678    H    ILE  87           H        ILE  87  -6.656  -3.436  -3.436
  679    HA   ILE  87           HA       ILE  87  -8.839  -4.448  -4.448
  680    HB   ILE  87           HB       ILE  87 -10.323  -2.902  -2.902
  681   1HG1  ILE  87          2HG1      ILE  87 -10.038  -3.362  -3.362
  682   2HG1  ILE  87          1HG1      ILE  87 -10.046  -1.626  -1.626
  683   1HG2  ILE  87          2HG2      ILE  87  -8.004  -1.938  -1.938
  684   2HG2  ILE  87          1HG2      ILE  87  -8.126  -1.032  -1.032
  685   3HG2  ILE  87          3HG2      ILE  87  -9.434  -0.962  -0.962
  686   1HD1  ILE  87          3HD1      ILE  87  -7.402  -2.125  -2.125
  687   2HD1  ILE  87          2HD1      ILE  87  -7.922  -3.363  -3.363
  688   3HD1  ILE  87          1HD1      ILE  87  -8.265  -1.665  -1.665
  689    H    GLU  88           H        GLU  88 -10.560  -5.603  -5.603
  690    HA   GLU  88           HA       GLU  88  -9.610  -7.189  -7.189
  691   1HB   GLU  88          2HB       GLU  88 -10.651  -8.048  -8.048
  692   2HB   GLU  88          1HB       GLU  88 -12.139  -7.887  -7.887
  693   1HG   GLU  88          2HG       GLU  88 -11.485  -9.482  -9.482
  694   2HG   GLU  88          1HG       GLU  88  -9.788  -9.377  -9.377
  695    H    HIS  89           H        HIS  89 -10.038  -5.341  -5.341
  696    HA   HIS  89           HA       HIS  89 -12.441  -4.112  -4.112
  697   1HB   HIS  89          2HB       HIS  89 -10.050  -3.954  -3.954
  698   2HB   HIS  89          1HB       HIS  89 -10.846  -4.939  -4.939
  699    HD1  HIS  89           HD1      HIS  89 -12.215  -3.722  -3.722
  700    HD2  HIS  89           HD2      HIS  89 -11.424  -1.406  -1.406
  701    HE1  HIS  89           HE1      HIS  89 -13.122  -1.438  -1.438
  702    HE2  HIS  89           HE2      HIS  89 -12.552  -0.029  -0.029
  703    HA   PRO  90           HA       PRO  90 -15.068  -7.356  -7.356
  704   1HB   PRO  90          2HB       PRO  90 -17.118  -5.877  -5.877
  705   2HB   PRO  90          1HB       PRO  90 -16.766  -6.019  -6.019
  706   1HG   PRO  90          2HG       PRO  90 -16.099  -3.799  -3.799
  707   2HG   PRO  90          1HG       PRO  90 -16.707  -3.707  -3.707
  708   1HD   PRO  90          2HD       PRO  90 -14.070  -3.391  -3.391
  709   2HD   PRO  90          1HD       PRO  90 -14.619  -3.955  -3.955
  710    H    GLU  91           H        GLU  91 -13.862  -4.797  -4.797
  711    HA   GLU  91           HA       GLU  91 -14.862  -5.898  -5.898
  712   1HB   GLU  91          2HB       GLU  91 -13.751  -3.438  -3.438
  713   2HB   GLU  91          1HB       GLU  91 -12.699  -4.067  -4.067
  714   1HG   GLU  91          2HG       GLU  91 -15.641  -4.050  -4.050
  715   2HG   GLU  91          1HG       GLU  91 -14.738  -2.540  -2.540
  716    H    TYR  92           H        TYR  92 -12.054  -6.272  -6.272
  717    HA   TYR  92           HA       TYR  92 -10.783  -7.870  -7.870
  718   1HB   TYR  92          2HB       TYR  92  -9.224  -6.716  -6.716
  719   2HB   TYR  92          1HB       TYR  92  -8.668  -7.173  -7.173
  720    HD1  TYR  92           HD1      TYR  92 -10.572  -5.762  -5.762
  721    HD2  TYR  92           HD2      TYR  92  -8.653  -4.464  -4.464
  722    HE1  TYR  92           HE1      TYR  92 -10.796  -3.430  -3.430
  723    HE2  TYR  92           HE2      TYR  92  -8.867  -2.126  -2.126
  724    HH   TYR  92           HH       TYR  92  -9.095  -0.972  -0.972
  725    H    GLY  93           H        GLY  93 -11.137  -7.584  -7.584
  726   1HA   GLY  93          2HA       GLY  93 -11.987  -9.576  -9.576
  727   2HA   GLY  93          1HA       GLY  93 -10.945 -10.532 -10.532
  728    H    GLU  94           H        GLU  94  -8.918  -8.193  -8.193
  729    HA   GLU  94           HA       GLU  94  -8.169  -8.101  -8.101
  730   1HB   GLU  94          2HB       GLU  94  -7.887 -10.524 -10.524
  731   2HB   GLU  94          1HB       GLU  94  -6.824 -10.345 -10.345
  732   1HG   GLU  94          2HG       GLU  94  -5.065  -9.611  -9.611
  733   2HG   GLU  94          1HG       GLU  94  -6.104  -8.965  -8.965
  734    H    VAL  95           H        VAL  95  -7.150  -6.197  -6.197
  735    HA   VAL  95           HA       VAL  95  -4.760  -5.977  -5.977
  736    HB   VAL  95           HB       VAL  95  -5.467  -3.896  -3.896
  737   1HG1  VAL  95          1HG1      VAL  95  -5.633  -6.144  -6.144
  738   2HG1  VAL  95          3HG1      VAL  95  -7.338  -6.172  -6.172
  739   3HG1  VAL  95          2HG1      VAL  95  -6.736  -4.934  -4.934
  740   1HG2  VAL  95          2HG2      VAL  95  -7.231  -3.264  -3.264
  741   2HG2  VAL  95          1HG2      VAL  95  -7.806  -3.262  -3.262
  742   3HG2  VAL  95          3HG2      VAL  95  -8.224  -4.596  -4.596
  743    H    ILE  96           H        ILE  96  -3.483  -4.102  -4.102
  744    HA   ILE  96           HA       ILE  96  -3.935  -3.203  -3.203
  745    HB   ILE  96           HB       ILE  96  -1.587  -3.567  -3.567
  746   1HG1  ILE  96          2HG1      ILE  96  -2.213  -4.774  -4.774
  747   2HG1  ILE  96          1HG1      ILE  96  -0.557  -4.181  -4.181
  748   1HG2  ILE  96          3HG2      ILE  96  -1.728  -1.109  -1.109
  749   2HG2  ILE  96          2HG2      ILE  96  -0.236  -1.799  -1.799
  750   3HG2  ILE  96          1HG2      ILE  96  -1.456  -1.168  -1.168
  751   1HD1  ILE  96          3HD1      ILE  96  -2.026  -2.121  -2.121
  752   2HD1  ILE  96          2HD1      ILE  96  -2.616  -3.608  -3.608
  753   3HD1  ILE  96          1HD1      ILE  96  -0.899  -3.224  -3.224
  754    H    GLN  97           H        GLN  97  -4.825  -1.320  -1.320
  755    HA   GLN  97           HA       GLN  97  -5.146   0.627   0.627
  756   1HB   GLN  97          2HB       GLN  97  -6.797  -0.281  -0.281
  757   2HB   GLN  97          1HB       GLN  97  -6.470   1.420   1.420
  758   1HG   GLN  97          2HG       GLN  97  -7.218   1.896   1.896
  759   2HG   GLN  97          1HG       GLN  97  -7.680   0.200   0.200
  760   1HE2  GLN  97          2HE2      GLN  97  -9.751   2.454   2.454
  761   2HE2  GLN  97          1HE2      GLN  97  -8.042   2.637   2.637
  762    H    LEU  98           H        LEU  98  -3.765   2.242   2.242
  763    HA   LEU  98           HA       LEU  98  -2.386   3.194   3.194
  764   1HB   LEU  98          2HB       LEU  98  -1.684   3.932   3.932
  765   2HB   LEU  98          1HB       LEU  98  -0.685   4.050   4.050
  766    HG   LEU  98           HG       LEU  98  -1.562   1.328   1.328
  767   1HD1  LEU  98          3HD1      LEU  98  -0.931   2.582   2.582
  768   2HD1  LEU  98          2HD1      LEU  98   0.706   2.615   2.615
  769   3HD1  LEU  98          1HD1      LEU  98  -0.087   1.072   1.072
  770   1HD2  LEU  98          1HD2      LEU  98  -0.028   2.085   2.085
  771   2HD2  LEU  98          3HD2      LEU  98   0.450   0.691   0.691
  772   3HD2  LEU  98          2HD2      LEU  98   1.200   2.262   2.262
  773    H    GLN  99           H        GLN  99  -2.104   5.525   5.525
  774    HA   GLN  99           HA       GLN  99  -4.517   6.933   6.933
  775   1HB   GLN  99          2HB       GLN  99  -3.007   6.893   6.893
  776   2HB   GLN  99          1HB       GLN  99  -2.932   8.524   8.524
  777   1HG   GLN  99          2HG       GLN  99  -5.606   7.356   7.356
  778   2HG   GLN  99          1HG       GLN  99  -4.933   7.523   7.523
  779   1HE2  GLN  99          2HE2      GLN  99  -6.058  10.769  10.769
  780   2HE2  GLN  99          1HE2      GLN  99  -6.013   9.187   9.187
  781    H    GLY 100           H        GLY 100  -4.486   8.555   8.555
  782   1HA   GLY 100          2HA       GLY 100  -3.586  10.423  10.423
  783   2HA   GLY 100          1HA       GLY 100  -1.987   9.960   9.960
  784    H    ASP 101           H        ASP 101  -2.481  10.720  10.720
  785    HA   ASP 101           HA       ASP 101  -2.919   8.508   8.508
  786   1HB   ASP 101          2HB       ASP 101  -1.832  10.005  10.005
  787   2HB   ASP 101          1HB       ASP 101  -3.238  10.683  10.683
  788    H    GLN 102           H        GLN 102  -1.544   6.930   6.930
  789    HA   GLN 102           HA       GLN 102   1.315   7.269   7.269
  790   1HB   GLN 102          2HB       GLN 102  -0.311   4.868   4.868
  791   2HB   GLN 102          1HB       GLN 102   1.432   5.034   5.034
  792   1HG   GLN 102          2HG       GLN 102  -0.727   6.504   6.504
  793   2HG   GLN 102          1HG       GLN 102   0.554   5.490   5.490
  794   1HE2  GLN 102          2HE2      GLN 102   1.211   9.400   9.400
  795   2HE2  GLN 102          1HE2      GLN 102  -0.207   8.570   8.570
  796    H    ARG 103           H        ARG 103  -0.938   6.583   6.583
  797    HA   ARG 103           HA       ARG 103  -0.333   4.306   4.306
  798   1HB   ARG 103          2HB       ARG 103  -1.005   5.384   5.384
  799   2HB   ARG 103          1HB       ARG 103  -1.993   6.002   6.002
  800   1HG   ARG 103          2HG       ARG 103  -1.400   8.077   8.077
  801   2HG   ARG 103          1HG       ARG 103   0.305   7.669   7.669
  802   1HD   ARG 103          2HD       ARG 103   0.590   7.920   7.920
  803   2HD   ARG 103          1HD       ARG 103  -0.537   6.596   6.596
  804    HE   ARG 103           HE       ARG 103  -2.048   8.137   8.137
  805   1HH1  ARG 103          2HH1      ARG 103   0.244   9.752   9.752
  806   2HH1  ARG 103          1HH1      ARG 103  -0.437  11.323  11.323
  807   1HH2  ARG 103          1HH2      ARG 103  -2.946  10.202  10.202
  808   2HH2  ARG 103          2HH2      ARG 103  -2.249  11.578  11.578
  809    H    LYS 104           H        LYS 104   1.723   7.105   7.105
  810    HA   LYS 104           HA       LYS 104   3.668   5.919   5.919
  811   1HB   LYS 104          2HB       LYS 104   2.797   8.505   8.505
  812   2HB   LYS 104          1HB       LYS 104   4.283   8.552   8.552
  813   1HG   LYS 104          2HG       LYS 104   3.986   7.684   7.684
  814   2HG   LYS 104          1HG       LYS 104   4.745   9.164   9.164
  815   1HD   LYS 104          2HD       LYS 104   5.701   6.374   6.374
  816   2HD   LYS 104          1HD       LYS 104   6.373   7.399   7.399
  817   1HE   LYS 104          2HE       LYS 104   6.241   8.222   8.222
  818   2HE   LYS 104          1HE       LYS 104   7.629   7.397   7.397
  819   1HZ   LYS 104          2HZ       LYS 104   7.720   9.251   9.251
  820   2HZ   LYS 104          1HZ       LYS 104   6.557  10.064  10.064
  821   3HZ   LYS 104          3HZ       LYS 104   8.069   9.707   9.707
  822    H    ASN 105           H        ASN 105   3.079   6.575   6.575
  823    HA   ASN 105           HA       ASN 105   5.874   6.216   6.216
  824   1HB   ASN 105          2HB       ASN 105   3.387   7.051   7.051
  825   2HB   ASN 105          1HB       ASN 105   4.646   6.289   6.289
  826   1HD2  ASN 105          2HD2      ASN 105   4.926  10.121  10.121
  827   2HD2  ASN 105          1HD2      ASN 105   3.500   9.160   9.160
  828    H    ILE 106           H        ILE 106   2.812   4.456   4.456
  829    HA   ILE 106           HA       ILE 106   3.741   2.366   2.366
  830    HB   ILE 106           HB       ILE 106   1.335   2.827   2.827
  831   1HG1  ILE 106          2HG1      ILE 106   0.651   0.517   0.517
  832   2HG1  ILE 106          1HG1      ILE 106   2.166  -0.014  -0.014
  833   1HG2  ILE 106          1HG2      ILE 106   1.622   3.088   3.088
  834   2HG2  ILE 106          3HG2      ILE 106   1.821   1.342   1.342
  835   3HG2  ILE 106          2HG2      ILE 106   0.298   2.021   2.021
  836   1HD1  ILE 106          3HD1      ILE 106   2.336   1.533   1.533
  837   2HD1  ILE 106          2HD1      ILE 106   1.703  -0.109  -0.109
  838   3HD1  ILE 106          1HD1      ILE 106   3.310   0.179   0.179
  839    H    CYS 107           H        CYS 107   3.493   2.594   2.594
  840    HA   CYS 107           HA       CYS 107   4.551   0.077   0.077
  841   1HB   CYS 107          2HB       CYS 107   5.333   1.217   1.217
  842   2HB   CYS 107          1HB       CYS 107   3.613   1.340   1.340
  843    HG   CYS 107           HG       CYS 107   4.853   3.655   3.655
  844    H    GLN 108           H        GLN 108   6.008   3.076   3.076
  845    HA   GLN 108           HA       GLN 108   8.726   2.403   2.403
  846   1HB   GLN 108          2HB       GLN 108   7.260   4.522   4.522
  847   2HB   GLN 108          1HB       GLN 108   8.909   4.222   4.222
  848   1HG   GLN 108          2HG       GLN 108   8.066   4.883   4.883
  849   2HG   GLN 108          1HG       GLN 108   8.736   6.023   6.023
  850   1HE2  GLN 108          2HE2      GLN 108  11.930   4.134   4.134
  851   2HE2  GLN 108          1HE2      GLN 108  10.722   4.466   4.466
  852    H    PHE 109           H        PHE 109   6.685   2.359   2.359
  853    HA   PHE 109           HA       PHE 109   8.565   1.400   1.400
  854   1HB   PHE 109          2HB       PHE 109   6.385   2.372   2.372
  855   2HB   PHE 109          1HB       PHE 109   5.572   0.960   0.960
  856    HD1  PHE 109           HD2      PHE 109   8.175   1.867   1.867
  857    HD2  PHE 109           HD1      PHE 109   5.014  -0.763  -0.763
  858    HE1  PHE 109           HE2      PHE 109   8.347   0.758   0.758
  859    HE2  PHE 109           HE1      PHE 109   5.180  -1.875  -1.875
  860    HZ   PHE 109           HZ       PHE 109   6.847  -1.113  -1.113
  861    H    LEU 110           H        LEU 110   6.142  -0.363  -0.363
  862    HA   LEU 110           HA       LEU 110   6.677  -2.933  -2.933
  863   1HB   LEU 110          2HB       LEU 110   5.590  -1.773  -1.773
  864   2HB   LEU 110          1HB       LEU 110   6.007  -3.475  -3.475
  865    HG   LEU 110           HG       LEU 110   4.403  -3.955  -3.955
  866   1HD1  LEU 110          3HD1      LEU 110   4.835  -1.933  -1.933
  867   2HD1  LEU 110          2HD1      LEU 110   3.869  -0.998  -0.998
  868   3HD1  LEU 110          1HD1      LEU 110   3.119  -2.287  -2.287
  869   1HD2  LEU 110          2HD2      LEU 110   3.693  -3.266  -3.266
  870   2HD2  LEU 110          1HD2      LEU 110   2.502  -3.692  -3.692
  871   3HD2  LEU 110          3HD2      LEU 110   2.833  -1.997  -1.997
  872    H    VAL 111           H        VAL 111   8.436  -0.922  -0.922
  873    HA   VAL 111           HA       VAL 111  10.178  -3.123  -3.123
  874    HB   VAL 111           HB       VAL 111  10.185  -0.220  -0.220
  875   1HG1  VAL 111          3HG1      VAL 111  12.055  -2.417  -2.417
  876   2HG1  VAL 111          2HG1      VAL 111  11.499  -1.629  -1.629
  877   3HG1  VAL 111          1HG1      VAL 111  12.270  -0.679  -0.679
  878   1HG2  VAL 111          1HG2      VAL 111   8.347  -2.131  -2.131
  879   2HG2  VAL 111          3HG2      VAL 111   8.747  -0.723  -0.723
  880   3HG2  VAL 111          2HG2      VAL 111   9.515  -2.276  -2.276
  881    H    GLU 112           H        GLU 112  10.136  -0.341  -0.341
  882    HA   GLU 112           HA       GLU 112  12.964  -0.187  -0.187
  883   1HB   GLU 112          2HB       GLU 112  10.614   0.954   0.954
  884   2HB   GLU 112          1HB       GLU 112  12.277   1.218   1.218
  885   1HG   GLU 112          2HG       GLU 112  11.719   1.819   1.819
  886   2HG   GLU 112          1HG       GLU 112  10.900   2.851   2.851
  887    H    ILE 113           H        ILE 113  10.284  -1.684  -1.684
  888    HA   ILE 113           HA       ILE 113  12.098  -2.718  -2.718
  889    HB   ILE 113           HB       ILE 113  10.182  -3.504  -3.504
  890   1HG1  ILE 113          2HG1      ILE 113   8.619  -2.959  -2.959
  891   2HG1  ILE 113          1HG1      ILE 113   8.967  -4.538  -4.538
  892   1HG2  ILE 113          2HG2      ILE 113  10.621  -0.936  -0.936
  893   2HG2  ILE 113          1HG2      ILE 113   9.044  -1.007  -1.007
  894   3HG2  ILE 113          3HG2      ILE 113   9.211  -1.503  -1.503
  895   1HD1  ILE 113          2HD1      ILE 113   7.644  -2.854  -2.854
  896   2HD1  ILE 113          1HD1      ILE 113   6.716  -2.967  -2.967
  897   3HD1  ILE 113          3HD1      ILE 113   7.174  -4.433  -4.433
  898    H    GLY 114           H        GLY 114  10.498  -3.786  -3.786
  899   1HA   GLY 114          2HA       GLY 114  11.260  -5.689  -5.689
  900   2HA   GLY 114          1HA       GLY 114  11.805  -6.400  -6.400
  901    H    LEU 115           H        LEU 115   8.677  -4.901  -4.901
  902    HA   LEU 115           HA       LEU 115   7.367  -7.330  -7.330
  903   1HB   LEU 115          2HB       LEU 115   6.836  -4.644  -4.644
  904   2HB   LEU 115          1HB       LEU 115   5.666  -5.132  -5.132
  905    HG   LEU 115           HG       LEU 115   4.634  -6.676  -6.676
  906   1HD1  LEU 115          3HD1      LEU 115   7.097  -6.316  -6.316
  907   2HD1  LEU 115          2HD1      LEU 115   5.587  -6.850  -6.850
  908   3HD1  LEU 115          1HD1      LEU 115   6.325  -7.804  -7.804
  909   1HD2  LEU 115          2HD2      LEU 115   4.583  -4.022  -4.022
  910   2HD2  LEU 115          1HD2      LEU 115   3.604  -5.184  -5.184
  911   3HD2  LEU 115          3HD2      LEU 115   5.116  -4.587  -4.587
  912    H    ALA 116           H        ALA 116   6.583  -5.128  -5.128
  913    HA   ALA 116           HA       ALA 116   5.586  -7.398  -7.398
  914   1HB   ALA 116          2HB       ALA 116   4.395  -5.126  -5.126
  915   2HB   ALA 116          1HB       ALA 116   5.552  -4.555  -4.555
  916   3HB   ALA 116          3HB       ALA 116   4.450  -5.872  -5.872
  917    H    LYS 117           H        LYS 117   6.030  -6.562  -6.562
  918    HA   LYS 117           HA       LYS 117   8.960  -6.427  -6.427
  919   1HB   LYS 117          2HB       LYS 117   7.431  -8.685  -8.685
  920   2HB   LYS 117          1HB       LYS 117   7.736  -7.966  -7.966
  921   1HG   LYS 117          2HG       LYS 117   9.530  -9.382  -9.382
  922   2HG   LYS 117          1HG       LYS 117  10.195  -7.848  -7.848
  923   1HD   LYS 117          2HD       LYS 117   8.903  -9.447  -9.447
  924   2HD   LYS 117          1HD       LYS 117  10.318 -10.210 -10.210
  925   1HE   LYS 117          2HE       LYS 117  11.748  -8.675  -8.675
  926   2HE   LYS 117          1HE       LYS 117  10.590  -7.355  -7.355
  927   1HZ   LYS 117          3HZ       LYS 117  10.371  -9.479  -9.479
  928   2HZ   LYS 117          2HZ       LYS 117  11.161  -8.007  -8.007
  929   3HZ   LYS 117          1HZ       LYS 117   9.505  -8.027  -8.027
  930    H    ASP 118           H        ASP 118   9.743  -5.577  -5.577
  931    HA   ASP 118           HA       ASP 118   8.310  -3.317  -3.317
  932   1HB   ASP 118          2HB       ASP 118  10.063  -2.997  -2.997
  933   2HB   ASP 118          1HB       ASP 118  10.784  -3.529  -3.529
  934    H    ASP 119           H        ASP 119   8.392  -6.599  -6.599
  935    HA   ASP 119           HA       ASP 119   7.115  -6.056  -6.056
  936   1HB   ASP 119          2HB       ASP 119   8.616  -7.998  -7.998
  937   2HB   ASP 119          1HB       ASP 119   7.504  -8.678  -8.678
  938    H    GLN 120           H        GLN 120   6.163  -6.582  -6.582
  939    HA   GLN 120           HA       GLN 120   3.405  -7.185  -7.185
  940   1HB   GLN 120          2HB       GLN 120   4.539  -7.005  -7.005
  941   2HB   GLN 120          1HB       GLN 120   3.043  -7.778  -7.778
  942   1HG   GLN 120          2HG       GLN 120   4.522  -9.333  -9.333
  943   2HG   GLN 120          1HG       GLN 120   5.860  -8.700  -8.700
  944   1HE2  GLN 120          2HE2      GLN 120   4.118  -9.977  -9.977
  945   2HE2  GLN 120          1HE2      GLN 120   4.454  -8.401  -8.401
  946    H    LEU 121           H        LEU 121   5.255  -4.503  -4.503
  947    HA   LEU 121           HA       LEU 121   3.767  -2.834  -2.834
  948   1HB   LEU 121          2HB       LEU 121   5.623  -2.354  -2.354
  949   2HB   LEU 121          1HB       LEU 121   4.732  -1.009  -1.009
  950    HG   LEU 121           HG       LEU 121   6.556  -2.812  -2.812
  951   1HD1  LEU 121          3HD1      LEU 121   7.060  -0.071  -0.071
  952   2HD1  LEU 121          2HD1      LEU 121   8.116  -0.907  -0.907
  953   3HD1  LEU 121          1HD1      LEU 121   7.855  -1.574  -1.574
  954   1HD2  LEU 121          2HD2      LEU 121   4.802  -0.510  -0.510
  955   2HD2  LEU 121          1HD2      LEU 121   5.238  -1.913  -1.913
  956   3HD2  LEU 121          3HD2      LEU 121   6.374  -0.576  -0.576
  957    H    LYS 122           H        LYS 122   1.566  -3.212  -3.212
  958    HA   LYS 122           HA       LYS 122   0.526  -2.291  -2.291
  959   1HB   LYS 122          2HB       LYS 122  -0.383  -4.263  -4.263
  960   2HB   LYS 122          1HB       LYS 122  -1.653  -3.289  -3.289
  961   1HG   LYS 122          2HG       LYS 122   0.386  -4.829  -4.829
  962   2HG   LYS 122          1HG       LYS 122  -1.199  -5.462  -5.462
  963   1HD   LYS 122          2HD       LYS 122  -2.273  -4.203  -4.203
  964   2HD   LYS 122          1HD       LYS 122  -1.226  -2.808  -2.808
  965   1HE   LYS 122          2HE       LYS 122   0.569  -4.164  -4.164
  966   2HE   LYS 122          1HE       LYS 122  -0.757  -5.203  -5.203
  967   1HZ   LYS 122          3HZ       LYS 122  -1.791  -2.920  -2.920
  968   2HZ   LYS 122          2HZ       LYS 122  -0.174  -2.423  -2.423
  969   3HZ   LYS 122          1HZ       LYS 122  -0.684  -3.708  -3.708
  970    H    VAL 123           H        VAL 123   1.039  -0.072  -0.072
  971    HA   VAL 123           HA       VAL 123  -0.511   1.035   1.035
  972    HB   VAL 123           HB       VAL 123   1.707   1.940   1.940
  973   1HG1  VAL 123          1HG1      VAL 123   1.428   1.651   1.651
  974   2HG1  VAL 123          3HG1      VAL 123   0.406   3.088   3.088
  975   3HG1  VAL 123          2HG1      VAL 123   2.098   3.206   3.206
  976   1HG2  VAL 123          3HG2      VAL 123  -0.424   3.299   3.299
  977   2HG2  VAL 123          2HG2      VAL 123   1.166   4.033   4.033
  978   3HG2  VAL 123          1HG2      VAL 123  -0.073   4.231   4.231
  979    H    HIS 124           H        HIS 124  -2.551   1.673   1.673
  980    HA   HIS 124           HA       HIS 124  -3.632   2.520   2.520
  981   1HB   HIS 124          2HB       HIS 124  -5.069   0.903   0.903
  982   2HB   HIS 124          1HB       HIS 124  -5.785   1.498   1.498
  983    HD1  HIS 124           HD1      HIS 124  -5.045   0.331   0.331
  984    HD2  HIS 124           HD2      HIS 124  -3.513  -1.385  -1.385
  985    HE1  HIS 124           HE1      HIS 124  -4.134  -1.905  -1.905
  986    HE2  HIS 124           HE2      HIS 124  -3.152  -2.897  -2.897
  987    H    GLY 125           H        GLY 125  -2.778   4.586   4.586
  988   1HA   GLY 125          2HA       GLY 125  -4.070   5.716   5.716
  989   2HA   GLY 125          1HA       GLY 125  -3.358   6.633   6.633
  990    H    PHE 126           HN       PHE 126  -6.128   6.190   6.190
  991    HA   PHE 126           HA       PHE 126  -8.200   5.959   5.959
  992   1HB   PHE 126          2HB       PHE 126  -9.574   6.784   6.784
  993   2HB   PHE 126          1HB       PHE 126  -8.155   6.354   6.354
  994    HD1  PHE 126           HD1      PHE 126  -6.355   8.603   8.603
  995    HD2  PHE 126           HD2      PHE 126 -10.547   8.550   8.550
  996    HE1  PHE 126           HE1      PHE 126  -6.231  10.907  10.907
  997    HE2  PHE 126           HE2      PHE 126 -10.432  10.854  10.854
  998    HZ   PHE 126           HZ       PHE 126  -8.272  12.036  12.036

  Start of MODEL   27
    1   1H    MET   1          1H        MET   1  14.087  11.281  11.281
    2   2H    MET   1          3H        MET   1  15.377  10.245  10.245
    3   3H    MET   1          2H        MET   1  14.071  10.498  10.498
    4    HA   MET   1           HA       MET   1  13.697   8.440   8.440
    5   1HB   MET   1          2HB       MET   1  15.379   9.117   9.117
    6   2HB   MET   1          1HB       MET   1  13.904   9.496   9.496
    7   1HG   MET   1          2HG       MET   1  14.383   6.831   6.831
    8   2HG   MET   1          1HG       MET   1  14.875   7.197   7.197
    9   1HE   MET   1          3HE       MET   1  12.647   5.185   5.185
   10   2HE   MET   1          2HE       MET   1  10.978   5.549   5.549
   11   3HE   MET   1          1HE       MET   1  11.821   6.557   6.557
   12    H    ARG   2           H        ARG   2  11.609   8.404   8.404
   13    HA   ARG   2           HA       ARG   2   9.722  10.162  10.162
   14   1HB   ARG   2          2HB       ARG   2   9.859   8.974   8.974
   15   2HB   ARG   2          1HB       ARG   2   8.262   8.913   8.913
   16   1HG   ARG   2          2HG       ARG   2   9.930  11.391  11.391
   17   2HG   ARG   2          1HG       ARG   2   8.539  10.907  10.907
   18   1HD   ARG   2          2HD       ARG   2   7.493  10.821  10.821
   19   2HD   ARG   2          1HD       ARG   2   8.650  12.143  12.143
   20    HE   ARG   2           HE       ARG   2   7.053  12.406  12.406
   21   1HH1  ARG   2          2HH1      ARG   2   7.034  12.883  12.883
   22   2HH1  ARG   2          1HH1      ARG   2   5.840  14.134  14.134
   23   1HH2  ARG   2          1HH2      ARG   2   5.482  14.053  14.053
   24   2HH2  ARG   2          2HH2      ARG   2   4.957  14.799  14.799
   25    H    GLY   3           H        GLY   3   9.711   8.905   8.905
   26   1HA   GLY   3          2HA       GLY   3   8.403   6.275   6.275
   27   2HA   GLY   3          1HA       GLY   3   9.352   6.801   6.801
   28    H    SER   4           H        SER   4   8.314   7.633   7.633
   29    HA   SER   4           HA       SER   4   5.705   8.866   8.866
   30   1HB   SER   4          2HB       SER   4   5.435   6.312   6.312
   31   2HB   SER   4          1HB       SER   4   5.942   6.603   6.603
   32    HG   SER   4           HG       SER   4   3.667   6.676   6.676
   33    H    HIS   5           H        HIS   5   4.900   9.071   9.071
   34    HA   HIS   5           HA       HIS   5   7.180  10.076  10.076
   35   1HB   HIS   5          2HB       HIS   5   5.740  12.127  12.127
   36   2HB   HIS   5          1HB       HIS   5   6.504  12.079  12.079
   37    HD1  HIS   5           HD1      HIS   5   3.250  12.380  12.380
   38    HD2  HIS   5           HD2      HIS   5   4.662  11.396  11.396
   39    HE1  HIS   5           HE1      HIS   5   1.265  12.578  12.578
   40    HE2  HIS   5           HE2      HIS   5   2.124  11.894  11.894
   41    H    HIS   6           H        HIS   6   7.070   8.896   8.896
   42    HA   HIS   6           HA       HIS   6   4.632   8.990   8.990
   43   1HB   HIS   6          2HB       HIS   6   5.863   6.461   6.461
   44   2HB   HIS   6          1HB       HIS   6   4.972   6.457   6.457
   45    HD1  HIS   6           HD1      HIS   6   2.430   6.627   6.627
   46    HD2  HIS   6           HD2      HIS   6   4.289   6.936   6.936
   47    HE1  HIS   6           HE1      HIS   6   0.581   6.454   6.454
   48    HE2  HIS   6           HE2      HIS   6   1.738   6.576   6.576
   49    H    HIS   7           H        HIS   7   7.145  10.260  10.260
   50    HA   HIS   7           HA       HIS   7   8.678  10.720  10.720
   51   1HB   HIS   7          2HB       HIS   7   6.605  10.312  10.312
   52   2HB   HIS   7          1HB       HIS   7   7.276   8.716   8.716
   53    HD1  HIS   7           HD1      HIS   7  10.115  10.797  10.797
   54    HD2  HIS   7           HD2      HIS   7   7.152  10.226  10.226
   55    HE1  HIS   7           HE1      HIS   7  11.086  11.653  11.653
   56    HE2  HIS   7           HE2      HIS   7   9.245  11.377  11.377
   57    H    HIS   8           H        HIS   8  10.144   9.563   9.563
   58    HA   HIS   8           HA       HIS   8  11.070   6.991   6.991
   59   1HB   HIS   8          2HB       HIS   8  10.754   8.013   8.013
   60   2HB   HIS   8          1HB       HIS   8  12.409   7.479   7.479
   61    HD1  HIS   8           HD1      HIS   8  12.501   4.935   4.935
   62    HD2  HIS   8           HD2      HIS   8   9.118   6.005   6.005
   63    HE1  HIS   8           HE1      HIS   8  11.381   2.768   2.768
   64    HE2  HIS   8           HE2      HIS   8   9.389   3.438   3.438
   65    H    HIS   9           H        HIS   9  11.675   9.614   9.614
   66    HA   HIS   9           HA       HIS   9  14.452  10.114  10.114
   67   1HB   HIS   9          2HB       HIS   9  12.460  11.739  11.739
   68   2HB   HIS   9          1HB       HIS   9  13.305  11.399  11.399
   69    HD1  HIS   9           HD1      HIS   9  13.703  14.120  14.120
   70    HD2  HIS   9           HD2      HIS   9  15.874  11.521  11.521
   71    HE1  HIS   9           HE1      HIS   9  15.643  15.466  15.466
   72    HE2  HIS   9           HE2      HIS   9  16.893  13.898  13.898
   73    H    HIS  10           H        HIS  10  16.142  10.101  10.101
   74    HA   HIS  10           HA       HIS  10  15.845   7.812   7.812
   75   1HB   HIS  10          2HB       HIS  10  18.435   9.215   9.215
   76   2HB   HIS  10          1HB       HIS  10  18.188   7.562   7.562
   77    HD1  HIS  10           HD1      HIS  10  15.882   7.132   7.132
   78    HD2  HIS  10           HD2      HIS  10  19.842   8.277   8.277
   79    HE1  HIS  10           HE1      HIS  10  16.458   6.504   6.504
   80    HE2  HIS  10           HE2      HIS  10  18.830   7.288   7.288
   81    H    THR  11           H        THR  11  17.350   8.046   8.046
   82    HA   THR  11           HA       THR  11  17.573  10.651  10.651
   83    HB   THR  11           HB       THR  11  15.926   9.549   9.549
   84    HG1  THR  11           HG1      THR  11  14.078   8.912   8.912
   85   1HG2  THR  11          3HG2      THR  11  15.427  11.619  11.619
   86   2HG2  THR  11          2HG2      THR  11  14.195  11.184  11.184
   87   3HG2  THR  11          1HG2      THR  11  15.744  11.834  11.834
   88    H    ASP  12           H        ASP  12  17.268   7.185   7.185
   89    HA   ASP  12           HA       ASP  12  19.726   7.383   7.383
   90   1HB   ASP  12          2HB       ASP  12  18.729   5.697   5.697
   91   2HB   ASP  12          1HB       ASP  12  17.992   7.295   7.295
   92    HA   PRO  13           HA       PRO  13  20.108   4.040   4.040
   93   1HB   PRO  13          2HB       PRO  13  22.742   4.491   4.491
   94   2HB   PRO  13          1HB       PRO  13  21.446   5.378   5.378
   95   1HG   PRO  13          2HG       PRO  13  23.127   6.197   6.197
   96   2HG   PRO  13          1HG       PRO  13  22.635   7.150   7.150
   97   1HD   PRO  13          2HD       PRO  13  21.401   7.367   7.367
   98   2HD   PRO  13          1HD       PRO  13  20.536   7.573   7.573
   99    H    MET  14           H        MET  14  22.062   4.902   4.902
  100    HA   MET  14           HA       MET  14  23.606   2.589   2.589
  101   1HB   MET  14          2HB       MET  14  22.530   4.450   4.450
  102   2HB   MET  14          1HB       MET  14  23.692   3.172   3.172
  103   1HG   MET  14          2HG       MET  14  25.403   4.269   4.269
  104   2HG   MET  14          1HG       MET  14  24.344   5.095   5.095
  105   1HE   MET  14          2HE       MET  14  24.761   7.300   7.300
  106   2HE   MET  14          1HE       MET  14  23.178   7.628   7.628
  107   3HE   MET  14          3HE       MET  14  24.600   8.497   8.497
  108    H    SER  15           H        SER  15  20.245   3.116   3.116
  109    HA   SER  15           HA       SER  15  19.708   1.101   1.101
  110   1HB   SER  15          2HB       SER  15  18.205   2.932   2.932
  111   2HB   SER  15          1HB       SER  15  17.632   1.381   1.381
  112    HG   SER  15           HG       SER  15  16.923   0.840   0.840
  113    H    ALA  16           H        ALA  16  19.939   0.961   0.961
  114    HA   ALA  16           HA       ALA  16  19.988  -1.979  -1.979
  115   1HB   ALA  16          1HB       ALA  16  17.891  -1.235  -1.235
  116   2HB   ALA  16          3HB       ALA  16  18.800  -0.359  -0.359
  117   3HB   ALA  16          2HB       ALA  16  18.889  -2.119  -2.119
  118    H    ILE  17           H        ILE  17  22.253  -2.007  -2.007
  119    HA   ILE  17           HA       ILE  17  23.669  -0.922  -0.922
  120    HB   ILE  17           HB       ILE  17  24.941  -2.178  -2.178
  121   1HG1  ILE  17          2HG1      ILE  17  24.466   0.778   0.778
  122   2HG1  ILE  17          1HG1      ILE  17  23.406  -0.236  -0.236
  123   1HG2  ILE  17          3HG2      ILE  17  25.873  -0.699  -0.699
  124   2HG2  ILE  17          2HG2      ILE  17  26.678  -0.336  -0.336
  125   3HG2  ILE  17          1HG2      ILE  17  26.653  -1.989  -1.989
  126   1HD1  ILE  17          2HD1      ILE  17  26.344  -0.099  -0.099
  127   2HD1  ILE  17          1HD1      ILE  17  25.231   1.111   1.111
  128   3HD1  ILE  17          3HD1      ILE  17  25.035  -0.586  -0.586
  129    H    GLN  18           H        GLN  18  24.004  -2.237  -2.237
  130    HA   GLN  18           HA       GLN  18  23.541  -5.006  -5.006
  131   1HB   GLN  18          2HB       GLN  18  25.084  -3.310  -3.310
  132   2HB   GLN  18          1HB       GLN  18  24.660  -4.994  -4.994
  133   1HG   GLN  18          2HG       GLN  18  22.690  -2.763  -2.763
  134   2HG   GLN  18          1HG       GLN  18  23.141  -3.428  -3.428
  135   1HE2  GLN  18          2HE2      GLN  18  21.284  -6.396  -6.396
  136   2HE2  GLN  18          1HE2      GLN  18  22.644  -5.666  -5.666
  137    H    ASN  19           H        ASN  19  24.904  -6.771  -6.771
  138    HA   ASN  19           HA       ASN  19  27.734  -6.575  -6.575
  139   1HB   ASN  19          2HB       ASN  19  27.697  -7.579  -7.579
  140   2HB   ASN  19          1HB       ASN  19  27.837  -5.853  -5.853
  141   1HD2  ASN  19          2HD2      ASN  19  24.078  -7.132  -7.132
  142   2HD2  ASN  19          1HD2      ASN  19  25.009  -7.966  -7.966
  143    H    LEU  20           H        LEU  20  28.021  -8.313  -8.313
  144    HA   LEU  20           HA       LEU  20  27.664 -10.916 -10.916
  145   1HB   LEU  20          2HB       LEU  20  25.344  -9.996  -9.996
  146   2HB   LEU  20          1HB       LEU  20  26.062 -10.695 -10.695
  147    HG   LEU  20           HG       LEU  20  26.315 -12.848 -12.848
  148   1HD1  LEU  20          3HD1      LEU  20  24.970 -11.230 -11.230
  149   2HD1  LEU  20          2HD1      LEU  20  24.692 -12.969 -12.969
  150   3HD1  LEU  20          1HD1      LEU  20  26.327 -12.348 -12.348
  151   1HD2  LEU  20          1HD2      LEU  20  23.736 -11.569 -11.569
  152   2HD2  LEU  20          3HD2      LEU  20  24.504 -13.010 -13.010
  153   3HD2  LEU  20          2HD2      LEU  20  23.667 -13.093 -13.093
  154    H    HIS  21           H        HIS  21  29.621 -11.601 -11.601
  155    HA   HIS  21           HA       HIS  21  30.189 -11.891 -11.891
  156   1HB   HIS  21          2HB       HIS  21  32.636 -10.961 -10.961
  157   2HB   HIS  21          1HB       HIS  21  31.423 -10.000 -10.000
  158    HD1  HIS  21           HD1      HIS  21  33.228 -10.302 -10.302
  159    HD2  HIS  21           HD2      HIS  21  29.995  -8.182  -8.182
  160    HE1  HIS  21           HE1      HIS  21  32.789  -8.464  -8.464
  161    HE2  HIS  21           HE2      HIS  21  30.894  -7.135  -7.135
  162    H    SER  22           H        SER  22  31.656 -12.160 -12.160
  163    HA   SER  22           HA       SER  22  33.257 -14.407 -14.407
  164   1HB   SER  22          2HB       SER  22  33.753 -14.549 -14.549
  165   2HB   SER  22          1HB       SER  22  33.793 -12.861 -12.861
  166    HG   SER  22           HG       SER  22  32.090 -14.141 -14.141
  167    H    PHE  23           H        PHE  23  32.675 -16.459 -16.459
  168    HA   PHE  23           HA       PHE  23  30.005 -17.282 -17.282
  169   1HB   PHE  23          2HB       PHE  23  30.883 -17.831 -17.831
  170   2HB   PHE  23          1HB       PHE  23  32.114 -18.839 -18.839
  171    HD1  PHE  23           HD2      PHE  23  28.470 -18.456 -18.456
  172    HD2  PHE  23           HD1      PHE  23  31.644 -21.033 -21.033
  173    HE1  PHE  23           HE2      PHE  23  26.913 -20.362 -20.362
  174    HE2  PHE  23           HE1      PHE  23  30.092 -22.942 -22.942
  175    HZ   PHE  23           HZ       PHE  23  27.724 -22.608 -22.608
  176    H    ASP  24           H        ASP  24  29.669 -18.142 -18.142
  177    HA   ASP  24           HA       ASP  24  31.882 -19.545 -19.545
  178   1HB   ASP  24          2HB       ASP  24  30.646 -17.485 -17.485
  179   2HB   ASP  24          1HB       ASP  24  29.392 -18.659 -18.659
  180    HA   PRO  25           HA       PRO  25  29.435 -23.197 -23.197
  181   1HB   PRO  25          2HB       PRO  25  31.625 -24.461 -24.461
  182   2HB   PRO  25          1HB       PRO  25  31.007 -24.867 -24.867
  183   1HG   PRO  25          2HG       PRO  25  33.342 -23.613 -23.613
  184   2HG   PRO  25          1HG       PRO  25  32.243 -23.210 -23.210
  185   1HD   PRO  25          2HD       PRO  25  32.784 -21.721 -21.721
  186   2HD   PRO  25          1HD       PRO  25  32.460 -21.098 -21.098
  187    H    PHE  26           H        PHE  26  30.515 -22.119 -22.119
  188    HA   PHE  26           HA       PHE  26  28.727 -23.991 -23.991
  189   1HB   PHE  26          2HB       PHE  26  30.659 -21.998 -21.998
  190   2HB   PHE  26          1HB       PHE  26  29.812 -23.285 -23.285
  191    HD1  PHE  26           HD1      PHE  26  32.269 -22.700 -22.700
  192    HD2  PHE  26           HD2      PHE  26  30.803 -25.363 -25.363
  193    HE1  PHE  26           HE1      PHE  26  34.146 -24.225 -24.225
  194    HE2  PHE  26           HE2      PHE  26  32.679 -26.893 -26.893
  195    HZ   PHE  26           HZ       PHE  26  34.354 -26.325 -26.325
  196    H    ALA  27           H        ALA  27  27.523 -21.993 -21.993
  197    HA   ALA  27           HA       ALA  27  25.731 -20.864 -20.864
  198   1HB   ALA  27          2HB       ALA  27  27.658 -19.276 -19.276
  199   2HB   ALA  27          1HB       ALA  27  27.362 -18.874 -18.874
  200   3HB   ALA  27          3HB       ALA  27  26.130 -18.536 -18.536
  201    H    ASP  28           H        ASP  28  25.383 -22.592 -22.592
  202    HA   ASP  28           HA       ASP  28  24.047 -20.930 -20.930
  203   1HB   ASP  28          2HB       ASP  28  24.120 -22.941 -22.941
  204   2HB   ASP  28          1HB       ASP  28  25.725 -22.418 -22.418
  205    H    ALA  29           H        ALA  29  23.631 -23.741 -23.741
  206    HA   ALA  29           HA       ALA  29  20.807 -23.202 -23.202
  207   1HB   ALA  29          3HB       ALA  29  21.748 -25.767 -25.767
  208   2HB   ALA  29          2HB       ALA  29  20.101 -25.454 -25.454
  209   3HB   ALA  29          1HB       ALA  29  20.793 -24.496 -24.496
  210    H    SER  30           H        SER  30  19.790 -24.381 -24.381
  211    HA   SER  30           HA       SER  30  21.048 -26.365 -26.365
  212   1HB   SER  30          2HB       SER  30  22.654 -24.775 -24.775
  213   2HB   SER  30          1HB       SER  30  21.430 -23.526 -23.526
  214    HG   SER  30           HG       SER  30  20.695 -24.559 -24.559
  215    H    LYS  31           H        LYS  31  19.538 -27.333 -27.333
  216    HA   LYS  31           HA       LYS  31  16.915 -26.098 -26.098
  217   1HB   LYS  31          2HB       LYS  31  16.141 -28.287 -28.287
  218   2HB   LYS  31          1HB       LYS  31  17.123 -28.443 -28.443
  219   1HG   LYS  31          2HG       LYS  31  19.026 -28.808 -28.808
  220   2HG   LYS  31          1HG       LYS  31  17.630 -29.394 -29.394
  221   1HD   LYS  31          2HD       LYS  31  17.463 -31.251 -31.251
  222   2HD   LYS  31          1HD       LYS  31  17.720 -30.370 -30.370
  223   1HE   LYS  31          2HE       LYS  31  19.835 -31.046 -31.046
  224   2HE   LYS  31          1HE       LYS  31  20.150 -30.440 -30.440
  225   1HZ   LYS  31          1HZ       LYS  31  18.815 -32.658 -32.658
  226   2HZ   LYS  31          3HZ       LYS  31  19.526 -33.139 -33.139
  227   3HZ   LYS  31          2HZ       LYS  31  20.497 -32.617 -32.617
  228    H    GLY  32           H        GLY  32  15.784 -27.026 -27.026
  229   1HA   GLY  32          2HA       GLY  32  16.695 -27.223 -27.223
  230   2HA   GLY  32          1HA       GLY  32  17.268 -25.595 -25.595
  231    H    ASP  33           H        ASP  33  15.056 -24.663 -24.663
  232    HA   ASP  33           HA       ASP  33  13.013 -24.571 -24.571
  233   1HB   ASP  33          2HB       ASP  33  14.257 -22.437 -22.437
  234   2HB   ASP  33          1HB       ASP  33  13.522 -22.470 -22.470
  235    H    ASP  34           H        ASP  34  12.942 -26.654 -26.654
  236    HA   ASP  34           HA       ASP  34  11.028 -25.953 -25.953
  237   1HB   ASP  34          2HB       ASP  34  12.874 -27.611 -27.611
  238   2HB   ASP  34          1HB       ASP  34  12.069 -28.692 -28.692
  239    H    LEU  35           H        LEU  35   9.781 -25.263 -25.263
  240    HA   LEU  35           HA       LEU  35   8.150 -27.517 -27.517
  241   1HB   LEU  35          2HB       LEU  35   9.213 -25.267 -25.267
  242   2HB   LEU  35          1HB       LEU  35   7.486 -24.981 -24.981
  243    HG   LEU  35           HG       LEU  35   8.109 -26.068 -26.068
  244   1HD1  LEU  35          2HD1      LEU  35   5.995 -26.670 -26.670
  245   2HD1  LEU  35          1HD1      LEU  35   6.725 -28.270 -28.270
  246   3HD1  LEU  35          3HD1      LEU  35   6.275 -27.385 -27.385
  247   1HD2  LEU  35          1HD2      LEU  35   9.480 -27.923 -27.923
  248   2HD2  LEU  35          3HD2      LEU  35   9.937 -27.386 -27.386
  249   3HD2  LEU  35          2HD2      LEU  35   8.708 -28.634 -28.634
  250    H    LEU  36           H        LEU  36   7.115 -27.615 -27.615
  251    HA   LEU  36           HA       LEU  36   5.341 -27.285 -27.285
  252   1HB   LEU  36          2HB       LEU  36   4.191 -25.643 -25.643
  253   2HB   LEU  36          1HB       LEU  36   3.305 -26.413 -26.413
  254    HG   LEU  36           HG       LEU  36   4.910 -28.042 -28.042
  255   1HD1  LEU  36          3HD1      LEU  36   2.298 -26.702 -26.702
  256   2HD1  LEU  36          2HD1      LEU  36   2.473 -28.361 -28.361
  257   3HD1  LEU  36          1HD1      LEU  36   3.564 -27.107 -27.107
  258   1HD2  LEU  36          1HD2      LEU  36   2.594 -28.584 -28.584
  259   2HD2  LEU  36          3HD2      LEU  36   4.227 -29.243 -29.243
  260   3HD2  LEU  36          2HD2      LEU  36   3.154 -29.723 -29.723
  261    HA   PRO  37           HA       PRO  37   5.789 -23.594 -23.594
  262   1HB   PRO  37          2HB       PRO  37   2.822 -23.316 -23.316
  263   2HB   PRO  37          1HB       PRO  37   3.960 -23.352 -23.352
  264   1HG   PRO  37          2HG       PRO  37   2.442 -25.468 -25.468
  265   2HG   PRO  37          1HG       PRO  37   4.125 -25.666 -25.666
  266   1HD   PRO  37          2HD       PRO  37   2.940 -25.931 -25.931
  267   2HD   PRO  37          1HD       PRO  37   4.252 -26.858 -26.858
  268    H    ALA  38           H        ALA  38   6.084 -21.466 -21.466
  269    HA   ALA  38           HA       ALA  38   4.334 -19.985 -19.985
  270   1HB   ALA  38          1HB       ALA  38   7.077 -20.798 -20.798
  271   2HB   ALA  38          3HB       ALA  38   6.265 -19.364 -19.364
  272   3HB   ALA  38          2HB       ALA  38   5.539 -20.956 -20.956
  273    H    GLY  39           H        GLY  39   4.089 -18.334 -18.334
  274   1HA   GLY  39          2HA       GLY  39   6.474 -17.183 -17.183
  275   2HA   GLY  39          1HA       GLY  39   4.810 -16.890 -16.890
  276    H    THR  40           H        THR  40   4.658 -14.721 -14.721
  277    HA   THR  40           HA       THR  40   4.841 -13.552 -13.552
  278    HB   THR  40           HB       THR  40   5.909 -11.526 -11.526
  279    HG1  THR  40           HG1      THR  40   7.232 -13.919 -13.919
  280   1HG2  THR  40          2HG2      THR  40   6.622 -12.332 -12.332
  281   2HG2  THR  40          1HG2      THR  40   7.612 -13.531 -13.531
  282   3HG2  THR  40          3HG2      THR  40   7.917 -11.812 -11.812
  283    H    GLU  41           H        GLU  41   2.528 -13.642 -13.642
  284    HA   GLU  41           HA       GLU  41   1.524 -11.395 -11.395
  285   1HB   GLU  41          2HB       GLU  41   0.601 -14.201 -14.201
  286   2HB   GLU  41          1HB       GLU  41  -0.663 -12.977 -12.977
  287   1HG   GLU  41          2HG       GLU  41   0.344 -11.991 -11.991
  288   2HG   GLU  41          1HG       GLU  41   1.442 -13.369 -13.369
  289    H    ASP  42           H        ASP  42   1.308 -13.268 -13.268
  290    HA   ASP  42           HA       ASP  42  -0.909 -11.906 -11.906
  291   1HB   ASP  42          2HB       ASP  42   1.188 -13.768 -13.768
  292   2HB   ASP  42          1HB       ASP  42   0.371 -12.783 -12.783
  293    H    TYR  43           H        TYR  43  -0.060  -9.749  -9.749
  294    HA   TYR  43           HA       TYR  43   2.098  -8.523  -8.523
  295   1HB   TYR  43          2HB       TYR  43  -0.172  -7.133  -7.133
  296   2HB   TYR  43          1HB       TYR  43   1.442  -6.503  -6.503
  297    HD1  TYR  43           HD1      TYR  43   3.058  -8.909  -8.909
  298    HD2  TYR  43           HD2      TYR  43  -0.279  -7.038  -7.038
  299    HE1  TYR  43           HE1      TYR  43   3.814  -9.746  -9.746
  300    HE2  TYR  43           HE2      TYR  43   0.467  -7.873  -7.873
  301    HH   TYR  43           HH       TYR  43   3.452  -8.932  -8.932
  302    H    ILE  44           H        ILE  44   1.595  -6.308  -6.308
  303    HA   ILE  44           HA       ILE  44  -0.417  -6.845  -6.845
  304    HB   ILE  44           HB       ILE  44   2.101  -5.184  -5.184
  305   1HG1  ILE  44          2HG1      ILE  44   2.722  -7.475  -7.475
  306   2HG1  ILE  44          1HG1      ILE  44   2.706  -6.954  -6.954
  307   1HG2  ILE  44          2HG2      ILE  44  -0.045  -5.766  -5.766
  308   2HG2  ILE  44          1HG2      ILE  44   1.536  -5.091  -5.091
  309   3HG2  ILE  44          3HG2      ILE  44   0.430  -4.192  -4.192
  310   1HD1  ILE  44          2HD1      ILE  44   0.371  -7.919  -7.919
  311   2HD1  ILE  44          1HD1      ILE  44   0.709  -8.671  -8.671
  312   3HD1  ILE  44          3HD1      ILE  44   1.700  -9.070  -9.070
  313    H    HIS  45           H        HIS  45  -2.207  -5.787  -5.787
  314    HA   HIS  45           HA       HIS  45  -2.199  -3.290  -3.290
  315   1HB   HIS  45          2HB       HIS  45  -4.090  -5.318  -5.318
  316   2HB   HIS  45          1HB       HIS  45  -4.734  -3.769  -3.769
  317    HD1  HIS  45           HD1      HIS  45  -3.565  -5.544  -5.544
  318    HD2  HIS  45           HD2      HIS  45  -5.643  -2.120  -2.120
  319    HE1  HIS  45           HE1      HIS  45  -4.527  -4.624  -4.624
  320    HE2  HIS  45           HE2      HIS  45  -5.857  -2.603  -2.603
  321    H    ILE  46           H        ILE  46  -2.284  -1.291  -1.291
  322    HA   ILE  46           HA       ILE  46  -2.252  -0.869  -0.869
  323    HB   ILE  46           HB       ILE  46  -1.692   1.074   1.074
  324   1HG1  ILE  46          2HG1      ILE  46  -0.058  -0.805  -0.805
  325   2HG1  ILE  46          1HG1      ILE  46   0.632   0.796   0.796
  326   1HG2  ILE  46          1HG2      ILE  46  -1.772   1.385   1.385
  327   2HG2  ILE  46          3HG2      ILE  46  -0.594   2.309   2.309
  328   3HG2  ILE  46          2HG2      ILE  46  -2.318   2.486   2.486
  329   1HD1  ILE  46          3HD1      ILE  46   0.056   0.271   0.271
  330   2HD1  ILE  46          2HD1      ILE  46   0.160  -1.392  -1.392
  331   3HD1  ILE  46          1HD1      ILE  46   1.542  -0.308  -0.308
  332    H    ARG  47           H        ARG  47  -3.431   1.720   1.720
  333    HA   ARG  47           HA       ARG  47  -5.524   2.546   2.546
  334   1HB   ARG  47          2HB       ARG  47  -6.194  -0.009  -0.009
  335   2HB   ARG  47          1HB       ARG  47  -6.914   0.664   0.664
  336   1HG   ARG  47          2HG       ARG  47  -8.490   1.839   1.839
  337   2HG   ARG  47          1HG       ARG  47  -7.472   2.017   2.017
  338   1HD   ARG  47          2HD       ARG  47  -8.109   0.019   0.019
  339   2HD   ARG  47          1HD       ARG  47  -8.301  -0.731  -0.731
  340    HE   ARG  47           HE       ARG  47 -10.299   1.222   1.222
  341   1HH1  ARG  47          1HH1      ARG  47 -11.000  -2.457  -2.457
  342   2HH1  ARG  47          2HH1      ARG  47  -9.376  -1.969  -1.969
  343   1HH2  ARG  47          1HH2      ARG  47 -12.436   0.583   0.583
  344   2HH2  ARG  47          2HH2      ARG  47 -12.737  -1.008  -1.008
  345    H    ILE  48           H        ILE  48  -6.167   4.349   4.349
  346    HA   ILE  48           HA       ILE  48  -5.917   4.721   4.721
  347    HB   ILE  48           HB       ILE  48  -5.605   6.525   6.525
  348   1HG1  ILE  48          2HG1      ILE  48  -4.314   6.462   6.462
  349   2HG1  ILE  48          1HG1      ILE  48  -3.678   5.683   5.683
  350   1HG2  ILE  48          1HG2      ILE  48  -6.666   7.512   7.512
  351   2HG2  ILE  48          3HG2      ILE  48  -5.971   8.541   8.541
  352   3HG2  ILE  48          2HG2      ILE  48  -7.449   7.638   7.638
  353   1HD1  ILE  48          1HD1      ILE  48  -4.117   8.643   8.643
  354   2HD1  ILE  48          3HD1      ILE  48  -2.570   7.811   7.811
  355   3HD1  ILE  48          2HD1      ILE  48  -3.392   7.831   7.831
  356    H    GLN  49           H        GLN  49  -7.594   5.985   5.985
  357    HA   GLN  49           HA       GLN  49 -10.172   6.094   6.094
  358   1HB   GLN  49          2HB       GLN  49 -11.334   5.003   5.003
  359   2HB   GLN  49          1HB       GLN  49 -10.138   3.927   3.927
  360   1HG   GLN  49          2HG       GLN  49  -8.705   5.103   5.103
  361   2HG   GLN  49          1HG       GLN  49 -10.317   5.039   5.039
  362   1HE2  GLN  49          2HE2      GLN  49 -10.264   1.632   1.632
  363   2HE2  GLN  49          1HE2      GLN  49 -11.098   3.141   3.141
  364    H    GLN  50           H        GLN  50 -10.200   8.303   8.303
  365    HA   GLN  50           HA       GLN  50  -9.886   9.678   9.678
  366   1HB   GLN  50          2HB       GLN  50  -9.172  10.328  10.328
  367   2HB   GLN  50          1HB       GLN  50 -10.523  11.391  11.391
  368   1HG   GLN  50          2HG       GLN  50  -9.380  12.491  12.491
  369   2HG   GLN  50          1HG       GLN  50  -8.308  11.131  11.131
  370   1HE2  GLN  50          2HE2      GLN  50  -6.402  13.806  13.806
  371   2HE2  GLN  50          1HE2      GLN  50  -7.328  13.675  13.675
  372    H    ARG  51           H        ARG  51 -11.631   9.927   9.927
  373    HA   ARG  51           HA       ARG  51 -14.247   9.418   9.418
  374   1HB   ARG  51          2HB       ARG  51 -13.230  11.148  11.148
  375   2HB   ARG  51          1HB       ARG  51 -14.895  10.608  10.608
  376   1HG   ARG  51          2HG       ARG  51 -12.463   8.886   8.886
  377   2HG   ARG  51          1HG       ARG  51 -13.763   9.200   9.200
  378   1HD   ARG  51          2HD       ARG  51 -15.216   8.245   8.245
  379   2HD   ARG  51          1HD       ARG  51 -13.698   7.415   7.415
  380    HE   ARG  51           HE       ARG  51 -14.074   6.081   6.081
  381   1HH1  ARG  51          2HH1      ARG  51 -16.124   8.894   8.894
  382   2HH1  ARG  51          1HH1      ARG  51 -16.990   8.298   8.298
  383   1HH2  ARG  51          1HH2      ARG  51 -15.211   5.296   5.296
  384   2HH2  ARG  51          2HH2      ARG  51 -16.471   6.256   6.256
  385    H    ASN  52           H        ASN  52 -13.434  12.682  12.682
  386    HA   ASN  52           HA       ASN  52 -15.228  13.743  13.743
  387   1HB   ASN  52          2HB       ASN  52 -14.228  15.708  15.708
  388   2HB   ASN  52          1HB       ASN  52 -15.885  15.279  15.279
  389   1HD2  ASN  52          2HD2      ASN  52 -16.358  13.884  13.884
  390   2HD2  ASN  52          1HD2      ASN  52 -16.934  14.844  14.844
  391    H    GLY  53           H        GLY  53 -12.358  12.910  12.910
  392   1HA   GLY  53          2HA       GLY  53 -10.861  13.691  13.691
  393   2HA   GLY  53          1HA       GLY  53 -11.577  15.289  15.289
  394    H    ARG  54           H        ARG  54 -10.851  13.838  13.838
  395    HA   ARG  54           HA       ARG  54  -8.202  15.062  15.062
  396   1HB   ARG  54          2HB       ARG  54  -8.826  16.067  16.067
  397   2HB   ARG  54          1HB       ARG  54  -9.560  16.823  16.823
  398   1HG   ARG  54          2HG       ARG  54 -11.502  16.624  16.624
  399   2HG   ARG  54          1HG       ARG  54 -11.395  14.892  14.892
  400   1HD   ARG  54          2HD       ARG  54 -11.737  14.972  14.972
  401   2HD   ARG  54          1HD       ARG  54  -9.982  14.833  14.833
  402    HE   ARG  54           HE       ARG  54 -10.541  17.536  17.536
  403   1HH1  ARG  54          2HH1      ARG  54 -11.026  14.785  14.785
  404   2HH1  ARG  54          1HH1      ARG  54 -10.948  15.721  15.721
  405   1HH2  ARG  54          1HH2      ARG  54 -10.439  18.768  18.768
  406   2HH2  ARG  54          2HH2      ARG  54 -10.616  17.982  17.982
  407    H    LYS  55           H        LYS  55 -10.640  13.124  13.124
  408    HA   LYS  55           HA       LYS  55  -8.720  11.924  11.924
  409   1HB   LYS  55          2HB       LYS  55 -11.226  12.218  12.218
  410   2HB   LYS  55          1HB       LYS  55 -11.460  10.836  10.836
  411   1HG   LYS  55          2HG       LYS  55 -11.486  10.134  10.134
  412   2HG   LYS  55          1HG       LYS  55 -10.072   9.468   9.468
  413   1HD   LYS  55          2HD       LYS  55  -9.518  10.310  10.310
  414   2HD   LYS  55          1HD       LYS  55  -8.668  11.201  11.201
  415   1HE   LYS  55          2HE       LYS  55 -10.033  13.084  13.084
  416   2HE   LYS  55          1HE       LYS  55 -11.279  12.179  12.179
  417   1HZ   LYS  55          3HZ       LYS  55  -9.585  11.882  11.882
  418   2HZ   LYS  55          2HZ       LYS  55  -8.628  13.025  13.025
  419   3HZ   LYS  55          1HZ       LYS  55 -10.154  13.462  13.462
  420    H    THR  56           H        THR  56  -7.330  11.453  11.453
  421    HA   THR  56           HA       THR  56  -8.060   9.256   9.256
  422    HB   THR  56           HB       THR  56  -5.199   9.817   9.817
  423    HG1  THR  56           HG1      THR  56  -5.234  11.901  11.901
  424   1HG2  THR  56          1HG2      THR  56  -7.173   9.395   9.395
  425   2HG2  THR  56          3HG2      THR  56  -5.962  10.618  10.618
  426   3HG2  THR  56          2HG2      THR  56  -5.458   8.984   8.984
  427    H    LEU  57           H        LEU  57  -7.412   7.140   7.140
  428    HA   LEU  57           HA       LEU  57  -5.811   6.252   6.252
  429   1HB   LEU  57          2HB       LEU  57  -8.670   5.741   5.741
  430   2HB   LEU  57          1HB       LEU  57  -7.726   4.299   4.299
  431    HG   LEU  57           HG       LEU  57  -7.511   6.689   6.689
  432   1HD1  LEU  57          3HD1      LEU  57  -9.750   4.758   4.758
  433   2HD1  LEU  57          2HD1      LEU  57  -9.199   5.194   5.194
  434   3HD1  LEU  57          1HD1      LEU  57  -9.754   6.447   6.447
  435   1HD2  LEU  57          2HD2      LEU  57  -6.690   3.855   3.855
  436   2HD2  LEU  57          1HD2      LEU  57  -5.914   5.269   5.269
  437   3HD2  LEU  57          3HD2      LEU  57  -7.279   4.504   4.504
  438    H    THR  58           H        THR  58  -4.145   5.661   5.661
  439    HA   THR  58           HA       THR  58  -4.527   4.139   4.139
  440    HB   THR  58           HB       THR  58  -2.049   4.536   4.536
  441    HG1  THR  58           HG1      THR  58  -3.221   6.380   6.380
  442   1HG2  THR  58          2HG2      THR  58  -2.364   2.749   2.749
  443   2HG2  THR  58          1HG2      THR  58  -1.604   4.162   4.162
  444   3HG2  THR  58          3HG2      THR  58  -0.845   3.368   3.368
  445    H    THR  59           H        THR  59  -5.060   2.059   2.059
  446    HA   THR  59           HA       THR  59  -4.521   0.314   0.314
  447    HB   THR  59           HB       THR  59  -6.126  -1.149  -1.149
  448    HG1  THR  59           HG1      THR  59  -6.873   0.280   0.280
  449   1HG2  THR  59          3HG2      THR  59  -6.469   0.284   0.284
  450   2HG2  THR  59          2HG2      THR  59  -7.957   0.212   0.212
  451   3HG2  THR  59          1HG2      THR  59  -7.114  -1.276  -1.276
  452    H    VAL  60           H        VAL  60  -4.042  -1.991  -1.991
  453    HA   VAL  60           HA       VAL  60  -2.427  -2.268  -2.268
  454    HB   VAL  60           HB       VAL  60  -1.526  -3.205  -3.205
  455   1HG1  VAL  60          3HG1      VAL  60  -0.826  -4.563  -4.563
  456   2HG1  VAL  60          2HG1      VAL  60   0.025  -3.135  -3.135
  457   3HG1  VAL  60          1HG1      VAL  60   0.500  -3.880  -3.880
  458   1HG2  VAL  60          2HG2      VAL  60  -0.883  -0.767  -0.767
  459   2HG2  VAL  60          1HG2      VAL  60  -1.216  -0.918  -0.918
  460   3HG2  VAL  60          3HG2      VAL  60   0.328  -1.468  -1.468
  461    H    GLN  61           H        GLN  61  -3.168  -3.926  -3.926
  462    HA   GLN  61           HA       GLN  61  -4.342  -6.207  -6.207
  463   1HB   GLN  61          2HB       GLN  61  -4.945  -6.181  -6.181
  464   2HB   GLN  61          1HB       GLN  61  -6.037  -6.255  -6.255
  465   1HG   GLN  61          2HG       GLN  61  -5.734  -3.755  -3.755
  466   2HG   GLN  61          1HG       GLN  61  -4.942  -3.822  -3.822
  467   1HE2  GLN  61          2HE2      GLN  61  -8.214  -5.246  -5.246
  468   2HE2  GLN  61          1HE2      GLN  61  -6.698  -5.993  -5.993
  469    H    GLY  62           H        GLY  62  -3.659  -8.260  -8.260
  470   1HA   GLY  62          2HA       GLY  62  -2.542  -9.828  -9.828
  471   2HA   GLY  62          1HA       GLY  62  -1.469  -8.516  -8.516
  472    H    ILE  63           H        ILE  63  -1.347  -7.664  -7.664
  473    HA   ILE  63           HA       ILE  63   0.984  -9.165  -9.165
  474    HB   ILE  63           HB       ILE  63  -0.542  -7.019  -7.019
  475   1HG1  ILE  63          2HG1      ILE  63   0.540  -5.955  -5.955
  476   2HG1  ILE  63          1HG1      ILE  63   1.753  -5.845  -5.845
  477   1HG2  ILE  63          3HG2      ILE  63   1.561  -8.792  -8.792
  478   2HG2  ILE  63          2HG2      ILE  63   1.914  -7.080  -7.080
  479   3HG2  ILE  63          1HG2      ILE  63   0.437  -7.767  -7.767
  480   1HD1  ILE  63          3HD1      ILE  63   2.633  -8.061  -8.061
  481   2HD1  ILE  63          2HD1      ILE  63   1.725  -7.513  -7.513
  482   3HD1  ILE  63          1HD1      ILE  63   3.009  -6.505  -6.505
  483    H    ALA  64           H        ALA  64   1.325 -10.557 -10.557
  484    HA   ALA  64           HA       ALA  64  -0.980 -12.102 -12.102
  485   1HB   ALA  64          1HB       ALA  64   1.295 -13.038 -13.038
  486   2HB   ALA  64          3HB       ALA  64   1.839 -12.551 -12.551
  487   3HB   ALA  64          2HB       ALA  64   0.533 -13.725 -13.725
  488    H    ASP  65           H        ASP  65  -1.863 -12.247 -12.247
  489    HA   ASP  65           HA       ASP  65  -1.547 -10.072 -10.072
  490   1HB   ASP  65          2HB       ASP  65  -3.033 -11.450 -11.450
  491   2HB   ASP  65          1HB       ASP  65  -3.680 -11.136 -11.136
  492    H    ASP  66           H        ASP  66   0.281 -12.888 -12.888
  493    HA   ASP  66           HA       ASP  66   1.135 -13.010 -13.010
  494   1HB   ASP  66          2HB       ASP  66   1.271 -14.787 -14.787
  495   2HB   ASP  66          1HB       ASP  66   2.737 -14.777 -14.777
  496    H    TYR  67           H        TYR  67   1.752 -10.681 -10.681
  497    HA   TYR  67           HA       TYR  67   4.615 -10.843 -10.843
  498   1HB   TYR  67          2HB       TYR  67   2.480  -8.841  -8.841
  499   2HB   TYR  67          1HB       TYR  67   4.152  -8.300  -8.300
  500    HD1  TYR  67           HD1      TYR  67   3.686 -11.694 -11.694
  501    HD2  TYR  67           HD2      TYR  67   3.763  -7.623  -7.623
  502    HE1  TYR  67           HE1      TYR  67   4.005 -12.404 -12.404
  503    HE2  TYR  67           HE2      TYR  67   4.080  -8.313  -8.313
  504    HH   TYR  67           HH       TYR  67   3.620 -11.494 -11.494
  505    H    ASP  68           H        ASP  68   3.353 -10.943 -10.943
  506    HA   ASP  68           HA       ASP  68   4.124 -10.373 -10.373
  507   1HB   ASP  68          2HB       ASP  68   6.274  -9.768  -9.768
  508   2HB   ASP  68          1HB       ASP  68   5.715  -8.104  -8.104
  509    H    LYS  69           H        LYS  69   2.658  -8.193  -8.193
  510    HA   LYS  69           HA       LYS  69   1.130  -6.540  -6.540
  511   1HB   LYS  69          2HB       LYS  69   0.052  -8.090  -8.090
  512   2HB   LYS  69          1HB       LYS  69   1.063  -7.499  -7.499
  513   1HG   LYS  69          2HG       LYS  69   0.049  -5.228  -5.228
  514   2HG   LYS  69          1HG       LYS  69  -1.103  -6.023  -6.023
  515   1HD   LYS  69          2HD       LYS  69  -2.267  -6.907  -6.907
  516   2HD   LYS  69          1HD       LYS  69  -0.808  -7.307  -7.307
  517   1HE   LYS  69          2HE       LYS  69  -0.739  -4.648  -4.648
  518   2HE   LYS  69          1HE       LYS  69  -2.480  -4.863  -4.863
  519   1HZ   LYS  69          1HZ       LYS  69  -1.120  -6.623  -6.623
  520   2HZ   LYS  69          3HZ       LYS  69  -1.279  -4.999  -4.999
  521   3HZ   LYS  69          2HZ       LYS  69  -2.654  -5.917  -5.917
  522    H    LYS  70           H        LYS  70   2.655  -6.392  -6.392
  523    HA   LYS  70           HA       LYS  70   2.800  -3.644  -3.644
  524   1HB   LYS  70          2HB       LYS  70   4.475  -3.961  -3.961
  525   2HB   LYS  70          1HB       LYS  70   3.213  -5.176  -5.176
  526   1HG   LYS  70          2HG       LYS  70   4.686  -6.790  -6.790
  527   2HG   LYS  70          1HG       LYS  70   5.959  -5.567  -5.567
  528   1HD   LYS  70          2HD       LYS  70   4.641  -6.287  -6.287
  529   2HD   LYS  70          1HD       LYS  70   5.856  -7.372  -7.372
  530   1HE   LYS  70          2HE       LYS  70   7.466  -6.072  -6.072
  531   2HE   LYS  70          1HE       LYS  70   6.865  -4.726  -4.726
  532   1HZ   LYS  70          3HZ       LYS  70   5.540  -5.362  -5.362
  533   2HZ   LYS  70          2HZ       LYS  70   7.012  -4.531  -4.531
  534   3HZ   LYS  70          1HZ       LYS  70   5.687  -3.874  -3.874
  535    H    LYS  71           H        LYS  71   5.277  -5.868  -5.868
  536    HA   LYS  71           HA       LYS  71   7.252  -3.972  -3.972
  537   1HB   LYS  71          2HB       LYS  71   6.973  -6.702  -6.702
  538   2HB   LYS  71          1HB       LYS  71   7.148  -6.108  -6.108
  539   1HG   LYS  71          2HG       LYS  71   9.043  -5.186  -5.186
  540   2HG   LYS  71          1HG       LYS  71   9.244  -6.781  -6.781
  541   1HD   LYS  71          2HD       LYS  71   8.775  -4.687  -4.687
  542   2HD   LYS  71          1HD       LYS  71  10.220  -4.403  -4.403
  543   1HE   LYS  71          2HE       LYS  71  10.977  -6.698  -6.698
  544   2HE   LYS  71          1HE       LYS  71   9.572  -6.891  -6.891
  545   1HZ   LYS  71          2HZ       LYS  71  10.505  -4.736  -4.736
  546   2HZ   LYS  71          1HZ       LYS  71  11.962  -5.231  -5.231
  547   3HZ   LYS  71          3HZ       LYS  71  11.165  -6.240  -6.240
  548    H    LEU  72           H        LEU  72   4.224  -4.344  -4.344
  549    HA   LEU  72           HA       LEU  72   5.117  -3.084  -3.084
  550   1HB   LEU  72          2HB       LEU  72   2.474  -4.273  -4.273
  551   2HB   LEU  72          1HB       LEU  72   2.712  -3.429  -3.429
  552    HG   LEU  72           HG       LEU  72   3.660  -5.216  -5.216
  553   1HD1  LEU  72          3HD1      LEU  72   5.731  -4.913  -4.913
  554   2HD1  LEU  72          2HD1      LEU  72   5.055  -5.948  -5.948
  555   3HD1  LEU  72          1HD1      LEU  72   5.376  -6.607  -6.607
  556   1HD2  LEU  72          2HD2      LEU  72   1.832  -6.060  -6.060
  557   2HD2  LEU  72          1HD2      LEU  72   2.296  -6.894  -6.894
  558   3HD2  LEU  72          3HD2      LEU  72   3.156  -7.224  -7.224
  559    H    VAL  73           H        VAL  73   2.496  -2.601  -2.601
  560    HA   VAL  73           HA       VAL  73   2.116   0.120   0.120
  561    HB   VAL  73           HB       VAL  73   0.841  -1.643  -1.643
  562   1HG1  VAL  73          2HG1      VAL  73   0.440   1.344   1.344
  563   2HG1  VAL  73          1HG1      VAL  73  -0.562   0.227   0.227
  564   3HG1  VAL  73          3HG1      VAL  73   1.132   0.456   0.456
  565   1HG2  VAL  73          3HG2      VAL  73  -0.044  -0.140  -0.140
  566   2HG2  VAL  73          2HG2      VAL  73  -0.136  -1.870  -1.870
  567   3HG2  VAL  73          1HG2      VAL  73  -1.206  -0.752  -0.752
  568    H    LYS  74           H        LYS  74   3.265  -1.445  -1.445
  569    HA   LYS  74           HA       LYS  74   3.865   0.837   0.837
  570   1HB   LYS  74          2HB       LYS  74   4.118  -1.774  -1.774
  571   2HB   LYS  74          1HB       LYS  74   5.799  -1.420  -1.420
  572   1HG   LYS  74          2HG       LYS  74   5.803  -1.069  -1.069
  573   2HG   LYS  74          1HG       LYS  74   5.418   0.559   0.559
  574   1HD   LYS  74          2HD       LYS  74   2.938  -0.497  -0.497
  575   2HD   LYS  74          1HD       LYS  74   3.753  -1.393  -1.393
  576   1HE   LYS  74          2HE       LYS  74   3.627   1.607   1.607
  577   2HE   LYS  74          1HE       LYS  74   2.730   0.632   0.632
  578   1HZ   LYS  74          1HZ       LYS  74   5.233  -0.130  -0.130
  579   2HZ   LYS  74          3HZ       LYS  74   5.505   1.470   1.470
  580   3HZ   LYS  74          2HZ       LYS  74   4.457   1.137   1.137
  581    H    ALA  75           H        ALA  75   5.821  -0.869  -0.869
  582    HA   ALA  75           HA       ALA  75   8.090   0.835   0.835
  583   1HB   ALA  75          2HB       ALA  75   7.210  -1.133  -1.133
  584   2HB   ALA  75          1HB       ALA  75   8.696  -0.195  -0.195
  585   3HB   ALA  75          3HB       ALA  75   8.487  -1.313  -1.313
  586    H    PHE  76           H        PHE  76   5.408   0.622   0.622
  587    HA   PHE  76           HA       PHE  76   6.085   2.610   2.610
  588   1HB   PHE  76          2HB       PHE  76   3.960   1.117   1.117
  589   2HB   PHE  76          1HB       PHE  76   3.263   2.444   2.444
  590    HD1  PHE  76           HD2      PHE  76   4.601   1.423   1.423
  591    HD2  PHE  76           HD1      PHE  76   2.644   4.492   4.492
  592    HE1  PHE  76           HE2      PHE  76   4.066   2.578   2.578
  593    HE2  PHE  76           HE1      PHE  76   2.106   5.656   5.656
  594    HZ   PHE  76           HZ       PHE  76   2.816   4.700   4.700
  595    H    LYS  77           H        LYS  77   4.433   3.041   3.041
  596    HA   LYS  77           HA       LYS  77   4.128   5.833   5.833
  597   1HB   LYS  77          2HB       LYS  77   4.435   4.127   4.127
  598   2HB   LYS  77          1HB       LYS  77   3.782   5.758   5.758
  599   1HG   LYS  77          2HG       LYS  77   1.770   5.069   5.069
  600   2HG   LYS  77          1HG       LYS  77   2.448   3.836   3.836
  601   1HD   LYS  77          2HD       LYS  77   1.730   2.342   2.342
  602   2HD   LYS  77          1HD       LYS  77   3.039   2.905   2.905
  603   1HE   LYS  77          2HE       LYS  77   0.367   4.270   4.270
  604   2HE   LYS  77          1HE       LYS  77   0.658   2.849   2.849
  605   1HZ   LYS  77          1HZ       LYS  77   2.670   4.174   4.174
  606   2HZ   LYS  77          3HZ       LYS  77   1.883   5.524   5.524
  607   3HZ   LYS  77          2HZ       LYS  77   1.136   4.608   4.608
  608    H    LYS  78           H        LYS  78   6.863   3.854   3.854
  609    HA   LYS  78           HA       LYS  78   8.350   5.985   5.985
  610   1HB   LYS  78          2HB       LYS  78   8.481   3.345   3.345
  611   2HB   LYS  78          1HB       LYS  78   9.674   3.504   3.504
  612   1HG   LYS  78          2HG       LYS  78  10.693   5.339   5.339
  613   2HG   LYS  78          1HG       LYS  78   9.745   4.565   4.565
  614   1HD   LYS  78          2HD       LYS  78  11.788   3.211   3.211
  615   2HD   LYS  78          1HD       LYS  78  12.021   3.674   3.674
  616   1HE   LYS  78          2HE       LYS  78  10.136   1.604   1.604
  617   2HE   LYS  78          1HE       LYS  78  11.511   1.349   1.349
  618   1HZ   LYS  78          1HZ       LYS  78  10.185   2.912   2.912
  619   2HZ   LYS  78          3HZ       LYS  78   8.856   2.458   2.458
  620   3HZ   LYS  78          2HZ       LYS  78   9.745   1.283   1.283
  621    H    LYS  79           H        LYS  79   7.797   4.863   4.863
  622    HA   LYS  79           HA       LYS  79  10.217   6.192   6.192
  623   1HB   LYS  79          2HB       LYS  79   9.190   3.757   3.757
  624   2HB   LYS  79          1HB       LYS  79   8.518   4.759   4.759
  625   1HG   LYS  79          2HG       LYS  79  11.073   5.597   5.597
  626   2HG   LYS  79          1HG       LYS  79  11.297   3.933   3.933
  627   1HD   LYS  79          2HD       LYS  79  10.613   3.051   3.051
  628   2HD   LYS  79          1HD       LYS  79   9.435   4.334   4.334
  629   1HE   LYS  79          2HE       LYS  79  11.031   4.705   4.705
  630   2HE   LYS  79          1HE       LYS  79  11.497   5.835   5.835
  631   1HZ   LYS  79          2HZ       LYS  79  12.689   3.146   3.146
  632   2HZ   LYS  79          1HZ       LYS  79  13.276   4.343   4.343
  633   3HZ   LYS  79          3HZ       LYS  79  13.320   4.582   4.582
  634    H    PHE  80           H        PHE  80   6.695   6.240   6.240
  635    HA   PHE  80           HA       PHE  80   6.949   8.709   8.709
  636   1HB   PHE  80          2HB       PHE  80   4.518   6.936   6.936
  637   2HB   PHE  80          1HB       PHE  80   4.979   8.179   8.179
  638    HD1  PHE  80           HD2      PHE  80   5.520   4.737   4.737
  639    HD2  PHE  80           HD1      PHE  80   6.634   7.743   7.743
  640    HE1  PHE  80           HE2      PHE  80   6.598   3.026   3.026
  641    HE2  PHE  80           HE1      PHE  80   7.714   6.038   6.038
  642    HZ   PHE  80           HZ       PHE  80   7.698   3.676   3.676
  643    H    ALA  81           H        ALA  81   5.946   7.467   7.467
  644    HA   ALA  81           HA       ALA  81   4.848   8.392   8.392
  645   1HB   ALA  81          2HB       ALA  81   6.244  10.425  10.425
  646   2HB   ALA  81          1HB       ALA  81   4.616  11.057  11.057
  647   3HB   ALA  81          3HB       ALA  81   5.158  10.611  10.611
  648    H    CYS  82           H        CYS  82   3.378   7.223   7.223
  649    HA   CYS  82           HA       CYS  82   0.880   8.777   8.777
  650   1HB   CYS  82          2HB       CYS  82   1.518   6.490   6.490
  651   2HB   CYS  82          1HB       CYS  82   0.199   7.647   7.647
  652    HG   CYS  82           HG       CYS  82   2.942   8.948   8.948
  653    H    ASN  83           H        ASN  83  -1.129   7.578   7.578
  654    HA   ASN  83           HA       ASN  83  -0.834   5.544   5.544
  655   1HB   ASN  83          2HB       ASN  83  -2.532   6.890   6.890
  656   2HB   ASN  83          1HB       ASN  83  -2.973   7.366   7.366
  657   1HD2  ASN  83          2HD2      ASN  83  -5.270   4.728   4.728
  658   2HD2  ASN  83          1HD2      ASN  83  -4.147   5.759   5.759
  659    H    GLY  84           H        GLY  84  -0.874   3.439   3.439
  660   1HA   GLY  84          2HA       GLY  84  -2.046   2.510   2.510
  661   2HA   GLY  84          1HA       GLY  84  -0.689   1.734   1.734
  662    H    THR  85           H        THR  85  -3.749   1.197   1.197
  663    HA   THR  85           HA       THR  85  -4.225  -0.308  -0.308
  664    HB   THR  85           HB       THR  85  -6.674   0.092   0.092
  665    HG1  THR  85           HG1      THR  85  -7.330   1.213   1.213
  666   1HG2  THR  85          1HG2      THR  85  -5.418   1.436   1.436
  667   2HG2  THR  85          3HG2      THR  85  -5.081   2.616   2.616
  668   3HG2  THR  85          2HG2      THR  85  -6.742   2.332   2.332
  669    H    VAL  86           H        VAL  86  -4.145  -2.395  -2.395
  670    HA   VAL  86           HA       VAL  86  -4.449  -3.471  -3.471
  671    HB   VAL  86           HB       VAL  86  -2.881  -4.466  -4.466
  672   1HG1  VAL  86          1HG1      VAL  86  -4.761  -4.116  -4.116
  673   2HG1  VAL  86          3HG1      VAL  86  -5.015  -5.824  -5.824
  674   3HG1  VAL  86          2HG1      VAL  86  -3.428  -5.259  -5.259
  675   1HG2  VAL  86          1HG2      VAL  86  -4.806  -5.876  -5.876
  676   2HG2  VAL  86          3HG2      VAL  86  -3.120  -6.282  -6.282
  677   3HG2  VAL  86          2HG2      VAL  86  -4.386  -6.845  -6.845
  678    H    ILE  87           H        ILE  87  -6.392  -3.677  -3.677
  679    HA   ILE  87           HA       ILE  87  -8.638  -4.602  -4.602
  680    HB   ILE  87           HB       ILE  87 -10.140  -3.456  -3.456
  681   1HG1  ILE  87          2HG1      ILE  87  -7.644  -2.015  -2.015
  682   2HG1  ILE  87          1HG1      ILE  87  -8.354  -3.352  -3.352
  683   1HG2  ILE  87          2HG2      ILE  87  -9.624  -2.452  -2.452
  684   2HG2  ILE  87          1HG2      ILE  87  -8.190  -1.686  -1.686
  685   3HG2  ILE  87          3HG2      ILE  87  -9.797  -1.213  -1.213
  686   1HD1  ILE  87          1HD1      ILE  87 -10.420  -2.075  -2.075
  687   2HD1  ILE  87          3HD1      ILE  87  -9.697  -0.735  -0.735
  688   3HD1  ILE  87          2HD1      ILE  87  -9.032  -1.219  -1.219
  689    H    GLU  88           H        GLU  88 -10.284  -5.859  -5.859
  690    HA   GLU  88           HA       GLU  88  -9.109  -7.509  -7.509
  691   1HB   GLU  88          2HB       GLU  88  -9.772  -8.523  -8.523
  692   2HB   GLU  88          1HB       GLU  88 -11.431  -8.324  -8.324
  693   1HG   GLU  88          2HG       GLU  88 -10.916  -9.703  -9.703
  694   2HG   GLU  88          1HG       GLU  88  -9.284  -9.944  -9.944
  695    H    HIS  89           H        HIS  89  -9.851  -5.696  -5.696
  696    HA   HIS  89           HA       HIS  89 -12.488  -4.972  -4.972
  697   1HB   HIS  89          2HB       HIS  89 -10.180  -4.212  -4.212
  698   2HB   HIS  89          1HB       HIS  89 -10.744  -5.269  -5.269
  699    HD1  HIS  89           HD1      HIS  89 -12.272  -4.231  -4.231
  700    HD2  HIS  89           HD2      HIS  89 -12.168  -2.113  -2.113
  701    HE1  HIS  89           HE1      HIS  89 -13.680  -2.183  -2.183
  702    HE2  HIS  89           HE2      HIS  89 -13.545  -0.881  -0.881
  703    HA   PRO  90           HA       PRO  90 -14.241  -8.700  -8.700
  704   1HB   PRO  90          2HB       PRO  90 -16.647  -7.740  -7.740
  705   2HB   PRO  90          1HB       PRO  90 -16.190  -7.939  -7.939
  706   1HG   PRO  90          2HG       PRO  90 -16.208  -5.461  -5.461
  707   2HG   PRO  90          1HG       PRO  90 -16.751  -5.683  -5.683
  708   1HD   PRO  90          2HD       PRO  90 -14.321  -4.619  -4.619
  709   2HD   PRO  90          1HD       PRO  90 -14.630  -5.471  -5.471
  710    H    GLU  91           H        GLU  91 -13.742  -5.780  -5.780
  711    HA   GLU  91           HA       GLU  91 -14.586  -6.842  -6.842
  712   1HB   GLU  91          2HB       GLU  91 -14.003  -4.284  -4.284
  713   2HB   GLU  91          1HB       GLU  91 -12.934  -4.537  -4.537
  714   1HG   GLU  91          2HG       GLU  91 -15.022  -3.418  -3.418
  715   2HG   GLU  91          1HG       GLU  91 -14.811  -4.960  -4.960
  716    H    TYR  92           H        TYR  92 -11.679  -6.714  -6.714
  717    HA   TYR  92           HA       TYR  92 -10.197  -7.867  -7.867
  718   1HB   TYR  92          2HB       TYR  92  -8.757  -6.437  -6.437
  719   2HB   TYR  92          1HB       TYR  92  -8.292  -6.655  -6.655
  720    HD1  TYR  92           HD1      TYR  92 -10.459  -5.619  -5.619
  721    HD2  TYR  92           HD2      TYR  92  -8.920  -4.181  -4.181
  722    HE1  TYR  92           HE1      TYR  92 -11.313  -3.376  -3.376
  723    HE2  TYR  92           HE2      TYR  92  -9.768  -1.931  -1.931
  724    HH   TYR  92           HH       TYR  92 -10.361  -0.616  -0.616
  725    H    GLY  93           H        GLY  93 -10.249  -7.662  -7.662
  726   1HA   GLY  93          2HA       GLY  93 -10.420  -9.628  -9.628
  727   2HA   GLY  93          1HA       GLY  93  -9.646 -10.540 -10.540
  728    H    GLU  94           H        GLU  94  -9.200  -8.853  -8.853
  729    HA   GLU  94           HA       GLU  94  -7.387  -8.435  -8.435
  730   1HB   GLU  94          2HB       GLU  94  -7.047 -10.888 -10.888
  731   2HB   GLU  94          1HB       GLU  94  -5.913 -10.385 -10.385
  732   1HG   GLU  94          2HG       GLU  94  -5.346  -9.152  -9.152
  733   2HG   GLU  94          1HG       GLU  94  -5.332 -10.912 -10.912
  734    H    VAL  95           H        VAL  95  -7.090  -6.288  -6.288
  735    HA   VAL  95           HA       VAL  95  -4.678  -5.831  -5.831
  736    HB   VAL  95           HB       VAL  95  -5.729  -3.956  -3.956
  737   1HG1  VAL  95          2HG1      VAL  95  -5.747  -6.571  -6.571
  738   2HG1  VAL  95          1HG1      VAL  95  -7.471  -6.216  -6.216
  739   3HG1  VAL  95          3HG1      VAL  95  -6.329  -5.294  -5.294
  740   1HG2  VAL  95          1HG2      VAL  95  -7.579  -3.628  -3.628
  741   2HG2  VAL  95          3HG2      VAL  95  -8.090  -3.621  -3.621
  742   3HG2  VAL  95          2HG2      VAL  95  -8.363  -5.049  -5.049
  743    H    ILE  96           H        ILE  96  -3.441  -4.172  -4.172
  744    HA   ILE  96           HA       ILE  96  -4.053  -3.074  -3.074
  745    HB   ILE  96           HB       ILE  96  -1.784  -2.734  -2.734
  746   1HG1  ILE  96          2HG1      ILE  96  -2.242  -4.600  -4.600
  747   2HG1  ILE  96          1HG1      ILE  96  -0.619  -4.064  -4.064
  748   1HG2  ILE  96          1HG2      ILE  96  -2.207  -1.092  -1.092
  749   2HG2  ILE  96          3HG2      ILE  96  -0.673  -1.223  -1.223
  750   3HG2  ILE  96          2HG2      ILE  96  -2.073  -0.500  -0.500
  751   1HD1  ILE  96          1HD1      ILE  96  -2.035  -2.621  -2.621
  752   2HD1  ILE  96          3HD1      ILE  96  -1.430  -4.244  -4.244
  753   3HD1  ILE  96          2HD1      ILE  96  -0.320  -2.980  -2.980
  754    H    GLN  97           H        GLN  97  -4.159  -0.769  -0.769
  755    HA   GLN  97           HA       GLN  97  -5.156   0.859   0.859
  756   1HB   GLN  97          2HB       GLN  97  -6.789  -0.232  -0.232
  757   2HB   GLN  97          1HB       GLN  97  -6.529   1.420   1.420
  758   1HG   GLN  97          2HG       GLN  97  -7.118   1.980   1.980
  759   2HG   GLN  97          1HG       GLN  97  -7.920   0.412   0.412
  760   1HE2  GLN  97          2HE2      GLN  97 -10.744   1.930   1.930
  761   2HE2  GLN  97          1HE2      GLN  97 -10.011   0.874   0.874
  762    H    LEU  98           H        LEU  98  -3.372   2.163   2.163
  763    HA   LEU  98           HA       LEU  98  -2.334   3.419   3.419
  764   1HB   LEU  98          2HB       LEU  98  -1.573   3.953   3.953
  765   2HB   LEU  98          1HB       LEU  98  -0.671   4.394   4.394
  766    HG   LEU  98           HG       LEU  98  -1.232   1.509   1.509
  767   1HD1  LEU  98          1HD1      LEU  98  -0.006   3.080   3.080
  768   2HD1  LEU  98          3HD1      LEU  98   1.350   2.433   2.433
  769   3HD1  LEU  98          2HD1      LEU  98   0.184   1.336   1.336
  770   1HD2  LEU  98          1HD2      LEU  98   0.405   3.088   3.088
  771   2HD2  LEU  98          3HD2      LEU  98  -0.101   1.400   1.400
  772   3HD2  LEU  98          2HD2      LEU  98   1.327   1.836   1.836
  773    H    GLN  99           H        GLN  99  -2.191   5.733   5.733
  774    HA   GLN  99           HA       GLN  99  -4.626   7.035   7.035
  775   1HB   GLN  99          2HB       GLN  99  -3.026   7.180   7.180
  776   2HB   GLN  99          1HB       GLN  99  -3.159   8.783   8.783
  777   1HG   GLN  99          2HG       GLN  99  -5.703   7.405   7.405
  778   2HG   GLN  99          1HG       GLN  99  -5.001   7.534   7.534
  779   1HE2  GLN  99          2HE2      GLN  99  -5.449  11.104  11.104
  780   2HE2  GLN  99          1HE2      GLN  99  -4.687   9.763   9.763
  781    H    GLY 100           H        GLY 100  -4.690   8.891   8.891
  782   1HA   GLY 100          2HA       GLY 100  -3.893  10.677  10.677
  783   2HA   GLY 100          1HA       GLY 100  -2.264  10.287  10.287
  784    H    ASP 101           H        ASP 101  -2.337  10.990  10.990
  785    HA   ASP 101           HA       ASP 101  -2.886   8.788   8.788
  786   1HB   ASP 101          2HB       ASP 101  -1.858  10.292  10.292
  787   2HB   ASP 101          1HB       ASP 101  -3.231  10.992  10.992
  788    H    GLN 102           H        GLN 102  -1.490   7.275   7.275
  789    HA   GLN 102           HA       GLN 102   1.374   7.643   7.643
  790   1HB   GLN 102          2HB       GLN 102  -0.406   5.839   5.839
  791   2HB   GLN 102          1HB       GLN 102   1.116   5.140   5.140
  792   1HG   GLN 102          2HG       GLN 102   1.017   6.213   6.213
  793   2HG   GLN 102          1HG       GLN 102   2.383   6.609   6.609
  794   1HE2  GLN 102          2HE2      GLN 102  -0.523   9.477   9.477
  795   2HE2  GLN 102          1HE2      GLN 102  -0.934   7.820   7.820
  796    H    ARG 103           H        ARG 103  -0.852   6.907   6.907
  797    HA   ARG 103           HA       ARG 103  -0.396   4.445   4.445
  798   1HB   ARG 103          2HB       ARG 103  -2.047   6.095   6.095
  799   2HB   ARG 103          1HB       ARG 103  -0.738   7.039   7.039
  800   1HG   ARG 103          2HG       ARG 103  -0.791   4.233   4.233
  801   2HG   ARG 103          1HG       ARG 103  -2.194   5.180   5.180
  802   1HD   ARG 103          2HD       ARG 103   0.670   5.994   5.994
  803   2HD   ARG 103          1HD       ARG 103  -0.344   5.183   5.183
  804    HE   ARG 103           HE       ARG 103  -1.653   7.495   7.495
  805   1HH1  ARG 103          2HH1      ARG 103   1.071   6.545   6.545
  806   2HH1  ARG 103          1HH1      ARG 103   1.018   7.967   7.967
  807   1HH2  ARG 103          1HH2      ARG 103  -1.725   9.368   9.368
  808   2HH2  ARG 103          2HH2      ARG 103  -0.569   9.570   9.570
  809    H    LYS 104           H        LYS 104   1.709   7.217   7.217
  810    HA   LYS 104           HA       LYS 104   3.567   5.898   5.898
  811   1HB   LYS 104          2HB       LYS 104   3.495   8.709   8.709
  812   2HB   LYS 104          1HB       LYS 104   4.782   8.090   8.090
  813   1HG   LYS 104          2HG       LYS 104   3.610   8.693   8.693
  814   2HG   LYS 104          1HG       LYS 104   2.374   7.515   7.515
  815   1HD   LYS 104          2HD       LYS 104   0.993   9.263   9.263
  816   2HD   LYS 104          1HD       LYS 104   1.853   9.630   9.630
  817   1HE   LYS 104          2HE       LYS 104   2.277  11.614  11.614
  818   2HE   LYS 104          1HE       LYS 104   3.484  10.745  10.745
  819   1HZ   LYS 104          3HZ       LYS 104   0.672  11.038  11.038
  820   2HZ   LYS 104          2HZ       LYS 104   1.875  12.158  12.158
  821   3HZ   LYS 104          1HZ       LYS 104   2.007  10.553  10.553
  822    H    ASN 105           H        ASN 105   3.094   6.592   6.592
  823    HA   ASN 105           HA       ASN 105   5.899   6.241   6.241
  824   1HB   ASN 105          2HB       ASN 105   3.420   6.966   6.966
  825   2HB   ASN 105          1HB       ASN 105   4.748   6.250   6.250
  826   1HD2  ASN 105          2HD2      ASN 105   4.830  10.101  10.101
  827   2HD2  ASN 105          1HD2      ASN 105   3.450   9.076   9.076
  828    H    ILE 106           H        ILE 106   2.907   4.405   4.405
  829    HA   ILE 106           HA       ILE 106   3.836   2.305   2.305
  830    HB   ILE 106           HB       ILE 106   1.448   2.709   2.709
  831   1HG1  ILE 106          2HG1      ILE 106   0.804   0.367   0.367
  832   2HG1  ILE 106          1HG1      ILE 106   2.366  -0.054  -0.054
  833   1HG2  ILE 106          3HG2      ILE 106   1.736   3.182   3.182
  834   2HG2  ILE 106          2HG2      ILE 106   1.935   1.450   1.450
  835   3HG2  ILE 106          1HG2      ILE 106   0.415   2.078   2.078
  836   1HD1  ILE 106          3HD1      ILE 106   2.564   1.335   1.335
  837   2HD1  ILE 106          2HD1      ILE 106   1.700  -0.201  -0.201
  838   3HD1  ILE 106          1HD1      ILE 106   3.342  -0.148  -0.148
  839    H    CYS 107           H        CYS 107   3.634   2.568   2.568
  840    HA   CYS 107           HA       CYS 107   4.673   0.075   0.075
  841   1HB   CYS 107          2HB       CYS 107   5.466   1.152   1.152
  842   2HB   CYS 107          1HB       CYS 107   3.795   1.550   1.550
  843    HG   CYS 107           HG       CYS 107   6.173   3.533   3.533
  844    H    GLN 108           H        GLN 108   6.227   3.002   3.002
  845    HA   GLN 108           HA       GLN 108   8.918   2.236   2.236
  846   1HB   GLN 108          2HB       GLN 108   7.526   4.327   4.327
  847   2HB   GLN 108          1HB       GLN 108   9.195   3.967   3.967
  848   1HG   GLN 108          2HG       GLN 108   8.598   4.421   4.421
  849   2HG   GLN 108          1HG       GLN 108   8.490   5.815   5.815
  850   1HE2  GLN 108          2HE2      GLN 108  12.124   3.957   3.957
  851   2HE2  GLN 108          1HE2      GLN 108  10.663   3.064   3.064
  852    H    PHE 109           H        PHE 109   6.870   2.212   2.212
  853    HA   PHE 109           HA       PHE 109   8.679   1.083   1.083
  854   1HB   PHE 109          2HB       PHE 109   6.491   2.133   2.133
  855   2HB   PHE 109          1HB       PHE 109   5.676   0.710   0.710
  856    HD1  PHE 109           HD2      PHE 109   8.358   1.583   1.583
  857    HD2  PHE 109           HD1      PHE 109   5.044  -0.907  -0.907
  858    HE1  PHE 109           HE2      PHE 109   8.530   0.512   0.512
  859    HE2  PHE 109           HE1      PHE 109   5.206  -1.979  -1.979
  860    HZ   PHE 109           HZ       PHE 109   6.951  -1.270  -1.270
  861    H    LEU 110           H        LEU 110   6.403  -0.436  -0.436
  862    HA   LEU 110           HA       LEU 110   6.677  -3.082  -3.082
  863   1HB   LEU 110          2HB       LEU 110   5.816  -1.746  -1.746
  864   2HB   LEU 110          1HB       LEU 110   6.197  -3.454  -3.454
  865    HG   LEU 110           HG       LEU 110   4.453  -4.039  -4.039
  866   1HD1  LEU 110          2HD1      LEU 110   4.881  -2.240  -2.240
  867   2HD1  LEU 110          1HD1      LEU 110   4.032  -1.114  -1.114
  868   3HD1  LEU 110          3HD1      LEU 110   3.169  -2.477  -2.477
  869   1HD2  LEU 110          1HD2      LEU 110   3.891  -3.087  -3.087
  870   2HD2  LEU 110          3HD2      LEU 110   2.597  -3.461  -3.461
  871   3HD2  LEU 110          2HD2      LEU 110   3.126  -1.793  -1.793
  872    H    VAL 111           H        VAL 111   8.688  -1.098  -1.098
  873    HA   VAL 111           HA       VAL 111  10.416  -3.378  -3.378
  874    HB   VAL 111           HB       VAL 111  10.614  -0.506  -0.506
  875   1HG1  VAL 111          3HG1      VAL 111  12.244  -2.938  -2.938
  876   2HG1  VAL 111          2HG1      VAL 111  11.968  -1.854  -1.854
  877   3HG1  VAL 111          1HG1      VAL 111  12.736  -1.247  -1.247
  878   1HG2  VAL 111          1HG2      VAL 111   8.625  -2.141  -2.141
  879   2HG2  VAL 111          3HG2      VAL 111   9.345  -0.989  -0.989
  880   3HG2  VAL 111          2HG2      VAL 111   9.840  -2.682  -2.682
  881    H    GLU 112           H        GLU 112  10.173  -0.639  -0.639
  882    HA   GLU 112           HA       GLU 112  12.903  -0.244  -0.244
  883   1HB   GLU 112          2HB       GLU 112  10.315   0.744   0.744
  884   2HB   GLU 112          1HB       GLU 112  11.362   0.517   0.517
  885   1HG   GLU 112          2HG       GLU 112  11.396   2.785   2.785
  886   2HG   GLU 112          1HG       GLU 112  12.974   2.007   2.007
  887    H    ILE 113           H        ILE 113  10.289  -2.105  -2.105
  888    HA   ILE 113           HA       ILE 113  12.160  -3.221  -3.221
  889    HB   ILE 113           HB       ILE 113  10.271  -4.018  -4.018
  890   1HG1  ILE 113          2HG1      ILE 113   8.725  -3.399  -3.399
  891   2HG1  ILE 113          1HG1      ILE 113   8.879  -4.946  -4.946
  892   1HG2  ILE 113          3HG2      ILE 113  10.778  -1.565  -1.565
  893   2HG2  ILE 113          2HG2      ILE 113   9.460  -1.328  -1.328
  894   3HG2  ILE 113          1HG2      ILE 113   9.127  -1.989  -1.989
  895   1HD1  ILE 113          2HD1      ILE 113   7.728  -3.147  -3.147
  896   2HD1  ILE 113          1HD1      ILE 113   6.887  -2.940  -2.940
  897   3HD1  ILE 113          3HD1      ILE 113   6.980  -4.534  -4.534
  898    H    GLY 114           H        GLY 114  10.402  -4.085  -4.085
  899   1HA   GLY 114          2HA       GLY 114  11.114  -5.942  -5.942
  900   2HA   GLY 114          1HA       GLY 114  11.604  -6.768  -6.768
  901    H    LEU 115           H        LEU 115   8.569  -5.079  -5.079
  902    HA   LEU 115           HA       LEU 115   7.109  -7.442  -7.442
  903   1HB   LEU 115          2HB       LEU 115   6.715  -4.695  -4.695
  904   2HB   LEU 115          1HB       LEU 115   5.487  -5.214  -5.214
  905    HG   LEU 115           HG       LEU 115   4.479  -6.656  -6.656
  906   1HD1  LEU 115          1HD1      LEU 115   7.047  -6.346  -6.346
  907   2HD1  LEU 115          3HD1      LEU 115   5.567  -6.722  -6.722
  908   3HD1  LEU 115          2HD1      LEU 115   6.138  -7.806  -7.806
  909   1HD2  LEU 115          2HD2      LEU 115   4.653  -3.943  -3.943
  910   2HD2  LEU 115          1HD2      LEU 115   3.514  -5.033  -5.033
  911   3HD2  LEU 115          3HD2      LEU 115   5.022  -4.599  -4.599
  912    H    ALA 116           H        ALA 116   6.428  -5.169  -5.169
  913    HA   ALA 116           HA       ALA 116   5.460  -7.414  -7.414
  914   1HB   ALA 116          2HB       ALA 116   4.201  -5.180  -5.180
  915   2HB   ALA 116          1HB       ALA 116   5.301  -4.551  -4.551
  916   3HB   ALA 116          3HB       ALA 116   4.227  -5.895  -5.895
  917    H    LYS 117           H        LYS 117   6.220  -7.820  -7.820
  918    HA   LYS 117           HA       LYS 117   9.014  -7.218  -7.218
  919   1HB   LYS 117          2HB       LYS 117   7.073  -9.109  -9.109
  920   2HB   LYS 117          1HB       LYS 117   8.184  -8.480  -8.480
  921   1HG   LYS 117          2HG       LYS 117   9.339  -9.420  -9.420
  922   2HG   LYS 117          1HG       LYS 117   8.725 -10.634 -10.634
  923   1HD   LYS 117          2HD       LYS 117  10.770 -10.495 -10.495
  924   2HD   LYS 117          1HD       LYS 117  10.142  -9.027  -9.027
  925   1HE   LYS 117          2HE       LYS 117  11.065  -7.681  -7.681
  926   2HE   LYS 117          1HE       LYS 117  11.619  -9.130  -9.130
  927   1HZ   LYS 117          3HZ       LYS 117  12.770  -9.434  -9.434
  928   2HZ   LYS 117          2HZ       LYS 117  12.777  -7.746  -7.746
  929   3HZ   LYS 117          1HZ       LYS 117  13.521  -8.685  -8.685
  930    H    ASP 118           H        ASP 118   9.939  -6.077  -6.077
  931    HA   ASP 118           HA       ASP 118   8.747  -3.700  -3.700
  932   1HB   ASP 118          2HB       ASP 118  10.758  -5.105  -5.105
  933   2HB   ASP 118          1HB       ASP 118  10.526  -3.372  -3.372
  934    H    ASP 119           H        ASP 119   8.510  -6.836  -6.836
  935    HA   ASP 119           HA       ASP 119   7.224  -5.870  -5.870
  936   1HB   ASP 119          2HB       ASP 119   7.908  -8.546  -8.546
  937   2HB   ASP 119          1HB       ASP 119   6.643  -8.464  -8.464
  938    H    GLN 120           H        GLN 120   6.289  -6.938  -6.938
  939    HA   GLN 120           HA       GLN 120   3.513  -7.319  -7.319
  940   1HB   GLN 120          2HB       GLN 120   4.982  -7.189  -7.189
  941   2HB   GLN 120          1HB       GLN 120   3.256  -7.483  -7.483
  942   1HG   GLN 120          2HG       GLN 120   3.827  -9.475  -9.475
  943   2HG   GLN 120          1HG       GLN 120   5.507  -9.227  -9.227
  944   1HE2  GLN 120          2HE2      GLN 120   2.848 -10.167 -10.167
  945   2HE2  GLN 120          1HE2      GLN 120   2.400  -9.085  -9.085
  946    H    LEU 121           H        LEU 121   5.476  -4.647  -4.647
  947    HA   LEU 121           HA       LEU 121   3.962  -2.918  -2.918
  948   1HB   LEU 121          2HB       LEU 121   5.763  -2.414  -2.414
  949   2HB   LEU 121          1HB       LEU 121   5.004  -1.104  -1.104
  950    HG   LEU 121           HG       LEU 121   6.788  -3.155  -3.155
  951   1HD1  LEU 121          1HD1      LEU 121   7.434  -0.539  -0.539
  952   2HD1  LEU 121          3HD1      LEU 121   8.413  -1.158  -1.158
  953   3HD1  LEU 121          2HD1      LEU 121   8.256  -2.096  -2.096
  954   1HD2  LEU 121          3HD2      LEU 121   5.255  -0.811  -0.811
  955   2HD2  LEU 121          2HD2      LEU 121   5.790  -2.234  -2.234
  956   3HD2  LEU 121          1HD2      LEU 121   6.912  -0.907  -0.907
  957    H    LYS 122           H        LYS 122   1.769  -3.274  -3.274
  958    HA   LYS 122           HA       LYS 122   0.781  -2.275  -2.275
  959   1HB   LYS 122          2HB       LYS 122  -0.120  -4.389  -4.389
  960   2HB   LYS 122          1HB       LYS 122  -1.405  -3.387  -3.387
  961   1HG   LYS 122          2HG       LYS 122   0.668  -4.820  -4.820
  962   2HG   LYS 122          1HG       LYS 122  -0.962  -5.421  -5.421
  963   1HD   LYS 122          2HD       LYS 122  -1.931  -3.933  -3.933
  964   2HD   LYS 122          1HD       LYS 122  -0.734  -2.678  -2.678
  965   1HE   LYS 122          2HE       LYS 122   0.879  -3.789  -3.789
  966   2HE   LYS 122          1HE       LYS 122  -0.206  -5.158  -5.158
  967   1HZ   LYS 122          1HZ       LYS 122  -1.330  -2.602  -2.602
  968   2HZ   LYS 122          3HZ       LYS 122  -0.004  -3.073  -3.073
  969   3HZ   LYS 122          2HZ       LYS 122  -1.360  -4.077  -4.077
  970    H    VAL 123           H        VAL 123   0.900  -0.078  -0.078
  971    HA   VAL 123           HA       VAL 123  -0.661   0.872   0.872
  972    HB   VAL 123           HB       VAL 123   0.537   2.958   2.958
  973   1HG1  VAL 123          1HG1      VAL 123  -0.080   2.450   2.450
  974   2HG1  VAL 123          3HG1      VAL 123   1.676   2.277   2.277
  975   3HG1  VAL 123          2HG1      VAL 123   0.945   3.779   3.779
  976   1HG2  VAL 123          1HG2      VAL 123   2.369   0.707   0.707
  977   2HG2  VAL 123          3HG2      VAL 123   2.192   1.476   1.476
  978   3HG2  VAL 123          2HG2      VAL 123   2.928   2.362   2.362
  979    H    HIS 124           H        HIS 124  -2.629   1.730   1.730
  980    HA   HIS 124           HA       HIS 124  -3.386   2.804   2.804
  981   1HB   HIS 124          2HB       HIS 124  -5.233   1.080   1.080
  982   2HB   HIS 124          1HB       HIS 124  -5.495   1.677   1.677
  983    HD1  HIS 124           HD1      HIS 124  -4.929   0.087   0.087
  984    HD2  HIS 124           HD2      HIS 124  -2.952  -0.820  -0.820
  985    HE1  HIS 124           HE1      HIS 124  -3.698  -2.058  -2.058
  986    HE2  HIS 124           HE2      HIS 124  -2.648  -2.667  -2.667
  987    H    GLY 125           H        GLY 125  -2.779   4.750   4.750
  988   1HA   GLY 125          2HA       GLY 125  -4.293   5.607   5.607
  989   2HA   GLY 125          1HA       GLY 125  -3.475   6.671   6.671
  990    H    PHE 126           HN       PHE 126  -6.387   6.008   6.008
  991    HA   PHE 126           HA       PHE 126  -8.272   5.934   5.934
  992   1HB   PHE 126          2HB       PHE 126  -9.799   6.517   6.517
  993   2HB   PHE 126          1HB       PHE 126  -8.435   6.139   6.139
  994    HD1  PHE 126           HD1      PHE 126  -6.765   8.368   8.368
  995    HD2  PHE 126           HD2      PHE 126 -10.998   8.316   8.316
  996    HE1  PHE 126           HE1      PHE 126  -6.891  10.629  10.629
  997    HE2  PHE 126           HE2      PHE 126 -11.131  10.576  10.576
  998    HZ   PHE 126           HZ       PHE 126  -9.076  11.737  11.737

  Start of MODEL   28
    1   1H    MET   1          3H        MET   1 -17.784 -17.947 -17.947
    2   2H    MET   1          2H        MET   1 -16.847 -17.199 -17.199
    3   3H    MET   1          1H        MET   1 -17.653 -18.681 -18.681
    4    HA   MET   1           HA       MET   1 -16.251 -19.884 -19.884
    5   1HB   MET   1          2HB       MET   1 -15.102 -17.912 -17.912
    6   2HB   MET   1          1HB       MET   1 -13.937 -18.656 -18.656
    7   1HG   MET   1          2HG       MET   1 -13.916 -20.511 -20.511
    8   2HG   MET   1          1HG       MET   1 -15.667 -20.663 -20.663
    9   1HE   MET   1          3HE       MET   1 -16.906 -21.032 -21.032
   10   2HE   MET   1          2HE       MET   1 -17.361 -19.329 -19.329
   11   3HE   MET   1          1HE       MET   1 -16.895 -20.060 -20.060
   12    H    ARG   2           H        ARG   2 -15.196 -20.127 -20.127
   13    HA   ARG   2           HA       ARG   2 -15.033 -17.824 -17.824
   14   1HB   ARG   2          2HB       ARG   2 -14.425 -19.513 -19.513
   15   2HB   ARG   2          1HB       ARG   2 -15.962 -19.835 -19.835
   16   1HG   ARG   2          2HG       ARG   2 -15.275 -21.857 -21.857
   17   2HG   ARG   2          1HG       ARG   2 -13.907 -21.170 -21.170
   18   1HD   ARG   2          2HD       ARG   2 -13.211 -22.775 -22.775
   19   2HD   ARG   2          1HD       ARG   2 -12.572 -21.155 -21.155
   20    HE   ARG   2           HE       ARG   2 -13.742 -21.083 -21.083
   21   1HH1  ARG   2          2HH1      ARG   2 -15.107 -23.590 -23.590
   22   2HH1  ARG   2          1HH1      ARG   2 -16.180 -24.165 -24.165
   23   1HH2  ARG   2          1HH2      ARG   2 -15.153 -21.838 -21.838
   24   2HH2  ARG   2          2HH2      ARG   2 -16.207 -23.170 -23.170
   25    H    GLY   3           H        GLY   3 -13.142 -17.186 -17.186
   26   1HA   GLY   3          2HA       GLY   3 -10.879 -16.853 -16.853
   27   2HA   GLY   3          1HA       GLY   3 -10.582 -18.312 -18.312
   28    H    SER   4           H        SER   4 -12.403 -15.515 -15.515
   29    HA   SER   4           HA       SER   4 -10.169 -14.584 -14.584
   30   1HB   SER   4          2HB       SER   4 -11.717 -16.455 -16.455
   31   2HB   SER   4          1HB       SER   4 -12.657 -15.017 -15.017
   32    HG   SER   4           HG       SER   4 -10.727 -15.824 -15.824
   33    H    HIS   5           H        HIS   5 -13.647 -14.273 -14.273
   34    HA   HIS   5           HA       HIS   5 -14.976 -12.462 -12.462
   35   1HB   HIS   5          2HB       HIS   5 -12.442 -10.891 -10.891
   36   2HB   HIS   5          1HB       HIS   5 -14.049 -10.551 -10.551
   37    HD1  HIS   5           HD1      HIS   5 -14.462 -13.660 -13.660
   38    HD2  HIS   5           HD2      HIS   5 -11.373 -11.111 -11.111
   39    HE1  HIS   5           HE1      HIS   5 -13.548 -14.603 -14.603
   40    HE2  HIS   5           HE2      HIS   5 -11.620 -13.095 -13.095
   41    H    HIS   6           H        HIS   6 -15.628 -10.366 -10.366
   42    HA   HIS   6           HA       HIS   6 -14.472  -9.962  -9.962
   43   1HB   HIS   6          2HB       HIS   6 -17.295  -9.896  -9.896
   44   2HB   HIS   6          1HB       HIS   6 -16.850  -8.930  -8.930
   45    HD1  HIS   6           HD1      HIS   6 -14.862 -11.072 -11.072
   46    HD2  HIS   6           HD2      HIS   6 -18.762 -11.783 -11.783
   47    HE1  HIS   6           HE1      HIS   6 -15.610 -13.114 -13.114
   48    HE2  HIS   6           HE2      HIS   6 -17.993 -13.492 -13.492
   49    H    HIS   7           H        HIS   7 -14.574  -8.582  -8.582
   50    HA   HIS   7           HA       HIS   7 -14.860  -5.834  -5.834
   51   1HB   HIS   7          2HB       HIS   7 -14.938  -7.196  -7.196
   52   2HB   HIS   7          1HB       HIS   7 -14.214  -5.592  -5.592
   53    HD1  HIS   7           HD1      HIS   7 -17.466  -7.358  -7.358
   54    HD2  HIS   7           HD2      HIS   7 -15.987  -3.479  -3.479
   55    HE1  HIS   7           HE1      HIS   7 -19.492  -5.869  -5.869
   56    HE2  HIS   7           HE2      HIS   7 -18.572  -3.523  -3.523
   57    H    HIS   8           H        HIS   8 -12.507  -7.802  -7.802
   58    HA   HIS   8           HA       HIS   8 -10.241  -7.711  -7.711
   59   1HB   HIS   8          2HB       HIS   8 -10.548  -4.719  -4.719
   60   2HB   HIS   8          1HB       HIS   8  -9.301  -5.612  -5.612
   61    HD1  HIS   8           HD1      HIS   8 -11.024  -7.507  -7.507
   62    HD2  HIS   8           HD2      HIS   8 -11.855  -3.468  -3.468
   63    HE1  HIS   8           HE1      HIS   8 -12.444  -6.860  -6.860
   64    HE2  HIS   8           HE2      HIS   8 -12.871  -4.393  -4.393
   65    H    HIS   9           H        HIS   9  -8.254  -6.208  -6.208
   66    HA   HIS   9           HA       HIS   9  -8.689  -6.021  -6.021
   67   1HB   HIS   9          2HB       HIS   9  -7.156  -8.094  -8.094
   68   2HB   HIS   9          1HB       HIS   9  -6.169  -7.193  -7.193
   69    HD1  HIS   9           HD1      HIS   9  -8.399  -9.990  -9.990
   70    HD2  HIS   9           HD2      HIS   9  -7.518  -7.091  -7.091
   71    HE1  HIS   9           HE1      HIS   9  -9.225 -10.920 -10.920
   72    HE2  HIS   9           HE2      HIS   9  -8.604  -9.185  -9.185
   73    H    HIS  10           H        HIS  10  -6.050  -5.834  -5.834
   74    HA   HIS  10           HA       HIS  10  -5.075  -3.416  -3.416
   75   1HB   HIS  10          2HB       HIS  10  -3.858  -5.286  -5.286
   76   2HB   HIS  10          1HB       HIS  10  -3.126  -3.735  -3.735
   77    HD1  HIS  10           HD1      HIS  10  -2.449  -6.995  -6.995
   78    HD2  HIS  10           HD2      HIS  10  -3.205  -3.760  -3.760
   79    HE1  HIS  10           HE1      HIS  10  -1.429  -7.603  -7.603
   80    HE2  HIS  10           HE2      HIS  10  -1.973  -5.666  -5.666
   81    H    THR  11           H        THR  11  -6.290  -1.726  -1.726
   82    HA   THR  11           HA       THR  11  -7.300  -1.417  -1.417
   83    HB   THR  11           HB       THR  11  -7.433   1.083   1.083
   84    HG1  THR  11           HG1      THR  11  -6.415   1.244   1.244
   85   1HG2  THR  11          1HG2      THR  11  -9.001  -1.165  -1.165
   86   2HG2  THR  11          3HG2      THR  11  -9.414   0.543   0.543
   87   3HG2  THR  11          2HG2      THR  11  -9.417  -0.229  -0.229
   88    H    ASP  12           H        ASP  12  -4.372  -0.287  -0.287
   89    HA   ASP  12           HA       ASP  12  -3.512   0.973   0.973
   90   1HB   ASP  12          2HB       ASP  12  -2.925   1.481   1.481
   91   2HB   ASP  12          1HB       ASP  12  -1.619   1.767   1.767
   92    HA   PRO  13           HA       PRO  13  -0.936  -2.707  -2.707
   93   1HB   PRO  13          2HB       PRO  13   0.136  -2.041  -2.041
   94   2HB   PRO  13          1HB       PRO  13  -1.479  -2.734  -2.734
   95   1HG   PRO  13          2HG       PRO  13  -0.675   0.127   0.127
   96   2HG   PRO  13          1HG       PRO  13  -1.999  -0.768  -0.768
   97   1HD   PRO  13          2HD       PRO  13  -2.404   0.901   0.901
   98   2HD   PRO  13          1HD       PRO  13  -3.372  -0.567  -0.567
   99    H    MET  14           H        MET  14   0.050   0.633   0.633
  100    HA   MET  14           HA       MET  14   2.807   0.387   0.387
  101   1HB   MET  14          2HB       MET  14   1.186   2.381   2.381
  102   2HB   MET  14          1HB       MET  14   2.907   2.543   2.543
  103   1HG   MET  14          2HG       MET  14   1.018   2.187   2.187
  104   2HG   MET  14          1HG       MET  14   1.157   3.761   3.761
  105   1HE   MET  14          3HE       MET  14   1.680   2.662   2.662
  106   2HE   MET  14          2HE       MET  14   3.349   2.827   2.827
  107   3HE   MET  14          1HE       MET  14   2.836   1.363   1.363
  108    H    SER  15           H        SER  15   0.743  -0.432  -0.432
  109    HA   SER  15           HA       SER  15   2.505  -0.263  -0.263
  110   1HB   SER  15          2HB       SER  15   0.517  -2.506  -2.506
  111   2HB   SER  15          1HB       SER  15   0.992  -1.609  -1.609
  112    HG   SER  15           HG       SER  15  -0.379  -0.068  -0.068
  113    H    ALA  16           H        ALA  16   1.927  -2.955  -2.955
  114    HA   ALA  16           HA       ALA  16   4.549  -4.043  -4.043
  115   1HB   ALA  16          2HB       ALA  16   2.862  -5.376  -5.376
  116   2HB   ALA  16          1HB       ALA  16   2.034  -5.657  -5.657
  117   3HB   ALA  16          3HB       ALA  16   3.645  -6.321  -6.321
  118    H    ILE  17           H        ILE  17   5.567  -3.324  -3.324
  119    HA   ILE  17           HA       ILE  17   4.463  -4.156  -4.156
  120    HB   ILE  17           HB       ILE  17   6.802  -2.318  -2.318
  121   1HG1  ILE  17          2HG1      ILE  17   4.204  -1.247  -1.247
  122   2HG1  ILE  17          1HG1      ILE  17   4.284  -1.713  -1.713
  123   1HG2  ILE  17          2HG2      ILE  17   6.790  -3.361  -3.361
  124   2HG2  ILE  17          1HG2      ILE  17   5.132  -2.816  -2.816
  125   3HG2  ILE  17          3HG2      ILE  17   6.436  -1.638  -1.638
  126   1HD1  ILE  17          2HD1      ILE  17   6.367   0.063   0.063
  127   2HD1  ILE  17          1HD1      ILE  17   4.823   0.709   0.709
  128   3HD1  ILE  17          3HD1      ILE  17   5.891  -0.117  -0.117
  129    H    GLN  18           H        GLN  18   5.052  -6.395  -6.395
  130    HA   GLN  18           HA       GLN  18   6.359  -8.224  -8.224
  131   1HB   GLN  18          2HB       GLN  18   8.368  -6.357  -6.357
  132   2HB   GLN  18          1HB       GLN  18   8.167  -8.076  -8.076
  133   1HG   GLN  18          2HG       GLN  18   5.731  -7.234  -7.234
  134   2HG   GLN  18          1HG       GLN  18   6.652  -5.773  -5.773
  135   1HE2  GLN  18          2HE2      GLN  18   8.442  -7.163  -7.163
  136   2HE2  GLN  18          1HE2      GLN  18   8.461  -5.959  -5.959
  137    H    ASN  19           H        ASN  19   6.529  -7.038  -7.038
  138    HA   ASN  19           HA       ASN  19   9.242  -7.819  -7.819
  139   1HB   ASN  19          2HB       ASN  19   9.181  -5.328  -5.328
  140   2HB   ASN  19          1HB       ASN  19   7.919  -5.306  -5.306
  141   1HD2  ASN  19          2HD2      ASN  19  10.133  -5.384  -5.384
  142   2HD2  ASN  19          1HD2      ASN  19   8.542  -5.090  -5.090
  143    H    LEU  20           H        LEU  20   8.572  -9.674  -9.674
  144    HA   LEU  20           HA       LEU  20   7.391  -9.412  -9.412
  145   1HB   LEU  20          2HB       LEU  20   5.752 -10.221 -10.221
  146   2HB   LEU  20          1HB       LEU  20   5.716 -11.376 -11.376
  147    HG   LEU  20           HG       LEU  20   5.130  -8.442  -8.442
  148   1HD1  LEU  20          3HD1      LEU  20   3.551  -9.616  -9.616
  149   2HD1  LEU  20          2HD1      LEU  20   3.101 -10.650 -10.650
  150   3HD1  LEU  20          1HD1      LEU  20   2.817  -8.912  -8.912
  151   1HD2  LEU  20          1HD2      LEU  20   4.697 -10.877 -10.877
  152   2HD2  LEU  20          3HD2      LEU  20   5.788  -9.526  -9.526
  153   3HD2  LEU  20          2HD2      LEU  20   4.043  -9.277  -9.277
  154    H    HIS  21           H        HIS  21   9.838 -10.402 -10.402
  155    HA   HIS  21           HA       HIS  21   9.809 -13.262 -13.262
  156   1HB   HIS  21          2HB       HIS  21  11.439 -11.724 -11.724
  157   2HB   HIS  21          1HB       HIS  21  12.283 -11.568 -11.568
  158    HD1  HIS  21           HD1      HIS  21  12.249 -14.416 -14.416
  159    HD2  HIS  21           HD2      HIS  21  12.996 -13.434 -13.434
  160    HE1  HIS  21           HE1      HIS  21  13.529 -16.364 -16.364
  161    HE2  HIS  21           HE2      HIS  21  13.892 -15.785 -15.785
  162    H    SER  22           H        SER  22  10.452 -10.682 -10.682
  163    HA   SER  22           HA       SER  22  11.434 -12.554 -12.554
  164   1HB   SER  22          2HB       SER  22  11.358  -9.576  -9.576
  165   2HB   SER  22          1HB       SER  22  11.455 -10.281 -10.281
  166    HG   SER  22           HG       SER  22  13.330 -10.240 -10.240
  167    H    PHE  23           H        PHE  23   9.040 -13.409 -13.409
  168    HA   PHE  23           HA       PHE  23   7.631 -12.888 -12.888
  169   1HB   PHE  23          2HB       PHE  23   6.961 -11.012 -11.012
  170   2HB   PHE  23          1HB       PHE  23   6.013 -12.279 -12.279
  171    HD1  PHE  23           HD2      PHE  23   6.655 -11.459 -11.459
  172    HD2  PHE  23           HD1      PHE  23   3.792 -11.932 -11.932
  173    HE1  PHE  23           HE2      PHE  23   4.839 -11.079 -11.079
  174    HE2  PHE  23           HE1      PHE  23   1.971 -11.553 -11.553
  175    HZ   PHE  23           HZ       PHE  23   2.494 -11.125 -11.125
  176    H    ASP  24           H        ASP  24   7.344 -14.955 -14.955
  177    HA   ASP  24           HA       ASP  24   6.671 -17.126 -17.126
  178   1HB   ASP  24          2HB       ASP  24   4.766 -15.769 -15.769
  179   2HB   ASP  24          1HB       ASP  24   4.772 -17.530 -17.530
  180    HA   PRO  25           HA       PRO  25   9.504 -17.816 -17.816
  181   1HB   PRO  25          2HB       PRO  25  10.913 -19.437 -19.437
  182   2HB   PRO  25          1HB       PRO  25  11.559 -18.246 -18.246
  183   1HG   PRO  25          2HG       PRO  25  11.360 -17.706 -17.706
  184   2HG   PRO  25          1HG       PRO  25  11.058 -16.460 -16.460
  185   1HD   PRO  25          2HD       PRO  25   9.099 -18.053 -18.053
  186   2HD   PRO  25          1HD       PRO  25   9.060 -16.333 -16.333
  187    H    PHE  26           H        PHE  26   7.971 -19.843 -19.843
  188    HA   PHE  26           HA       PHE  26   8.139 -22.170 -22.170
  189   1HB   PHE  26          2HB       PHE  26   6.764 -22.565 -22.565
  190   2HB   PHE  26          1HB       PHE  26   8.096 -23.468 -23.468
  191    HD1  PHE  26           HD1      PHE  26  10.378 -22.001 -22.001
  192    HD2  PHE  26           HD2      PHE  26   7.181 -21.594 -21.594
  193    HE1  PHE  26           HE1      PHE  26  11.924 -20.992 -20.992
  194    HE2  PHE  26           HE2      PHE  26   8.721 -20.583 -20.583
  195    HZ   PHE  26           HZ       PHE  26  11.096 -20.280 -20.280
  196    H    ALA  27           H        ALA  27   6.495 -20.046 -20.046
  197    HA   ALA  27           HA       ALA  27   3.854 -21.332 -21.332
  198   1HB   ALA  27          2HB       ALA  27   3.939 -19.279 -19.279
  199   2HB   ALA  27          1HB       ALA  27   4.290 -18.350 -18.350
  200   3HB   ALA  27          3HB       ALA  27   2.753 -19.201 -19.201
  201    H    ASP  28           H        ASP  28   4.365 -22.357 -22.357
  202    HA   ASP  28           HA       ASP  28   3.377 -21.074 -21.074
  203   1HB   ASP  28          2HB       ASP  28   6.210 -20.610 -20.610
  204   2HB   ASP  28          1HB       ASP  28   5.928 -21.386 -21.386
  205    H    ALA  29           H        ALA  29   2.309 -23.106 -23.106
  206    HA   ALA  29           HA       ALA  29   3.540 -25.075 -25.075
  207   1HB   ALA  29          3HB       ALA  29   3.128 -25.709 -25.709
  208   2HB   ALA  29          2HB       ALA  29   3.285 -26.947 -26.947
  209   3HB   ALA  29          1HB       ALA  29   4.615 -25.830 -25.830
  210    H    SER  30           H        SER  30   2.001 -26.007 -26.007
  211    HA   SER  30           HA       SER  30  -0.721 -25.350 -25.350
  212   1HB   SER  30          2HB       SER  30   0.635 -27.431 -27.431
  213   2HB   SER  30          1HB       SER  30  -1.086 -27.060 -27.060
  214    HG   SER  30           HG       SER  30  -0.600 -25.011 -25.011
  215    H    LYS  31           H        LYS  31  -2.445 -26.478 -26.478
  216    HA   LYS  31           HA       LYS  31  -3.589 -27.938 -27.938
  217   1HB   LYS  31          2HB       LYS  31  -1.557 -30.039 -30.039
  218   2HB   LYS  31          1HB       LYS  31  -3.262 -30.251 -30.251
  219   1HG   LYS  31          2HG       LYS  31  -2.125 -28.956 -28.956
  220   2HG   LYS  31          1HG       LYS  31  -2.855 -30.560 -30.560
  221   1HD   LYS  31          2HD       LYS  31  -4.515 -28.345 -28.345
  222   2HD   LYS  31          1HD       LYS  31  -4.194 -28.326 -28.326
  223   1HE   LYS  31          2HE       LYS  31  -5.909 -29.745 -29.745
  224   2HE   LYS  31          1HE       LYS  31  -4.807 -30.960 -30.960
  225   1HZ   LYS  31          3HZ       LYS  31  -5.594 -30.331 -30.331
  226   2HZ   LYS  31          2HZ       LYS  31  -6.745 -29.316 -29.316
  227   3HZ   LYS  31          1HZ       LYS  31  -6.812 -30.984 -30.984
  228    H    GLY  32           H        GLY  32  -1.493 -26.363 -26.363
  229   1HA   GLY  32          2HA       GLY  32  -0.627 -28.168 -28.168
  230   2HA   GLY  32          1HA       GLY  32   0.267 -26.741 -26.741
  231    H    ASP  33           H        ASP  33  -1.872 -27.961 -27.961
  232    HA   ASP  33           HA       ASP  33  -3.465 -25.668 -25.668
  233   1HB   ASP  33          2HB       ASP  33  -3.819 -28.131 -28.131
  234   2HB   ASP  33          1HB       ASP  33  -2.762 -27.711 -27.711
  235    H    ASP  34           H        ASP  34  -1.863 -23.983 -23.983
  236    HA   ASP  34           HA       ASP  34  -0.048 -23.903 -23.903
  237   1HB   ASP  34          2HB       ASP  34   0.442 -23.264 -23.264
  238   2HB   ASP  34          1HB       ASP  34  -0.040 -21.686 -21.686
  239    H    LEU  35           H        LEU  35  -2.912 -23.577 -23.577
  240    HA   LEU  35           HA       LEU  35  -3.386 -20.764 -20.764
  241   1HB   LEU  35          2HB       LEU  35  -4.988 -23.020 -23.020
  242   2HB   LEU  35          1HB       LEU  35  -5.274 -22.545 -22.545
  243    HG   LEU  35           HG       LEU  35  -5.887 -20.282 -20.282
  244   1HD1  LEU  35          1HD1      LEU  35  -5.102 -21.416 -21.416
  245   2HD1  LEU  35          3HD1      LEU  35  -6.397 -20.222 -20.222
  246   3HD1  LEU  35          2HD1      LEU  35  -4.793 -19.819 -19.819
  247   1HD2  LEU  35          1HD2      LEU  35  -7.521 -22.231 -22.231
  248   2HD2  LEU  35          3HD2      LEU  35  -8.040 -20.833 -20.833
  249   3HD2  LEU  35          2HD2      LEU  35  -7.477 -22.288 -22.288
  250    H    LEU  36           H        LEU  36  -1.842 -20.141 -20.141
  251    HA   LEU  36           HA       LEU  36  -1.598 -21.512 -21.512
  252   1HB   LEU  36          2HB       LEU  36  -0.461 -18.941 -18.941
  253   2HB   LEU  36          1HB       LEU  36  -0.184 -19.468 -19.468
  254    HG   LEU  36           HG       LEU  36   0.462 -21.416 -21.416
  255   1HD1  LEU  36          1HD1      LEU  36   1.779 -18.773 -18.773
  256   2HD1  LEU  36          3HD1      LEU  36   2.803 -20.184 -20.184
  257   3HD1  LEU  36          2HD1      LEU  36   1.550 -19.771 -19.771
  258   1HD2  LEU  36          1HD2      LEU  36   1.632 -20.593 -20.593
  259   2HD2  LEU  36          3HD2      LEU  36   0.858 -22.119 -22.119
  260   3HD2  LEU  36          2HD2      LEU  36   2.441 -21.716 -21.716
  261    HA   PRO  37           HA       PRO  37  -4.847 -19.640 -19.640
  262   1HB   PRO  37          2HB       PRO  37  -2.794 -19.283 -19.283
  263   2HB   PRO  37          1HB       PRO  37  -4.382 -20.053 -20.053
  264   1HG   PRO  37          2HG       PRO  37  -2.169 -21.526 -21.526
  265   2HG   PRO  37          1HG       PRO  37  -3.621 -22.032 -22.032
  266   1HD   PRO  37          2HD       PRO  37  -1.099 -20.809 -20.809
  267   2HD   PRO  37          1HD       PRO  37  -2.136 -22.050 -22.050
  268    H    ALA  38           H        ALA  38  -4.957 -17.718 -17.718
  269    HA   ALA  38           HA       ALA  38  -4.975 -15.463 -15.463
  270   1HB   ALA  38          2HB       ALA  38  -5.393 -15.766 -15.766
  271   2HB   ALA  38          1HB       ALA  38  -3.864 -14.890 -14.890
  272   3HB   ALA  38          3HB       ALA  38  -5.249 -14.182 -14.182
  273    H    GLY  39           H        GLY  39  -3.559 -14.510 -14.510
  274   1HA   GLY  39          2HA       GLY  39  -0.700 -14.832 -14.832
  275   2HA   GLY  39          1HA       GLY  39  -1.429 -14.260 -14.260
  276    H    THR  40           H        THR  40  -0.659 -13.359 -13.359
  277    HA   THR  40           HA       THR  40  -0.194 -10.626 -10.626
  278    HB   THR  40           HB       THR  40  -1.432  -9.795  -9.795
  279    HG1  THR  40           HG1      THR  40  -1.837 -11.650 -11.650
  280   1HG2  THR  40          2HG2      THR  40  -2.289  -9.672  -9.672
  281   2HG2  THR  40          1HG2      THR  40  -3.298 -11.056 -11.056
  282   3HG2  THR  40          3HG2      THR  40  -3.470  -9.536  -9.536
  283    H    GLU  41           H        GLU  41   1.258 -13.078 -13.078
  284    HA   GLU  41           HA       GLU  41   2.903 -13.556 -13.556
  285   1HB   GLU  41          2HB       GLU  41   3.396 -10.991 -10.991
  286   2HB   GLU  41          1HB       GLU  41   4.063 -11.033 -11.033
  287   1HG   GLU  41          2HG       GLU  41   5.392 -12.947 -12.947
  288   2HG   GLU  41          1HG       GLU  41   4.603 -13.125 -13.125
  289    H    ASP  42           H        ASP  42   0.297 -12.697 -12.697
  290    HA   ASP  42           HA       ASP  42  -0.648 -12.044 -12.044
  291   1HB   ASP  42          2HB       ASP  42   0.601 -14.226 -14.226
  292   2HB   ASP  42          1HB       ASP  42   1.828 -13.232 -13.232
  293    H    TYR  43           H        TYR  43   0.109  -9.788  -9.788
  294    HA   TYR  43           HA       TYR  43   2.221  -8.469  -8.469
  295   1HB   TYR  43          2HB       TYR  43  -0.254  -7.238  -7.238
  296   2HB   TYR  43          1HB       TYR  43   1.260  -6.415  -6.415
  297    HD1  TYR  43           HD2      TYR  43   3.076  -8.700  -8.700
  298    HD2  TYR  43           HD1      TYR  43  -0.328  -6.754  -6.754
  299    HE1  TYR  43           HE2      TYR  43   3.887  -9.214  -9.214
  300    HE2  TYR  43           HE1      TYR  43   0.474  -7.273  -7.273
  301    HH   TYR  43           HH       TYR  43   2.429  -9.462  -9.462
  302    H    ILE  44           H        ILE  44   1.653  -6.367  -6.367
  303    HA   ILE  44           HA       ILE  44  -0.198  -7.143  -7.143
  304    HB   ILE  44           HB       ILE  44   2.278  -5.419  -5.419
  305   1HG1  ILE  44          2HG1      ILE  44   2.975  -7.676  -7.676
  306   2HG1  ILE  44          1HG1      ILE  44   2.974  -7.256  -7.256
  307   1HG2  ILE  44          2HG2      ILE  44   0.536  -4.584  -4.584
  308   2HG2  ILE  44          1HG2      ILE  44   0.333  -6.197  -6.197
  309   3HG2  ILE  44          3HG2      ILE  44   1.846  -5.321  -5.321
  310   1HD1  ILE  44          2HD1      ILE  44   0.555  -8.257  -8.257
  311   2HD1  ILE  44          1HD1      ILE  44   1.183  -9.085  -9.085
  312   3HD1  ILE  44          3HD1      ILE  44   1.969  -9.300  -9.300
  313    H    HIS  45           H        HIS  45  -2.036  -6.161  -6.161
  314    HA   HIS  45           HA       HIS  45  -2.254  -3.678  -3.678
  315   1HB   HIS  45          2HB       HIS  45  -4.022  -5.667  -5.667
  316   2HB   HIS  45          1HB       HIS  45  -4.582  -4.094  -4.094
  317    HD1  HIS  45           HD1      HIS  45  -3.484  -5.671  -5.671
  318    HD2  HIS  45           HD2      HIS  45  -6.157  -2.855  -2.855
  319    HE1  HIS  45           HE1      HIS  45  -4.817  -4.904  -4.904
  320    HE2  HIS  45           HE2      HIS  45  -6.377  -3.143  -3.143
  321    H    ILE  46           H        ILE  46  -2.492  -1.641  -1.641
  322    HA   ILE  46           HA       ILE  46  -2.665  -1.002  -1.002
  323    HB   ILE  46           HB       ILE  46  -0.434  -0.146  -0.146
  324   1HG1  ILE  46          2HG1      ILE  46  -0.767  -1.978  -1.978
  325   2HG1  ILE  46          1HG1      ILE  46   0.682  -1.656  -1.656
  326   1HG2  ILE  46          1HG2      ILE  46  -1.407   1.216   1.216
  327   2HG2  ILE  46          3HG2      ILE  46   0.197   1.472   1.472
  328   3HG2  ILE  46          2HG2      ILE  46  -1.241   1.913   1.913
  329   1HD1  ILE  46          1HD1      ILE  46  -0.114   0.015   0.015
  330   2HD1  ILE  46          3HD1      ILE  46   0.868  -1.440  -1.440
  331   3HD1  ILE  46          2HD1      ILE  46   1.456  -0.075  -0.075
  332    H    ARG  47           H        ARG  47  -4.514   0.094   0.094
  333    HA   ARG  47           HA       ARG  47  -4.799   2.271   2.271
  334   1HB   ARG  47          2HB       ARG  47  -6.266   0.262   0.262
  335   2HB   ARG  47          1HB       ARG  47  -7.099   0.639   0.639
  336   1HG   ARG  47          2HG       ARG  47  -7.469   2.963   2.963
  337   2HG   ARG  47          1HG       ARG  47  -7.028   2.204   2.204
  338   1HD   ARG  47          2HD       ARG  47  -8.992   0.699   0.699
  339   2HD   ARG  47          1HD       ARG  47  -9.548   2.291   2.291
  340    HE   ARG  47           HE       ARG  47  -9.118  -0.002  -0.002
  341   1HH1  ARG  47          2HH1      ARG  47  -9.146   3.487   3.487
  342   2HH1  ARG  47          1HH1      ARG  47  -9.481   3.634   3.634
  343   1HH2  ARG  47          1HH2      ARG  47  -9.559   0.189   0.189
  344   2HH2  ARG  47          2HH2      ARG  47  -9.717   1.762   1.762
  345    H    ILE  48           H        ILE  48  -5.900   4.123   4.123
  346    HA   ILE  48           HA       ILE  48  -5.980   4.551   4.551
  347    HB   ILE  48           HB       ILE  48  -5.653   6.446   6.446
  348   1HG1  ILE  48          2HG1      ILE  48  -4.002   6.002   6.002
  349   2HG1  ILE  48          1HG1      ILE  48  -3.637   5.335   5.335
  350   1HG2  ILE  48          3HG2      ILE  48  -6.274   7.162   7.162
  351   2HG2  ILE  48          2HG2      ILE  48  -5.663   8.295   8.295
  352   3HG2  ILE  48          1HG2      ILE  48  -7.238   7.534   7.534
  353   1HD1  ILE  48          3HD1      ILE  48  -3.920   8.284   8.284
  354   2HD1  ILE  48          2HD1      ILE  48  -2.399   7.439   7.439
  355   3HD1  ILE  48          1HD1      ILE  48  -3.113   7.427   7.427
  356    H    GLN  49           H        GLN  49  -7.726   5.848   5.848
  357    HA   GLN  49           HA       GLN  49 -10.149   6.005   6.005
  358   1HB   GLN  49          2HB       GLN  49 -11.488   5.041   5.041
  359   2HB   GLN  49          1HB       GLN  49 -10.420   3.886   3.886
  360   1HG   GLN  49          2HG       GLN  49  -8.898   4.928   4.928
  361   2HG   GLN  49          1HG       GLN  49 -10.512   4.750   4.750
  362   1HE2  GLN  49          2HE2      GLN  49  -9.995   1.400   1.400
  363   2HE2  GLN  49          1HE2      GLN  49 -10.637   2.928   2.928
  364    H    GLN  50           H        GLN  50 -10.060   8.219   8.219
  365    HA   GLN  50           HA       GLN  50  -9.881   9.621   9.621
  366   1HB   GLN  50          2HB       GLN  50  -8.951  10.205  10.205
  367   2HB   GLN  50          1HB       GLN  50 -10.373  11.232  11.232
  368   1HG   GLN  50          2HG       GLN  50  -9.503  12.239  12.239
  369   2HG   GLN  50          1HG       GLN  50  -8.119  11.153  11.153
  370   1HE2  GLN  50          2HE2      GLN  50  -6.360  13.688  13.688
  371   2HE2  GLN  50          1HE2      GLN  50  -6.556  12.670  12.670
  372    H    ARG  51           H        ARG  51 -11.683   9.842   9.842
  373    HA   ARG  51           HA       ARG  51 -14.266   9.968   9.968
  374   1HB   ARG  51          2HB       ARG  51 -13.685   9.992   9.992
  375   2HB   ARG  51          1HB       ARG  51 -15.236   9.693   9.693
  376   1HG   ARG  51          2HG       ARG  51 -14.653   7.567   7.567
  377   2HG   ARG  51          1HG       ARG  51 -12.923   7.914   7.914
  378   1HD   ARG  51          2HD       ARG  51 -12.927   6.854   6.854
  379   2HD   ARG  51          1HD       ARG  51 -13.689   8.309   8.309
  380    HE   ARG  51           HE       ARG  51 -15.610   6.514   6.514
  381   1HH1  ARG  51          2HH1      ARG  51 -13.599   7.079   7.079
  382   2HH1  ARG  51          1HH1      ARG  51 -14.648   6.225   6.225
  383   1HH2  ARG  51          1HH2      ARG  51 -16.990   5.392   5.392
  384   2HH2  ARG  51          2HH2      ARG  51 -16.573   5.267   5.267
  385    H    ASN  52           H        ASN  52 -15.326  11.806  11.806
  386    HA   ASN  52           HA       ASN  52 -15.931  13.999  13.999
  387   1HB   ASN  52          2HB       ASN  52 -14.587  14.230  14.230
  388   2HB   ASN  52          1HB       ASN  52 -15.919  15.193  15.193
  389   1HD2  ASN  52          2HD2      ASN  52 -17.015  12.493  12.493
  390   2HD2  ASN  52          1HD2      ASN  52 -15.702  13.616  13.616
  391    H    GLY  53           H        GLY  53 -13.205  13.035  13.035
  392   1HA   GLY  53          2HA       GLY  53 -11.322  13.962  13.962
  393   2HA   GLY  53          1HA       GLY  53 -12.159  15.505  15.505
  394    H    ARG  54           H        ARG  54 -11.022  13.285  13.285
  395    HA   ARG  54           HA       ARG  54  -8.830  14.903  14.903
  396   1HB   ARG  54          2HB       ARG  54  -9.647  15.882  15.882
  397   2HB   ARG  54          1HB       ARG  54 -10.705  16.375  16.375
  398   1HG   ARG  54          2HG       ARG  54 -12.337  14.686  14.686
  399   2HG   ARG  54          1HG       ARG  54 -11.274  14.190  14.190
  400   1HD   ARG  54          2HD       ARG  54 -11.775  17.054  17.054
  401   2HD   ARG  54          1HD       ARG  54 -13.257  16.110  16.110
  402    HE   ARG  54           HE       ARG  54 -11.586  14.969  14.969
  403   1HH1  ARG  54          2HH1      ARG  54 -12.689  18.232  18.232
  404   2HH1  ARG  54          1HH1      ARG  54 -12.582  18.690  18.690
  405   1HH2  ARG  54          1HH2      ARG  54 -11.444  15.570  15.570
  406   2HH2  ARG  54          2HH2      ARG  54 -11.874  17.179  17.179
  407    H    LYS  55           H        LYS  55 -11.300  12.652  12.652
  408    HA   LYS  55           HA       LYS  55  -9.574  11.440  11.440
  409   1HB   LYS  55          2HB       LYS  55 -12.321  11.305  11.305
  410   2HB   LYS  55          1HB       LYS  55 -11.688   9.667   9.667
  411   1HG   LYS  55          2HG       LYS  55 -12.610  10.208  10.208
  412   2HG   LYS  55          1HG       LYS  55 -10.891   9.814   9.814
  413   1HD   LYS  55          2HD       LYS  55 -11.337  12.650  12.650
  414   2HD   LYS  55          1HD       LYS  55 -12.122  12.068  12.068
  415   1HE   LYS  55          2HE       LYS  55  -9.826  10.885  10.885
  416   2HE   LYS  55          1HE       LYS  55  -9.224  12.104  12.104
  417   1HZ   LYS  55          3HZ       LYS  55 -10.921  13.080  13.080
  418   2HZ   LYS  55          2HZ       LYS  55  -9.407  12.490  12.490
  419   3HZ   LYS  55          1HZ       LYS  55  -9.510  13.746  13.746
  420    H    THR  56           H        THR  56  -7.828  11.303  11.303
  421    HA   THR  56           HA       THR  56  -8.027   9.176   9.176
  422    HB   THR  56           HB       THR  56  -5.325  10.006  10.006
  423    HG1  THR  56           HG1      THR  56  -5.730  12.034  12.034
  424   1HG2  THR  56          2HG2      THR  56  -6.860   9.512   9.512
  425   2HG2  THR  56          1HG2      THR  56  -5.797  10.915  10.915
  426   3HG2  THR  56          3HG2      THR  56  -5.131   9.338   9.338
  427    H    LEU  57           H        LEU  57  -7.531   7.081   7.081
  428    HA   LEU  57           HA       LEU  57  -5.948   6.226   6.226
  429   1HB   LEU  57          2HB       LEU  57  -8.775   5.512   5.512
  430   2HB   LEU  57          1HB       LEU  57  -7.731   4.248   4.248
  431    HG   LEU  57           HG       LEU  57  -7.845   6.861   6.861
  432   1HD1  LEU  57          3HD1      LEU  57 -10.189   5.688   5.688
  433   2HD1  LEU  57          2HD1      LEU  57  -9.757   4.792   4.792
  434   3HD1  LEU  57          1HD1      LEU  57  -9.881   6.551   6.551
  435   1HD2  LEU  57          2HD2      LEU  57  -6.957   4.108   4.108
  436   2HD2  LEU  57          1HD2      LEU  57  -6.387   5.629   5.629
  437   3HD2  LEU  57          3HD2      LEU  57  -7.831   4.851   4.851
  438    H    THR  58           H        THR  58  -4.237   5.516   5.516
  439    HA   THR  58           HA       THR  58  -4.499   4.065   4.065
  440    HB   THR  58           HB       THR  58  -2.100   4.261   4.261
  441    HG1  THR  58           HG1      THR  58  -3.065   6.290   6.290
  442   1HG2  THR  58          1HG2      THR  58  -2.321   2.651   2.651
  443   2HG2  THR  58          3HG2      THR  58  -1.733   4.136   4.136
  444   3HG2  THR  58          2HG2      THR  58  -0.813   3.381   3.381
  445    H    THR  59           H        THR  59  -5.274   2.058   2.058
  446    HA   THR  59           HA       THR  59  -4.789   0.231   0.231
  447    HB   THR  59           HB       THR  59  -6.460  -1.141  -1.141
  448    HG1  THR  59           HG1      THR  59  -6.604   0.734   0.734
  449   1HG2  THR  59          3HG2      THR  59  -6.792   0.420   0.420
  450   2HG2  THR  59          2HG2      THR  59  -8.261   0.321   0.321
  451   3HG2  THR  59          1HG2      THR  59  -7.451  -1.155  -1.155
  452    H    VAL  60           H        VAL  60  -3.999  -1.869  -1.869
  453    HA   VAL  60           HA       VAL  60  -2.582  -2.257  -2.257
  454    HB   VAL  60           HB       VAL  60  -1.611  -3.106  -3.106
  455   1HG1  VAL  60          3HG1      VAL  60  -0.937  -4.641  -4.641
  456   2HG1  VAL  60          2HG1      VAL  60  -0.276  -3.284  -3.284
  457   3HG1  VAL  60          1HG1      VAL  60   0.446  -3.743  -3.743
  458   1HG2  VAL  60          1HG2      VAL  60  -1.210  -0.688  -0.688
  459   2HG2  VAL  60          3HG2      VAL  60  -1.044  -0.931  -0.931
  460   3HG2  VAL  60          2HG2      VAL  60   0.261  -1.410  -1.410
  461    H    GLN  61           H        GLN  61  -3.077  -4.048  -4.048
  462    HA   GLN  61           HA       GLN  61  -4.275  -6.293  -6.293
  463   1HB   GLN  61          2HB       GLN  61  -5.042  -6.286  -6.286
  464   2HB   GLN  61          1HB       GLN  61  -6.058  -6.318  -6.318
  465   1HG   GLN  61          2HG       GLN  61  -6.126  -3.954  -3.954
  466   2HG   GLN  61          1HG       GLN  61  -4.853  -3.796  -3.796
  467   1HE2  GLN  61          2HE2      GLN  61  -8.356  -5.268  -5.268
  468   2HE2  GLN  61          1HE2      GLN  61  -7.612  -5.977  -5.977
  469    H    GLY  62           H        GLY  62  -3.665  -8.363  -8.363
  470   1HA   GLY  62          2HA       GLY  62  -2.585  -9.883  -9.883
  471   2HA   GLY  62          1HA       GLY  62  -1.551  -8.552  -8.552
  472    H    ILE  63           H        ILE  63  -1.233  -7.716  -7.716
  473    HA   ILE  63           HA       ILE  63   1.149  -9.140  -9.140
  474    HB   ILE  63           HB       ILE  63  -0.450  -7.172  -7.172
  475   1HG1  ILE  63          2HG1      ILE  63   0.585  -5.898  -5.898
  476   2HG1  ILE  63          1HG1      ILE  63   1.871  -5.939  -5.939
  477   1HG2  ILE  63          3HG2      ILE  63   1.750  -8.893  -8.893
  478   2HG2  ILE  63          2HG2      ILE  63   1.978  -7.180  -7.180
  479   3HG2  ILE  63          1HG2      ILE  63   0.548  -8.020  -8.020
  480   1HD1  ILE  63          2HD1      ILE  63   2.751  -7.957  -7.957
  481   2HD1  ILE  63          1HD1      ILE  63   1.662  -7.426  -7.426
  482   3HD1  ILE  63          3HD1      ILE  63   2.942  -6.355  -6.355
  483    H    ALA  64           H        ALA  64   1.652 -10.601 -10.601
  484    HA   ALA  64           HA       ALA  64  -0.481 -12.386 -12.386
  485   1HB   ALA  64          3HB       ALA  64   1.921 -13.003 -13.003
  486   2HB   ALA  64          2HB       ALA  64   2.341 -12.629 -12.629
  487   3HB   ALA  64          1HB       ALA  64   1.171 -13.900 -13.900
  488    H    ASP  65           H        ASP  65  -1.363 -12.704 -12.704
  489    HA   ASP  65           HA       ASP  65  -1.261 -10.608 -10.608
  490   1HB   ASP  65          2HB       ASP  65  -3.236 -12.064 -12.064
  491   2HB   ASP  65          1HB       ASP  65  -2.343 -13.411 -13.411
  492    H    ASP  66           H        ASP  66   0.808 -13.247 -13.247
  493    HA   ASP  66           HA       ASP  66   1.692 -13.345 -13.345
  494   1HB   ASP  66          2HB       ASP  66   1.409 -15.354 -15.354
  495   2HB   ASP  66          1HB       ASP  66   3.067 -14.911 -14.911
  496    H    TYR  67           H        TYR  67   2.120 -10.950 -10.950
  497    HA   TYR  67           HA       TYR  67   4.977 -10.932 -10.932
  498   1HB   TYR  67          2HB       TYR  67   2.692  -9.088  -9.088
  499   2HB   TYR  67          1HB       TYR  67   4.303  -8.391  -8.391
  500    HD1  TYR  67           HD2      TYR  67   4.171 -11.762 -11.762
  501    HD2  TYR  67           HD1      TYR  67   3.851  -7.654  -7.654
  502    HE1  TYR  67           HE2      TYR  67   4.552 -12.336 -12.336
  503    HE2  TYR  67           HE1      TYR  67   4.226  -8.207  -8.207
  504    HH   TYR  67           HH       TYR  67   3.784 -10.643 -10.643
  505    H    ASP  68           H        ASP  68   3.857 -11.208 -11.208
  506    HA   ASP  68           HA       ASP  68   4.683 -10.649 -10.649
  507   1HB   ASP  68          2HB       ASP  68   6.683  -9.757  -9.757
  508   2HB   ASP  68          1HB       ASP  68   5.997  -8.176  -8.176
  509    H    LYS  69           H        LYS  69   2.938  -8.515  -8.515
  510    HA   LYS  69           HA       LYS  69   1.275  -7.028  -7.028
  511   1HB   LYS  69          2HB       LYS  69   1.169  -8.856  -8.856
  512   2HB   LYS  69          1HB       LYS  69   0.981  -7.259  -7.259
  513   1HG   LYS  69          2HG       LYS  69  -1.029  -6.902  -6.902
  514   2HG   LYS  69          1HG       LYS  69  -0.622  -7.847  -7.847
  515   1HD   LYS  69          2HD       LYS  69  -1.926  -9.446  -9.446
  516   2HD   LYS  69          1HD       LYS  69  -0.626  -9.728  -9.728
  517   1HE   LYS  69          2HE       LYS  69  -3.038  -7.957  -7.957
  518   2HE   LYS  69          1HE       LYS  69  -2.694  -9.470  -9.470
  519   1HZ   LYS  69          2HZ       LYS  69  -0.660  -8.338  -8.338
  520   2HZ   LYS  69          1HZ       LYS  69  -1.271  -6.885  -6.885
  521   3HZ   LYS  69          3HZ       LYS  69  -2.128  -7.730  -7.730
  522    H    LYS  70           H        LYS  70   2.919  -6.850  -6.850
  523    HA   LYS  70           HA       LYS  70   2.837  -4.113  -4.113
  524   1HB   LYS  70          2HB       LYS  70   4.955  -6.019  -6.019
  525   2HB   LYS  70          1HB       LYS  70   4.732  -4.373  -4.373
  526   1HG   LYS  70          2HG       LYS  70   2.616  -4.896  -4.896
  527   2HG   LYS  70          1HG       LYS  70   2.587  -6.473  -6.473
  528   1HD   LYS  70          2HD       LYS  70   4.683  -7.014  -7.014
  529   2HD   LYS  70          1HD       LYS  70   4.342  -5.559  -5.559
  530   1HE   LYS  70          2HE       LYS  70   3.469  -7.602  -7.602
  531   2HE   LYS  70          1HE       LYS  70   2.197  -6.449  -6.449
  532   1HZ   LYS  70          1HZ       LYS  70   2.831  -8.524  -8.524
  533   2HZ   LYS  70          3HZ       LYS  70   1.976  -8.984  -8.984
  534   3HZ   LYS  70          2HZ       LYS  70   1.347  -7.796  -7.796
  535    H    LYS  71           H        LYS  71   5.353  -6.061  -6.061
  536    HA   LYS  71           HA       LYS  71   7.122  -3.908  -3.908
  537   1HB   LYS  71          2HB       LYS  71   7.402  -6.558  -6.558
  538   2HB   LYS  71          1HB       LYS  71   7.107  -6.251  -6.251
  539   1HG   LYS  71          2HG       LYS  71   8.955  -4.493  -4.493
  540   2HG   LYS  71          1HG       LYS  71   9.358  -5.273  -5.273
  541   1HD   LYS  71          2HD       LYS  71  10.748  -6.293  -6.293
  542   2HD   LYS  71          1HD       LYS  71   9.449  -7.451  -7.451
  543   1HE   LYS  71          2HE       LYS  71   8.871  -5.548  -5.548
  544   2HE   LYS  71          1HE       LYS  71  10.275  -6.567  -6.567
  545   1HZ   LYS  71          1HZ       LYS  71   7.872  -7.880  -7.880
  546   2HZ   LYS  71          3HZ       LYS  71   7.828  -7.323  -7.323
  547   3HZ   LYS  71          2HZ       LYS  71   9.014  -8.429  -8.429
  548    H    LEU  72           H        LEU  72   4.097  -4.346  -4.346
  549    HA   LEU  72           HA       LEU  72   4.815  -3.224  -3.224
  550   1HB   LEU  72          2HB       LEU  72   2.317  -4.608  -4.608
  551   2HB   LEU  72          1HB       LEU  72   2.432  -3.802  -3.802
  552    HG   LEU  72           HG       LEU  72   3.555  -5.510  -5.510
  553   1HD1  LEU  72          2HD1      LEU  72   5.587  -5.049  -5.049
  554   2HD1  LEU  72          1HD1      LEU  72   4.965  -6.081  -6.081
  555   3HD1  LEU  72          3HD1      LEU  72   5.345  -6.774  -6.774
  556   1HD2  LEU  72          1HD2      LEU  72   1.832  -6.466  -6.466
  557   2HD2  LEU  72          3HD2      LEU  72   2.202  -7.193  -7.193
  558   3HD2  LEU  72          2HD2      LEU  72   3.199  -7.570  -7.570
  559    H    VAL  73           H        VAL  73   1.976  -2.946  -2.946
  560    HA   VAL  73           HA       VAL  73   1.591  -0.216  -0.216
  561    HB   VAL  73           HB       VAL  73  -0.244  -1.905  -1.905
  562   1HG1  VAL  73          1HG1      VAL  73   0.693  -2.600  -2.600
  563   2HG1  VAL  73          3HG1      VAL  73   0.403  -0.979  -0.979
  564   3HG1  VAL  73          2HG1      VAL  73  -0.956  -1.994  -1.994
  565   1HG2  VAL  73          3HG2      VAL  73  -0.219   0.914   0.914
  566   2HG2  VAL  73          2HG2      VAL  73  -0.830   0.332   0.332
  567   3HG2  VAL  73          1HG2      VAL  73  -1.673  -0.082  -0.082
  568    H    LYS  74           H        LYS  74   2.563  -1.860  -1.860
  569    HA   LYS  74           HA       LYS  74   2.843   0.477   0.477
  570   1HB   LYS  74          2HB       LYS  74   3.082  -2.212  -2.212
  571   2HB   LYS  74          1HB       LYS  74   4.756  -1.682  -1.682
  572   1HG   LYS  74          2HG       LYS  74   4.309  -1.182  -1.182
  573   2HG   LYS  74          1HG       LYS  74   3.442   0.216   0.216
  574   1HD   LYS  74          2HD       LYS  74   1.617  -1.863  -1.863
  575   2HD   LYS  74          1HD       LYS  74   2.424  -2.152  -2.152
  576   1HE   LYS  74          2HE       LYS  74   2.021   0.397   0.397
  577   2HE   LYS  74          1HE       LYS  74   0.794   0.193   0.193
  578   1HZ   LYS  74          2HZ       LYS  74   0.574  -1.863  -1.863
  579   2HZ   LYS  74          1HZ       LYS  74   0.550  -0.356  -0.356
  580   3HZ   LYS  74          3HZ       LYS  74  -0.569  -0.702  -0.702
  581    H    ALA  75           H        ALA  75   5.093  -1.342  -1.342
  582    HA   ALA  75           HA       ALA  75   7.374   0.243   0.243
  583   1HB   ALA  75          2HB       ALA  75   6.642  -1.483  -1.483
  584   2HB   ALA  75          1HB       ALA  75   8.225  -0.746  -0.746
  585   3HB   ALA  75          3HB       ALA  75   7.626  -1.939  -1.939
  586    H    PHE  76           H        PHE  76   4.831   0.377   0.377
  587    HA   PHE  76           HA       PHE  76   5.800   2.339   2.339
  588   1HB   PHE  76          2HB       PHE  76   3.540   1.072   1.072
  589   2HB   PHE  76          1HB       PHE  76   2.923   2.416   2.416
  590    HD1  PHE  76           HD2      PHE  76   4.457   1.483   1.483
  591    HD2  PHE  76           HD1      PHE  76   2.475   4.528   4.528
  592    HE1  PHE  76           HE2      PHE  76   4.190   2.804   2.804
  593    HE2  PHE  76           HE1      PHE  76   2.209   5.853   5.853
  594    HZ   PHE  76           HZ       PHE  76   3.070   4.990   4.990
  595    H    LYS  77           H        LYS  77   3.988   2.835   2.835
  596    HA   LYS  77           HA       LYS  77   4.148   5.676   5.676
  597   1HB   LYS  77          2HB       LYS  77   3.606   3.896   3.896
  598   2HB   LYS  77          1HB       LYS  77   3.278   5.620   5.620
  599   1HG   LYS  77          2HG       LYS  77   1.270   5.186   5.186
  600   2HG   LYS  77          1HG       LYS  77   2.008   4.399   4.399
  601   1HD   LYS  77          2HD       LYS  77   0.948   2.559   2.559
  602   2HD   LYS  77          1HD       LYS  77   2.247   2.474   2.474
  603   1HE   LYS  77          2HE       LYS  77   0.478   4.236   4.236
  604   2HE   LYS  77          1HE       LYS  77  -0.588   3.082   3.082
  605   1HZ   LYS  77          3HZ       LYS  77   1.023   1.378   1.378
  606   2HZ   LYS  77          2HZ       LYS  77   1.286   2.657   2.657
  607   3HZ   LYS  77          1HZ       LYS  77  -0.275   2.048   2.048
  608    H    LYS  78           H        LYS  78   6.531   3.439   3.439
  609    HA   LYS  78           HA       LYS  78   7.994   5.189   5.189
  610   1HB   LYS  78          2HB       LYS  78   7.654   2.436   2.436
  611   2HB   LYS  78          1HB       LYS  78   9.269   2.649   2.649
  612   1HG   LYS  78          2HG       LYS  78  10.102   3.528   3.528
  613   2HG   LYS  78          1HG       LYS  78   8.534   4.150   4.150
  614   1HD   LYS  78          2HD       LYS  78   8.181   1.398   1.398
  615   2HD   LYS  78          1HD       LYS  78   9.802   1.602   1.602
  616   1HE   LYS  78          2HE       LYS  78   8.582   1.715   1.715
  617   2HE   LYS  78          1HE       LYS  78   8.582   3.420   3.420
  618   1HZ   LYS  78          1HZ       LYS  78   6.416   1.653   1.653
  619   2HZ   LYS  78          3HZ       LYS  78   6.375   2.284   2.284
  620   3HZ   LYS  78          2HZ       LYS  78   6.399   3.327   3.327
  621    H    LYS  79           H        LYS  79   7.862   4.057   4.057
  622    HA   LYS  79           HA       LYS  79  10.603   4.785   4.785
  623   1HB   LYS  79          2HB       LYS  79   9.057   2.874   2.874
  624   2HB   LYS  79          1HB       LYS  79   8.631   4.169   4.169
  625   1HG   LYS  79          2HG       LYS  79  11.460   4.127   4.127
  626   2HG   LYS  79          1HG       LYS  79  10.900   2.486   2.486
  627   1HD   LYS  79          2HD       LYS  79   9.627   3.349   3.349
  628   2HD   LYS  79          1HD       LYS  79  10.297   4.952   4.952
  629   1HE   LYS  79          2HE       LYS  79  11.959   2.498   2.498
  630   2HE   LYS  79          1HE       LYS  79  11.479   3.659   3.659
  631   1HZ   LYS  79          1HZ       LYS  79  12.768   4.755   4.755
  632   2HZ   LYS  79          3HZ       LYS  79  13.752   3.829   3.829
  633   3HZ   LYS  79          2HZ       LYS  79  12.944   5.184   5.184
  634    H    PHE  80           H        PHE  80   7.338   5.857   5.857
  635    HA   PHE  80           HA       PHE  80   8.539   8.361   8.361
  636   1HB   PHE  80          2HB       PHE  80   5.711   7.604   7.604
  637   2HB   PHE  80          1HB       PHE  80   6.831   8.583   8.583
  638    HD1  PHE  80           HD2      PHE  80   6.002   5.127   5.127
  639    HD2  PHE  80           HD1      PHE  80   8.175   7.623   7.623
  640    HE1  PHE  80           HE2      PHE  80   6.515   3.172   3.172
  641    HE2  PHE  80           HE1      PHE  80   8.690   5.672   5.672
  642    HZ   PHE  80           HZ       PHE  80   7.860   3.444   3.444
  643    H    ALA  81           H        ALA  81   6.589   7.042   7.042
  644    HA   ALA  81           HA       ALA  81   5.690   8.034   8.034
  645   1HB   ALA  81          1HB       ALA  81   7.521   9.868   9.868
  646   2HB   ALA  81          3HB       ALA  81   6.056  10.813  10.813
  647   3HB   ALA  81          2HB       ALA  81   6.360  10.104  10.104
  648    H    CYS  82           H        CYS  82   4.257   7.354   7.354
  649    HA   CYS  82           HA       CYS  82   2.163   9.383   9.383
  650   1HB   CYS  82          2HB       CYS  82   2.928   7.008   7.008
  651   2HB   CYS  82          1HB       CYS  82   1.298   7.661   7.661
  652    HG   CYS  82           HG       CYS  82   2.188   9.753   9.753
  653    H    ASN  83           H        ASN  83  -0.079   8.041   8.041
  654    HA   ASN  83           HA       ASN  83  -0.529   6.561   6.561
  655   1HB   ASN  83          2HB       ASN  83  -2.288   8.306   8.306
  656   2HB   ASN  83          1HB       ASN  83  -2.999   7.127   7.127
  657   1HD2  ASN  83          2HD2      ASN  83  -1.478   8.799   8.799
  658   2HD2  ASN  83          1HD2      ASN  83  -1.466   7.224   7.224
  659    H    GLY  84           H        GLY  84  -0.882   4.448   4.448
  660   1HA   GLY  84          2HA       GLY  84  -1.906   3.372   3.372
  661   2HA   GLY  84          1HA       GLY  84  -0.622   2.583   2.583
  662    H    THR  85           H        THR  85  -3.044   1.373   1.373
  663    HA   THR  85           HA       THR  85  -3.937   0.426   0.426
  664    HB   THR  85           HB       THR  85  -6.278   0.819   0.819
  665    HG1  THR  85           HG1      THR  85  -6.907   0.892   0.892
  666   1HG2  THR  85          1HG2      THR  85  -5.027   2.732   2.732
  667   2HG2  THR  85          3HG2      THR  85  -4.886   3.388   3.388
  668   3HG2  THR  85          2HG2      THR  85  -6.475   3.205   3.205
  669    H    VAL  86           H        VAL  86  -4.958  -1.613  -1.613
  670    HA   VAL  86           HA       VAL  86  -4.677  -2.981  -2.981
  671    HB   VAL  86           HB       VAL  86  -3.089  -3.785  -3.785
  672   1HG1  VAL  86          1HG1      VAL  86  -5.081  -3.382  -3.382
  673   2HG1  VAL  86          3HG1      VAL  86  -5.114  -5.136  -5.136
  674   3HG1  VAL  86          2HG1      VAL  86  -3.622  -4.327  -4.327
  675   1HG2  VAL  86          1HG2      VAL  86  -4.521  -5.274  -5.274
  676   2HG2  VAL  86          3HG2      VAL  86  -3.270  -5.943  -5.943
  677   3HG2  VAL  86          2HG2      VAL  86  -4.967  -6.057  -6.057
  678    H    ILE  87           H        ILE  87  -6.619  -3.296  -3.296
  679    HA   ILE  87           HA       ILE  87  -8.827  -4.177  -4.177
  680    HB   ILE  87           HB       ILE  87 -10.405  -3.091  -3.091
  681   1HG1  ILE  87          2HG1      ILE  87  -8.121  -1.615  -1.615
  682   2HG1  ILE  87          1HG1      ILE  87  -8.632  -3.168  -3.168
  683   1HG2  ILE  87          2HG2      ILE  87  -8.303  -1.265  -1.265
  684   2HG2  ILE  87          1HG2      ILE  87  -9.903  -0.750  -0.750
  685   3HG2  ILE  87          3HG2      ILE  87  -9.743  -1.872  -1.872
  686   1HD1  ILE  87          3HD1      ILE  87 -11.000  -1.834  -1.834
  687   2HD1  ILE  87          2HD1      ILE  87  -9.876  -0.544  -0.544
  688   3HD1  ILE  87          1HD1      ILE  87 -10.029  -1.962  -1.962
  689    H    GLU  88           H        GLU  88 -10.517  -5.422  -5.422
  690    HA   GLU  88           HA       GLU  88  -9.329  -7.110  -7.110
  691   1HB   GLU  88          2HB       GLU  88  -9.825  -8.219  -8.219
  692   2HB   GLU  88          1HB       GLU  88 -11.528  -7.895  -7.895
  693   1HG   GLU  88          2HG       GLU  88 -11.647  -9.391  -9.391
  694   2HG   GLU  88          1HG       GLU  88  -9.905  -9.364  -9.364
  695    H    HIS  89           H        HIS  89 -10.099  -5.454  -5.454
  696    HA   HIS  89           HA       HIS  89 -12.698  -4.625  -4.625
  697   1HB   HIS  89          2HB       HIS  89 -10.411  -4.127  -4.127
  698   2HB   HIS  89          1HB       HIS  89 -11.136  -5.231  -5.231
  699    HD1  HIS  89           HD1      HIS  89 -12.790  -4.254  -4.254
  700    HD2  HIS  89           HD2      HIS  89 -12.106  -1.800  -1.800
  701    HE1  HIS  89           HE1      HIS  89 -14.065  -2.140  -2.140
  702    HE2  HIS  89           HE2      HIS  89 -13.548  -0.627  -0.627
  703    HA   PRO  90           HA       PRO  90 -14.768  -8.370  -8.370
  704   1HB   PRO  90          2HB       PRO  90 -17.168  -7.322  -7.322
  705   2HB   PRO  90          1HB       PRO  90 -16.593  -7.435  -7.435
  706   1HG   PRO  90          2HG       PRO  90 -16.610  -5.077  -5.077
  707   2HG   PRO  90          1HG       PRO  90 -17.030  -5.155  -5.155
  708   1HD   PRO  90          2HD       PRO  90 -14.611  -4.281  -4.281
  709   2HD   PRO  90          1HD       PRO  90 -14.840  -5.014  -5.014
  710    H    GLU  91           H        GLU  91 -14.150  -5.669  -5.669
  711    HA   GLU  91           HA       GLU  91 -15.288  -6.861  -6.861
  712   1HB   GLU  91          2HB       GLU  91 -14.567  -4.264  -4.264
  713   2HB   GLU  91          1HB       GLU  91 -13.492  -4.672  -4.672
  714   1HG   GLU  91          2HG       GLU  91 -16.387  -5.232  -5.232
  715   2HG   GLU  91          1HG       GLU  91 -15.843  -3.556  -3.556
  716    H    TYR  92           H        TYR  92 -12.247  -6.772  -6.772
  717    HA   TYR  92           HA       TYR  92 -11.025  -8.243  -8.243
  718   1HB   TYR  92          2HB       TYR  92  -9.314  -6.652  -6.652
  719   2HB   TYR  92          1HB       TYR  92  -9.029  -7.091  -7.091
  720    HD1  TYR  92           HD2      TYR  92 -11.232  -6.097  -6.097
  721    HD2  TYR  92           HD1      TYR  92  -9.366  -4.358  -4.358
  722    HE1  TYR  92           HE2      TYR  92 -12.014  -3.879  -3.879
  723    HE2  TYR  92           HE1      TYR  92 -10.144  -2.134  -2.134
  724    HH   TYR  92           HH       TYR  92 -11.218  -1.431  -1.431
  725    H    GLY  93           H        GLY  93 -10.657  -7.577  -7.577
  726   1HA   GLY  93          2HA       GLY  93 -11.032  -9.849  -9.849
  727   2HA   GLY  93          1HA       GLY  93  -9.564 -10.272 -10.272
  728    H    GLU  94           H        GLU  94  -7.708  -9.935  -9.935
  729    HA   GLU  94           HA       GLU  94  -7.737  -8.247  -8.247
  730   1HB   GLU  94          2HB       GLU  94  -6.903 -10.756 -10.756
  731   2HB   GLU  94          1HB       GLU  94  -5.417  -9.990  -9.990
  732   1HG   GLU  94          2HG       GLU  94  -4.862  -9.716  -9.716
  733   2HG   GLU  94          1HG       GLU  94  -6.186  -8.559  -8.559
  734    H    VAL  95           H        VAL  95  -7.504  -6.214  -6.214
  735    HA   VAL  95           HA       VAL  95  -4.875  -5.739  -5.739
  736    HB   VAL  95           HB       VAL  95  -5.914  -3.868  -3.868
  737   1HG1  VAL  95          2HG1      VAL  95  -5.764  -6.439  -6.439
  738   2HG1  VAL  95          1HG1      VAL  95  -7.513  -6.233  -6.233
  739   3HG1  VAL  95          3HG1      VAL  95  -6.451  -5.207  -5.207
  740   1HG2  VAL  95          2HG2      VAL  95  -7.991  -4.116  -4.116
  741   2HG2  VAL  95          1HG2      VAL  95  -8.061  -3.248  -3.248
  742   3HG2  VAL  95          3HG2      VAL  95  -8.635  -4.912  -4.912
  743    H    ILE  96           H        ILE  96  -3.726  -3.971  -3.971
  744    HA   ILE  96           HA       ILE  96  -4.397  -2.867  -2.867
  745    HB   ILE  96           HB       ILE  96  -2.085  -2.686  -2.686
  746   1HG1  ILE  96          2HG1      ILE  96  -2.560  -4.206  -4.206
  747   2HG1  ILE  96          1HG1      ILE  96  -0.934  -3.660  -3.660
  748   1HG2  ILE  96          2HG2      ILE  96  -2.552  -0.626  -0.626
  749   2HG2  ILE  96          1HG2      ILE  96  -1.030  -0.877  -0.877
  750   3HG2  ILE  96          3HG2      ILE  96  -2.457  -0.330  -0.330
  751   1HD1  ILE  96          1HD1      ILE  96  -1.191  -1.832  -1.832
  752   2HD1  ILE  96          3HD1      ILE  96  -2.791  -2.447  -2.447
  753   3HD1  ILE  96          2HD1      ILE  96  -1.360  -3.425  -3.425
  754    H    GLN  97           H        GLN  97  -4.507  -0.511  -0.511
  755    HA   GLN  97           HA       GLN  97  -5.572   0.981   0.981
  756   1HB   GLN  97          2HB       GLN  97  -7.096   0.010   0.010
  757   2HB   GLN  97          1HB       GLN  97  -6.952   1.744   1.744
  758   1HG   GLN  97          2HG       GLN  97  -7.597   1.773   1.773
  759   2HG   GLN  97          1HG       GLN  97  -8.325   0.225   0.225
  760   1HE2  GLN  97          2HE2      GLN  97 -10.370   1.969   1.969
  761   2HE2  GLN  97          1HE2      GLN  97  -9.102   0.796   0.796
  762    H    LEU  98           H        LEU  98  -3.504   2.019   2.019
  763    HA   LEU  98           HA       LEU  98  -2.451   3.455   3.455
  764   1HB   LEU  98          2HB       LEU  98  -1.897   3.166   3.166
  765   2HB   LEU  98          1HB       LEU  98  -1.555   4.775   4.775
  766    HG   LEU  98           HG       LEU  98   0.144   4.042   4.042
  767   1HD1  LEU  98          2HD1      LEU  98  -1.426   1.571   1.571
  768   2HD1  LEU  98          1HD1      LEU  98   0.322   1.336   1.336
  769   3HD1  LEU  98          3HD1      LEU  98  -0.438   2.355   2.355
  770   1HD2  LEU  98          1HD2      LEU  98   0.098   2.330   2.330
  771   2HD2  LEU  98          3HD2      LEU  98   0.944   3.855   3.855
  772   3HD2  LEU  98          2HD2      LEU  98   1.482   2.395   2.395
  773    H    GLN  99           H        GLN  99  -2.198   5.890   5.890
  774    HA   GLN  99           HA       GLN  99  -4.793   7.102   7.102
  775   1HB   GLN  99          2HB       GLN  99  -3.317   7.090   7.090
  776   2HB   GLN  99          1HB       GLN  99  -3.262   8.734   8.734
  777   1HG   GLN  99          2HG       GLN  99  -5.880   7.335   7.335
  778   2HG   GLN  99          1HG       GLN  99  -5.198   7.905   7.905
  779   1HE2  GLN  99          2HE2      GLN  99  -7.342  10.453  10.453
  780   2HE2  GLN  99          1HE2      GLN  99  -7.538   8.746   8.746
  781    H    GLY 100           H        GLY 100  -4.868   8.749   8.749
  782   1HA   GLY 100          2HA       GLY 100  -4.109  10.651  10.651
  783   2HA   GLY 100          1HA       GLY 100  -2.496  10.360  10.360
  784    H    ASP 101           H        ASP 101  -2.401  11.021  11.021
  785    HA   ASP 101           HA       ASP 101  -2.738   8.770   8.770
  786   1HB   ASP 101          2HB       ASP 101  -1.606  10.292  10.292
  787   2HB   ASP 101          1HB       ASP 101  -3.097  10.922  10.922
  788    H    GLN 102           H        GLN 102  -1.379   7.362   7.362
  789    HA   GLN 102           HA       GLN 102   1.480   7.835   7.835
  790   1HB   GLN 102          2HB       GLN 102  -0.349   6.040   6.040
  791   2HB   GLN 102          1HB       GLN 102   1.213   5.345   5.345
  792   1HG   GLN 102          2HG       GLN 102   1.013   6.455   6.455
  793   2HG   GLN 102          1HG       GLN 102   2.376   6.949   6.949
  794   1HE2  GLN 102          2HE2      GLN 102  -0.719   9.609   9.609
  795   2HE2  GLN 102          1HE2      GLN 102  -0.989   7.935   7.935
  796    H    ARG 103           H        ARG 103  -0.558   6.869   6.869
  797    HA   ARG 103           HA       ARG 103   0.145   4.398   4.398
  798   1HB   ARG 103          2HB       ARG 103  -0.394   5.195   5.195
  799   2HB   ARG 103          1HB       ARG 103  -1.532   5.851   5.851
  800   1HG   ARG 103          2HG       ARG 103  -1.047   7.919   7.919
  801   2HG   ARG 103          1HG       ARG 103   0.667   7.655   7.655
  802   1HD   ARG 103          2HD       ARG 103   0.927   7.957   7.957
  803   2HD   ARG 103          1HD       ARG 103   0.317   6.309   6.309
  804    HE   ARG 103           HE       ARG 103  -1.930   7.841   7.841
  805   1HH1  ARG 103          2HH1      ARG 103   0.987   7.835   7.835
  806   2HH1  ARG 103          1HH1      ARG 103   0.208   8.461   8.461
  807   1HH2  ARG 103          1HH2      ARG 103  -2.957   8.664   8.664
  808   2HH2  ARG 103          2HH2      ARG 103  -2.031   8.932   8.932
  809    H    LYS 104           H        LYS 104   2.070   7.290   7.290
  810    HA   LYS 104           HA       LYS 104   4.131   6.108   6.108
  811   1HB   LYS 104          2HB       LYS 104   3.457   8.534   8.534
  812   2HB   LYS 104          1HB       LYS 104   4.186   8.785   8.785
  813   1HG   LYS 104          2HG       LYS 104   6.148   7.481   7.481
  814   2HG   LYS 104          1HG       LYS 104   5.426   8.629   8.629
  815   1HD   LYS 104          2HD       LYS 104   6.008   9.640   9.640
  816   2HD   LYS 104          1HD       LYS 104   7.403   9.272   9.272
  817   1HE   LYS 104          2HE       LYS 104   6.128  10.635  10.635
  818   2HE   LYS 104          1HE       LYS 104   5.222  11.274  11.274
  819   1HZ   LYS 104          2HZ       LYS 104   8.182  11.342  11.342
  820   2HZ   LYS 104          1HZ       LYS 104   7.182  12.622  12.622
  821   3HZ   LYS 104          3HZ       LYS 104   7.210  12.123  12.123
  822    H    ASN 105           H        ASN 105   3.415   6.734   6.734
  823    HA   ASN 105           HA       ASN 105   6.132   6.269   6.269
  824   1HB   ASN 105          2HB       ASN 105   3.564   7.034   7.034
  825   2HB   ASN 105          1HB       ASN 105   4.643   6.081   6.081
  826   1HD2  ASN 105          2HD2      ASN 105   5.232   9.952   9.952
  827   2HD2  ASN 105          1HD2      ASN 105   3.768   9.108   9.108
  828    H    ILE 106           H        ILE 106   3.085   4.486   4.486
  829    HA   ILE 106           HA       ILE 106   3.962   2.241   2.241
  830    HB   ILE 106           HB       ILE 106   1.585   2.731   2.731
  831   1HG1  ILE 106          2HG1      ILE 106   0.890   0.413   0.413
  832   2HG1  ILE 106          1HG1      ILE 106   2.483   0.031   0.031
  833   1HG2  ILE 106          2HG2      ILE 106   1.865   3.414   3.414
  834   2HG2  ILE 106          1HG2      ILE 106   2.076   1.716   1.716
  835   3HG2  ILE 106          3HG2      ILE 106   0.548   2.272   2.272
  836   1HD1  ILE 106          1HD1      ILE 106   2.003   1.004   1.004
  837   2HD1  ILE 106          3HD1      ILE 106   2.102  -0.696  -0.696
  838   3HD1  ILE 106          2HD1      ILE 106   3.499   0.358   0.358
  839    H    CYS 107           H        CYS 107   3.782   2.822   2.822
  840    HA   CYS 107           HA       CYS 107   4.850   0.363   0.363
  841   1HB   CYS 107          2HB       CYS 107   3.860   1.875   1.875
  842   2HB   CYS 107          1HB       CYS 107   5.051   3.118   3.118
  843    HG   CYS 107           HG       CYS 107   6.352   2.189   2.189
  844    H    GLN 108           H        GLN 108   6.279   3.311   3.311
  845    HA   GLN 108           HA       GLN 108   9.003   2.592   2.592
  846   1HB   GLN 108          2HB       GLN 108   8.761   4.883   4.883
  847   2HB   GLN 108          1HB       GLN 108   7.544   4.789   4.789
  848   1HG   GLN 108          2HG       GLN 108   9.185   5.591   5.591
  849   2HG   GLN 108          1HG       GLN 108   9.702   3.909   3.909
  850   1HE2  GLN 108          2HE2      GLN 108  12.519   4.352   4.352
  851   2HE2  GLN 108          1HE2      GLN 108  11.330   3.218   3.218
  852    H    PHE 109           H        PHE 109   6.706   2.232   2.232
  853    HA   PHE 109           HA       PHE 109   8.581   1.403   1.403
  854   1HB   PHE 109          2HB       PHE 109   6.361   2.324   2.324
  855   2HB   PHE 109          1HB       PHE 109   5.594   0.929   0.929
  856    HD1  PHE 109           HD2      PHE 109   8.167   1.689   1.689
  857    HD2  PHE 109           HD1      PHE 109   4.927  -0.782  -0.782
  858    HE1  PHE 109           HE2      PHE 109   8.282   0.484   0.484
  859    HE2  PHE 109           HE1      PHE 109   5.035  -1.992  -1.992
  860    HZ   PHE 109           HZ       PHE 109   6.714  -1.359  -1.359
  861    H    LEU 110           H        LEU 110   6.372  -0.278  -0.278
  862    HA   LEU 110           HA       LEU 110   6.855  -2.893  -2.893
  863   1HB   LEU 110          2HB       LEU 110   5.870  -1.644  -1.644
  864   2HB   LEU 110          1HB       LEU 110   6.313  -3.340  -3.340
  865    HG   LEU 110           HG       LEU 110   4.613  -3.942  -3.942
  866   1HD1  LEU 110          2HD1      LEU 110   5.029  -2.094  -2.094
  867   2HD1  LEU 110          1HD1      LEU 110   4.099  -1.025  -1.025
  868   3HD1  LEU 110          3HD1      LEU 110   3.318  -2.411  -2.411
  869   1HD2  LEU 110          3HD2      LEU 110   3.866  -2.058  -2.058
  870   2HD2  LEU 110          2HD2      LEU 110   3.393  -3.737  -3.737
  871   3HD2  LEU 110          1HD2      LEU 110   2.609  -2.452  -2.452
  872    H    VAL 111           H        VAL 111   8.710  -0.760  -0.760
  873    HA   VAL 111           HA       VAL 111  10.500  -2.914  -2.914
  874    HB   VAL 111           HB       VAL 111  10.627   0.034   0.034
  875   1HG1  VAL 111          3HG1      VAL 111  12.288  -2.315  -2.315
  876   2HG1  VAL 111          2HG1      VAL 111  11.986  -1.086  -1.086
  877   3HG1  VAL 111          1HG1      VAL 111  12.761  -0.642  -0.642
  878   1HG2  VAL 111          2HG2      VAL 111   8.667  -1.595  -1.595
  879   2HG2  VAL 111          1HG2      VAL 111   9.325  -0.307  -0.307
  880   3HG2  VAL 111          3HG2      VAL 111   9.876  -1.968  -1.968
  881    H    GLU 112           H        GLU 112  10.351  -0.234  -0.234
  882    HA   GLU 112           HA       GLU 112  13.137  -0.101  -0.101
  883   1HB   GLU 112          2HB       GLU 112  10.663   0.903   0.903
  884   2HB   GLU 112          1HB       GLU 112  12.236   1.037   1.037
  885   1HG   GLU 112          2HG       GLU 112  12.119   2.003   2.003
  886   2HG   GLU 112          1HG       GLU 112  11.152   2.912   2.912
  887    H    ILE 113           H        ILE 113  10.390  -1.730  -1.730
  888    HA   ILE 113           HA       ILE 113  12.134  -2.985  -2.985
  889    HB   ILE 113           HB       ILE 113  10.173  -3.805  -3.805
  890   1HG1  ILE 113          2HG1      ILE 113   8.750  -3.085  -3.085
  891   2HG1  ILE 113          1HG1      ILE 113   8.926  -4.682  -4.682
  892   1HG2  ILE 113          1HG2      ILE 113  10.688  -1.236  -1.236
  893   2HG2  ILE 113          3HG2      ILE 113   9.142  -1.181  -1.181
  894   3HG2  ILE 113          2HG2      ILE 113   9.226  -1.827  -1.827
  895   1HD1  ILE 113          3HD1      ILE 113   7.630  -3.009  -3.009
  896   2HD1  ILE 113          2HD1      ILE 113   6.830  -2.818  -2.818
  897   3HD1  ILE 113          1HD1      ILE 113   6.999  -4.422  -4.422
  898    H    GLY 114           H        GLY 114  10.699  -3.703  -3.703
  899   1HA   GLY 114          2HA       GLY 114  11.290  -5.523  -5.523
  900   2HA   GLY 114          1HA       GLY 114  11.913  -6.356  -6.356
  901    H    LEU 115           H        LEU 115   8.766  -4.838  -4.838
  902    HA   LEU 115           HA       LEU 115   7.467  -7.252  -7.252
  903   1HB   LEU 115          2HB       LEU 115   6.929  -4.591  -4.591
  904   2HB   LEU 115          1HB       LEU 115   5.790  -5.044  -5.044
  905    HG   LEU 115           HG       LEU 115   4.710  -6.617  -6.617
  906   1HD1  LEU 115          1HD1      LEU 115   7.138  -6.279  -6.279
  907   2HD1  LEU 115          3HD1      LEU 115   5.609  -6.710  -6.710
  908   3HD1  LEU 115          2HD1      LEU 115   6.297  -7.750  -7.750
  909   1HD2  LEU 115          1HD2      LEU 115   4.719  -3.923  -3.923
  910   2HD2  LEU 115          3HD2      LEU 115   3.590  -5.084  -5.084
  911   3HD2  LEU 115          2HD2      LEU 115   5.024  -4.594  -4.594
  912    H    ALA 116           H        ALA 116   6.554  -5.133  -5.133
  913    HA   ALA 116           HA       ALA 116   5.668  -7.489  -7.489
  914   1HB   ALA 116          1HB       ALA 116   4.142  -5.572  -5.572
  915   2HB   ALA 116          3HB       ALA 116   5.310  -4.566  -4.566
  916   3HB   ALA 116          2HB       ALA 116   4.545  -5.925  -5.925
  917    H    LYS 117           H        LYS 117   6.210  -7.681  -7.681
  918    HA   LYS 117           HA       LYS 117   9.035  -7.213  -7.213
  919   1HB   LYS 117          2HB       LYS 117   6.971  -8.939  -8.939
  920   2HB   LYS 117          1HB       LYS 117   8.071  -8.285  -8.285
  921   1HG   LYS 117          2HG       LYS 117   9.204  -9.491  -9.491
  922   2HG   LYS 117          1HG       LYS 117   8.581 -10.550 -10.550
  923   1HD   LYS 117          2HD       LYS 117  10.465 -10.284 -10.284
  924   2HD   LYS 117          1HD       LYS 117  10.166  -8.548  -8.548
  925   1HE   LYS 117          2HE       LYS 117  11.138  -8.510  -8.510
  926   2HE   LYS 117          1HE       LYS 117  11.806 -10.084 -10.084
  927   1HZ   LYS 117          3HZ       LYS 117  12.223  -7.673  -7.673
  928   2HZ   LYS 117          2HZ       LYS 117  13.274  -8.102  -8.102
  929   3HZ   LYS 117          1HZ       LYS 117  13.061  -9.141  -9.141
  930    H    ASP 118           H        ASP 118   9.957  -5.962  -5.962
  931    HA   ASP 118           HA       ASP 118   8.772  -3.528  -3.528
  932   1HB   ASP 118          2HB       ASP 118  10.802  -4.789  -4.789
  933   2HB   ASP 118          1HB       ASP 118  10.568  -3.080  -3.080
  934    H    ASP 119           H        ASP 119   8.581  -6.553  -6.553
  935    HA   ASP 119           HA       ASP 119   7.285  -5.421  -5.421
  936   1HB   ASP 119          2HB       ASP 119   8.707  -7.612  -7.612
  937   2HB   ASP 119          1HB       ASP 119   7.193  -8.339  -8.339
  938    H    GLN 120           H        GLN 120   6.374  -6.787  -6.787
  939    HA   GLN 120           HA       GLN 120   3.607  -7.170  -7.170
  940   1HB   GLN 120          2HB       GLN 120   5.058  -7.217  -7.217
  941   2HB   GLN 120          1HB       GLN 120   3.344  -7.561  -7.561
  942   1HG   GLN 120          2HG       GLN 120   3.935  -9.432  -9.432
  943   2HG   GLN 120          1HG       GLN 120   5.636  -9.124  -9.124
  944   1HE2  GLN 120          2HE2      GLN 120   3.300 -10.371 -10.371
  945   2HE2  GLN 120          1HE2      GLN 120   2.694  -9.237  -9.237
  946    H    LEU 121           H        LEU 121   5.475  -4.484  -4.484
  947    HA   LEU 121           HA       LEU 121   3.893  -2.943  -2.943
  948   1HB   LEU 121          2HB       LEU 121   5.675  -2.130  -2.130
  949   2HB   LEU 121          1HB       LEU 121   4.927  -0.979  -0.979
  950    HG   LEU 121           HG       LEU 121   6.773  -3.174  -3.174
  951   1HD1  LEU 121          2HD1      LEU 121   7.335  -0.401  -0.401
  952   2HD1  LEU 121          1HD1      LEU 121   8.325  -1.109  -1.109
  953   3HD1  LEU 121          3HD1      LEU 121   8.226  -1.893  -1.893
  954   1HD2  LEU 121          1HD2      LEU 121   5.178  -1.107  -1.107
  955   2HD2  LEU 121          3HD2      LEU 121   5.880  -2.588  -2.588
  956   3HD2  LEU 121          2HD2      LEU 121   6.869  -1.136  -1.136
  957    H    LYS 122           H        LYS 122   1.724  -3.289  -3.289
  958    HA   LYS 122           HA       LYS 122   0.756  -2.221  -2.221
  959   1HB   LYS 122          2HB       LYS 122  -0.178  -4.329  -4.329
  960   2HB   LYS 122          1HB       LYS 122  -1.448  -3.312  -3.312
  961   1HG   LYS 122          2HG       LYS 122   0.629  -4.688  -4.688
  962   2HG   LYS 122          1HG       LYS 122  -0.940  -5.397  -5.397
  963   1HD   LYS 122          2HD       LYS 122  -2.054  -4.035  -4.035
  964   2HD   LYS 122          1HD       LYS 122  -1.020  -2.649  -2.649
  965   1HE   LYS 122          2HE       LYS 122   0.463  -3.158  -3.158
  966   2HE   LYS 122          1HE       LYS 122   0.199  -4.894  -4.894
  967   1HZ   LYS 122          1HZ       LYS 122  -2.159  -4.162  -4.162
  968   2HZ   LYS 122          3HZ       LYS 122  -1.218  -2.935  -2.935
  969   3HZ   LYS 122          2HZ       LYS 122  -0.863  -4.557  -4.557
  970    H    VAL 123           H        VAL 123   1.113  -0.028  -0.028
  971    HA   VAL 123           HA       VAL 123  -0.578   0.913   0.913
  972    HB   VAL 123           HB       VAL 123   0.765   2.944   2.944
  973   1HG1  VAL 123          3HG1      VAL 123  -0.304   3.129   3.129
  974   2HG1  VAL 123          2HG1      VAL 123   1.096   2.254   2.254
  975   3HG1  VAL 123          1HG1      VAL 123   1.310   3.822   3.822
  976   1HG2  VAL 123          2HG2      VAL 123   2.355   0.686   0.686
  977   2HG2  VAL 123          1HG2      VAL 123   2.533   1.487   1.487
  978   3HG2  VAL 123          3HG2      VAL 123   3.024   2.316   2.316
  979    H    HIS 124           H        HIS 124  -2.638   1.320   1.320
  980    HA   HIS 124           HA       HIS 124  -3.343   2.476   2.476
  981   1HB   HIS 124          2HB       HIS 124  -5.132   0.907   0.907
  982   2HB   HIS 124          1HB       HIS 124  -5.544   1.481   1.481
  983    HD1  HIS 124           HD1      HIS 124  -4.865   0.037   0.037
  984    HD2  HIS 124           HD2      HIS 124  -3.264  -1.265  -1.265
  985    HE1  HIS 124           HE1      HIS 124  -3.850  -2.211  -2.211
  986    HE2  HIS 124           HE2      HIS 124  -2.998  -3.031  -3.031
  987    H    GLY 125           H        GLY 125  -2.670   4.541   4.541
  988   1HA   GLY 125          2HA       GLY 125  -4.016   5.650   5.650
  989   2HA   GLY 125          1HA       GLY 125  -3.327   6.579   6.579
  990    H    PHE 126           HN       PHE 126  -6.086   6.068   6.068
  991    HA   PHE 126           HA       PHE 126  -8.178   5.713   5.713
  992   1HB   PHE 126          2HB       PHE 126  -9.538   6.829   6.829
  993   2HB   PHE 126          1HB       PHE 126  -8.179   6.260   6.260
  994    HD1  PHE 126           HD2      PHE 126  -6.120   8.239   8.239
  995    HD2  PHE 126           HD1      PHE 126 -10.298   8.752   8.752
  996    HE1  PHE 126           HE2      PHE 126  -5.717  10.537  10.537
  997    HE2  PHE 126           HE1      PHE 126  -9.903  11.054  11.054
  998    HZ   PHE 126           HZ       PHE 126  -7.611  11.948  11.948

  Start of MODEL   29
    1   1H    MET   1          3H        MET   1 -12.835  -3.327  -3.327
    2   2H    MET   1          2H        MET   1 -13.443  -3.725  -3.725
    3   3H    MET   1          1H        MET   1 -12.642  -2.228  -2.228
    4    HA   MET   1           HA       MET   1 -14.938  -1.837  -1.837
    5   1HB   MET   1          2HB       MET   1 -14.957  -4.252  -4.252
    6   2HB   MET   1          1HB       MET   1 -16.147  -3.024  -3.024
    7   1HG   MET   1          2HG       MET   1 -17.392  -4.156  -4.156
    8   2HG   MET   1          1HG       MET   1 -16.536  -3.132  -3.132
    9   1HE   MET   1          1HE       MET   1 -17.902  -5.577  -5.577
   10   2HE   MET   1          3HE       MET   1 -16.770  -4.658  -4.658
   11   3HE   MET   1          2HE       MET   1 -16.650  -6.416  -6.416
   12    H    ARG   2           H        ARG   2 -14.059  -2.726  -2.726
   13    HA   ARG   2           HA       ARG   2 -13.995   0.147   0.147
   14   1HB   ARG   2          2HB       ARG   2 -14.900  -2.055  -2.055
   15   2HB   ARG   2          1HB       ARG   2 -14.995  -0.321  -0.321
   16   1HG   ARG   2          2HG       ARG   2 -16.914  -0.127  -0.127
   17   2HG   ARG   2          1HG       ARG   2 -16.373  -1.195  -1.195
   18   1HD   ARG   2          2HD       ARG   2 -18.142  -2.362  -2.362
   19   2HD   ARG   2          1HD       ARG   2 -16.721  -3.090  -3.090
   20    HE   ARG   2           HE       ARG   2 -17.472  -1.078  -1.078
   21   1HH1  ARG   2          2HH1      ARG   2 -19.006  -3.918  -3.918
   22   2HH1  ARG   2          1HH1      ARG   2 -20.030  -4.161  -4.161
   23   1HH2  ARG   2          1HH2      ARG   2 -18.818  -1.397  -1.397
   24   2HH2  ARG   2          2HH2      ARG   2 -19.924  -2.730  -2.730
   25    H    GLY   3           H        GLY   3 -11.673  -0.131  -0.131
   26   1HA   GLY   3          2HA       GLY   3 -10.219  -1.423  -1.423
   27   2HA   GLY   3          1HA       GLY   3  -9.562  -1.192  -1.192
   28    H    SER   4           H        SER   4  -7.757  -0.255  -0.255
   29    HA   SER   4           HA       SER   4  -7.857   2.579   2.579
   30   1HB   SER   4          2HB       SER   4  -7.172   2.749   2.749
   31   2HB   SER   4          1HB       SER   4  -8.877   2.702   2.702
   32    HG   SER   4           HG       SER   4  -7.368   0.869   0.869
   33    H    HIS   5           H        HIS   5  -6.149  -0.037  -0.037
   34    HA   HIS   5           HA       HIS   5  -3.959  -0.640  -0.640
   35   1HB   HIS   5          2HB       HIS   5  -4.488   0.007   0.007
   36   2HB   HIS   5          1HB       HIS   5  -2.971   0.817   0.817
   37    HD1  HIS   5           HD1      HIS   5  -4.119  -2.234  -2.234
   38    HD2  HIS   5           HD2      HIS   5  -1.169  -1.223  -1.223
   39    HE1  HIS   5           HE1      HIS   5  -2.557  -4.203  -4.203
   40    HE2  HIS   5           HE2      HIS   5  -0.729  -3.530  -3.530
   41    H    HIS   6           H        HIS   6  -3.579   0.599   0.599
   42    HA   HIS   6           HA       HIS   6  -2.881   3.331   3.331
   43   1HB   HIS   6          2HB       HIS   6  -2.288   1.137   1.137
   44   2HB   HIS   6          1HB       HIS   6  -1.921   2.835   2.835
   45    HD1  HIS   6           HD1      HIS   6  -5.052   2.491   2.491
   46    HD2  HIS   6           HD2      HIS   6  -3.850   2.383   2.383
   47    HE1  HIS   6           HE1      HIS   6  -7.150   2.822   2.822
   48    HE2  HIS   6           HE2      HIS   6  -6.410   2.667   2.667
   49    H    HIS   7           H        HIS   7  -0.673   4.069   4.069
   50    HA   HIS   7           HA       HIS   7   1.286   3.443   3.443
   51   1HB   HIS   7          2HB       HIS   7   1.108   5.208   5.208
   52   2HB   HIS   7          1HB       HIS   7   2.729   4.751   4.751
   53    HD1  HIS   7           HD1      HIS   7   2.806   5.010   5.010
   54    HD2  HIS   7           HD2      HIS   7   0.498   7.584   7.584
   55    HE1  HIS   7           HE1      HIS   7   2.454   7.054   7.054
   56    HE2  HIS   7           HE2      HIS   7   0.980   8.560   8.560
   57    H    HIS   8           H        HIS   8   1.592   1.182   1.182
   58    HA   HIS   8           HA       HIS   8   3.110   0.327   0.327
   59   1HB   HIS   8          2HB       HIS   8   0.912  -0.845  -0.845
   60   2HB   HIS   8          1HB       HIS   8   1.695  -1.499  -1.499
   61    HD1  HIS   8           HD1      HIS   8   3.224  -1.200  -1.200
   62    HD2  HIS   8           HD2      HIS   8   1.991  -4.106  -4.106
   63    HE1  HIS   8           HE1      HIS   8   3.971  -3.391  -3.391
   64    HE2  HIS   8           HE2      HIS   8   3.295  -5.126  -5.126
   65    H    HIS   9           H        HIS   9   2.984   0.328   0.328
   66    HA   HIS   9           HA       HIS   9   4.573  -0.005  -0.005
   67   1HB   HIS   9          2HB       HIS   9   5.780   1.636   1.636
   68   2HB   HIS   9          1HB       HIS   9   6.640   0.238   0.238
   69    HD1  HIS   9           HD1      HIS   9   8.371  -0.901  -0.901
   70    HD2  HIS   9           HD2      HIS   9   6.562   2.465   2.465
   71    HE1  HIS   9           HE1      HIS   9   9.750  -0.309  -0.309
   72    HE2  HIS   9           HE2      HIS   9   8.579   1.672   1.672
   73    H    HIS  10           H        HIS  10   6.380  -1.480  -1.480
   74    HA   HIS  10           HA       HIS  10   5.723  -4.142  -4.142
   75   1HB   HIS  10          2HB       HIS  10   6.828  -3.387  -3.387
   76   2HB   HIS  10          1HB       HIS  10   8.303  -3.082  -3.082
   77    HD1  HIS  10           HD1      HIS  10   9.252  -5.352  -5.352
   78    HD2  HIS  10           HD2      HIS  10   6.730  -5.862  -5.862
   79    HE1  HIS  10           HE1      HIS  10   9.628  -7.713  -7.713
   80    HE2  HIS  10           HE2      HIS  10   8.155  -7.971  -7.971
   81    H    THR  11           H        THR  11   6.033  -5.190  -5.190
   82    HA   THR  11           HA       THR  11   8.237  -4.439  -4.439
   83    HB   THR  11           HB       THR  11   7.124  -5.947  -5.947
   84    HG1  THR  11           HG1      THR  11   5.750  -7.329  -7.329
   85   1HG2  THR  11          3HG2      THR  11   6.387  -3.469  -3.469
   86   2HG2  THR  11          2HG2      THR  11   4.897  -4.279  -4.279
   87   3HG2  THR  11          1HG2      THR  11   5.517  -4.478  -4.478
   88    H    ASP  12           H        ASP  12   9.450  -6.216  -6.216
   89    HA   ASP  12           HA       ASP  12   9.685  -8.723  -8.723
   90   1HB   ASP  12          2HB       ASP  12  12.179  -8.335  -8.335
   91   2HB   ASP  12          1HB       ASP  12  11.060  -7.525  -7.525
   92    HA   PRO  13           HA       PRO  13  10.767  -8.712  -8.712
   93   1HB   PRO  13          2HB       PRO  13   9.132 -10.781 -10.781
   94   2HB   PRO  13          1HB       PRO  13   8.595  -9.097  -9.097
   95   1HG   PRO  13          2HG       PRO  13   8.232 -11.227 -11.227
   96   2HG   PRO  13          1HG       PRO  13   7.063 -10.033 -10.033
   97   1HD   PRO  13          2HD       PRO  13   8.386  -9.720  -9.720
   98   2HD   PRO  13          1HD       PRO  13   7.928  -8.344  -8.344
   99    H    MET  14           H        MET  14  10.871 -10.932 -10.932
  100    HA   MET  14           HA       MET  14  12.291 -12.978 -12.978
  101   1HB   MET  14          2HB       MET  14  11.776 -12.817 -12.817
  102   2HB   MET  14          1HB       MET  14  12.299 -14.232 -14.232
  103   1HG   MET  14          2HG       MET  14  10.222 -14.580 -14.580
  104   2HG   MET  14          1HG       MET  14   9.730 -12.901 -12.901
  105   1HE   MET  14          1HE       MET  14   7.878 -15.187 -15.187
  106   2HE   MET  14          3HE       MET  14   7.244 -13.682 -13.682
  107   3HE   MET  14          2HE       MET  14   7.251 -15.146 -15.146
  108    H    SER  15           H        SER  15  13.257 -10.076 -10.076
  109    HA   SER  15           HA       SER  15  15.845 -10.950 -10.950
  110   1HB   SER  15          2HB       SER  15  14.641  -9.299  -9.299
  111   2HB   SER  15          1HB       SER  15  14.613  -8.183  -8.183
  112    HG   SER  15           HG       SER  15  16.406  -7.545  -7.545
  113    H    ALA  16           H        ALA  16  15.164 -11.219 -11.219
  114    HA   ALA  16           HA       ALA  16  17.475 -10.073 -10.073
  115   1HB   ALA  16          3HB       ALA  16  14.858  -8.712  -8.712
  116   2HB   ALA  16          2HB       ALA  16  16.102  -8.743  -8.743
  117   3HB   ALA  16          1HB       ALA  16  16.444  -8.007  -8.007
  118    H    ILE  17           H        ILE  17  16.305 -12.645 -12.645
  119    HA   ILE  17           HA       ILE  17  15.283 -13.296 -13.296
  120    HB   ILE  17           HB       ILE  17  15.831 -15.199 -15.199
  121   1HG1  ILE  17          2HG1      ILE  17  13.162 -13.967 -13.967
  122   2HG1  ILE  17          1HG1      ILE  17  14.230 -13.288 -13.288
  123   1HG2  ILE  17          3HG2      ILE  17  15.381 -15.827 -15.827
  124   2HG2  ILE  17          2HG2      ILE  17  13.710 -15.657 -15.657
  125   3HG2  ILE  17          1HG2      ILE  17  14.784 -16.805 -16.805
  126   1HD1  ILE  17          3HD1      ILE  17  13.559 -16.165 -16.165
  127   2HD1  ILE  17          2HD1      ILE  17  12.300 -14.990 -14.990
  128   3HD1  ILE  17          1HD1      ILE  17  13.830 -14.966 -14.966
  129    H    GLN  18           H        GLN  18  16.379 -14.405 -14.405
  130    HA   GLN  18           HA       GLN  18  19.245 -14.524 -14.524
  131   1HB   GLN  18          2HB       GLN  18  17.348 -15.262 -15.262
  132   2HB   GLN  18          1HB       GLN  18  19.096 -15.418 -15.418
  133   1HG   GLN  18          2HG       GLN  18  17.569 -12.868 -12.868
  134   2HG   GLN  18          1HG       GLN  18  18.326 -13.370 -13.370
  135   1HE2  GLN  18          2HE2      GLN  18  20.491 -11.677 -11.677
  136   2HE2  GLN  18          1HE2      GLN  18  18.821 -12.079 -12.079
  137    H    ASN  19           H        ASN  19  20.549 -16.349 -16.349
  138    HA   ASN  19           HA       ASN  19  19.203 -18.833 -18.833
  139   1HB   ASN  19          2HB       ASN  19  22.116 -18.093 -18.093
  140   2HB   ASN  19          1HB       ASN  19  21.297 -19.487 -19.487
  141   1HD2  ASN  19          2HD2      ASN  19  21.574 -16.287 -16.287
  142   2HD2  ASN  19          1HD2      ASN  19  22.637 -16.813 -16.813
  143    H    LEU  20           H        LEU  20  19.368 -18.013 -18.013
  144    HA   LEU  20           HA       LEU  20  21.201 -20.053 -20.053
  145   1HB   LEU  20          2HB       LEU  20  21.071 -17.409 -17.409
  146   2HB   LEU  20          1HB       LEU  20  20.026 -18.117 -18.117
  147    HG   LEU  20           HG       LEU  20  22.067 -19.775 -19.775
  148   1HD1  LEU  20          2HD1      LEU  20  23.320 -18.739 -18.739
  149   2HD1  LEU  20          1HD1      LEU  20  23.434 -17.258 -17.258
  150   3HD1  LEU  20          3HD1      LEU  20  24.195 -18.740 -18.740
  151   1HD2  LEU  20          1HD2      LEU  20  21.122 -18.343 -18.343
  152   2HD2  LEU  20          3HD2      LEU  20  22.885 -18.322 -18.322
  153   3HD2  LEU  20          2HD2      LEU  20  22.007 -16.961 -16.961
  154    H    HIS  21           H        HIS  21  20.257 -20.609 -20.609
  155    HA   HIS  21           HA       HIS  21  18.728 -21.835 -21.835
  156   1HB   HIS  21          2HB       HIS  21  16.725 -20.303 -20.303
  157   2HB   HIS  21          1HB       HIS  21  16.355 -21.226 -21.226
  158    HD1  HIS  21           HD1      HIS  21  16.026 -18.045 -18.045
  159    HD2  HIS  21           HD2      HIS  21  18.919 -19.958 -19.958
  160    HE1  HIS  21           HE1      HIS  21  16.827 -16.322 -16.322
  161    HE2  HIS  21           HE2      HIS  21  18.519 -17.525 -17.525
  162    H    SER  22           H        SER  22  17.458 -23.730 -23.730
  163    HA   SER  22           HA       SER  22  17.493 -24.949 -24.949
  164   1HB   SER  22          2HB       SER  22  17.145 -26.589 -26.589
  165   2HB   SER  22          1HB       SER  22  17.962 -26.993 -26.993
  166    HG   SER  22           HG       SER  22  19.633 -26.623 -26.623
  167    H    PHE  23           H        PHE  23  15.662 -25.661 -25.661
  168    HA   PHE  23           HA       PHE  23  13.242 -25.936 -25.936
  169   1HB   PHE  23          2HB       PHE  23  13.231 -23.622 -23.622
  170   2HB   PHE  23          1HB       PHE  23  13.377 -24.239 -24.239
  171    HD1  PHE  23           HD1      PHE  23  11.232 -25.144 -25.144
  172    HD2  PHE  23           HD2      PHE  23  11.425 -23.942 -23.942
  173    HE1  PHE  23           HE1      PHE  23   8.781 -25.291 -25.291
  174    HE2  PHE  23           HE2      PHE  23   8.974 -24.085 -24.085
  175    HZ   PHE  23           HZ       PHE  23   7.649 -24.760 -24.760
  176    H    ASP  24           H        ASP  24  11.646 -27.272 -27.272
  177    HA   ASP  24           HA       ASP  24  12.559 -29.462 -29.462
  178   1HB   ASP  24          2HB       ASP  24   9.887 -28.439 -28.439
  179   2HB   ASP  24          1HB       ASP  24   9.931 -29.676 -29.676
  180    HA   PRO  25           HA       PRO  25  12.672 -27.387 -27.387
  181   1HB   PRO  25          2HB       PRO  25  13.625 -30.045 -30.045
  182   2HB   PRO  25          1HB       PRO  25  14.386 -28.461 -28.461
  183   1HG   PRO  25          2HG       PRO  25  15.339 -30.265 -30.265
  184   2HG   PRO  25          1HG       PRO  25  15.351 -28.530 -28.530
  185   1HD   PRO  25          2HD       PRO  25  13.475 -30.661 -30.661
  186   2HD   PRO  25          1HD       PRO  25  14.202 -29.312 -29.312
  187    H    PHE  26           H        PHE  26  11.235 -30.469 -30.469
  188    HA   PHE  26           HA       PHE  26   9.585 -30.422 -30.422
  189   1HB   PHE  26          2HB       PHE  26   9.103 -32.627 -32.627
  190   2HB   PHE  26          1HB       PHE  26   9.478 -32.668 -32.668
  191    HD1  PHE  26           HD1      PHE  26  12.078 -31.704 -31.704
  192    HD2  PHE  26           HD2      PHE  26  10.534 -33.906 -33.906
  193    HE1  PHE  26           HE1      PHE  26  14.344 -32.512 -32.512
  194    HE2  PHE  26           HE2      PHE  26  12.796 -34.718 -34.718
  195    HZ   PHE  26           HZ       PHE  26  14.705 -34.020 -34.020
  196    H    ALA  27           H        ALA  27   9.232 -30.677 -30.677
  197    HA   ALA  27           HA       ALA  27   7.548 -30.088 -30.088
  198   1HB   ALA  27          1HB       ALA  27   7.914 -27.914 -27.914
  199   2HB   ALA  27          3HB       ALA  27   6.425 -28.333 -28.333
  200   3HB   ALA  27          2HB       ALA  27   6.408 -28.092 -28.092
  201    H    ASP  28           H        ASP  28   6.617 -32.168 -32.168
  202    HA   ASP  28           HA       ASP  28   4.312 -32.518 -32.518
  203   1HB   ASP  28          2HB       ASP  28   5.785 -34.555 -34.555
  204   2HB   ASP  28          1HB       ASP  28   4.433 -34.905 -34.905
  205    H    ALA  29           H        ALA  29   3.146 -30.951 -30.951
  206    HA   ALA  29           HA       ALA  29   1.374 -32.250 -32.250
  207   1HB   ALA  29          1HB       ALA  29   3.597 -31.926 -31.926
  208   2HB   ALA  29          3HB       ALA  29   2.987 -30.282 -30.282
  209   3HB   ALA  29          2HB       ALA  29   2.028 -31.650 -31.650
  210    H    SER  30           H        SER  30   0.323 -30.295 -30.295
  211    HA   SER  30           HA       SER  30   0.169 -27.780 -27.780
  212   1HB   SER  30          2HB       SER  30  -2.166 -29.691 -29.691
  213   2HB   SER  30          1HB       SER  30  -2.230 -27.972 -27.972
  214    HG   SER  30           HG       SER  30  -1.491 -29.932 -29.932
  215    H    LYS  31           H        LYS  31   0.698 -27.212 -27.212
  216    HA   LYS  31           HA       LYS  31  -1.632 -27.283 -27.283
  217   1HB   LYS  31          2HB       LYS  31   0.896 -28.312 -28.312
  218   2HB   LYS  31          1HB       LYS  31   0.924 -26.757 -26.757
  219   1HG   LYS  31          2HG       LYS  31  -1.470 -28.420 -28.420
  220   2HG   LYS  31          1HG       LYS  31   0.043 -29.018 -29.018
  221   1HD   LYS  31          2HD       LYS  31   0.224 -26.476 -26.476
  222   2HD   LYS  31          1HD       LYS  31  -1.533 -26.596 -26.596
  223   1HE   LYS  31          2HE       LYS  31   0.218 -28.513 -28.513
  224   2HE   LYS  31          1HE       LYS  31  -0.595 -27.123 -27.123
  225   1HZ   LYS  31          2HZ       LYS  31  -2.075 -29.216 -29.216
  226   2HZ   LYS  31          1HZ       LYS  31  -1.756 -29.345 -29.345
  227   3HZ   LYS  31          3HZ       LYS  31  -2.687 -28.059 -28.059
  228    H    GLY  32           H        GLY  32  -2.576 -25.360 -25.360
  229   1HA   GLY  32          2HA       GLY  32  -1.125 -22.948 -22.948
  230   2HA   GLY  32          1HA       GLY  32  -2.836 -23.066 -23.066
  231    H    ASP  33           H        ASP  33  -2.063 -24.603 -24.603
  232    HA   ASP  33           HA       ASP  33  -1.703 -24.168 -24.168
  233   1HB   ASP  33          2HB       ASP  33   0.050 -21.904 -21.904
  234   2HB   ASP  33          1HB       ASP  33   0.085 -22.648 -22.648
  235    H    ASP  34           H        ASP  34  -4.058 -23.439 -23.439
  236    HA   ASP  34           HA       ASP  34  -4.696 -20.687 -20.687
  237   1HB   ASP  34          2HB       ASP  34  -6.262 -22.509 -22.509
  238   2HB   ASP  34          1HB       ASP  34  -6.388 -22.985 -22.985
  239    H    LEU  35           H        LEU  35  -3.854 -22.965 -22.965
  240    HA   LEU  35           HA       LEU  35  -4.938 -21.739 -21.739
  241   1HB   LEU  35          2HB       LEU  35  -3.729 -23.977 -23.977
  242   2HB   LEU  35          1HB       LEU  35  -2.237 -23.065 -23.065
  243    HG   LEU  35           HG       LEU  35  -2.914 -22.239 -22.239
  244   1HD1  LEU  35          1HD1      LEU  35  -5.382 -23.855 -23.855
  245   2HD1  LEU  35          3HD1      LEU  35  -4.889 -23.418 -23.418
  246   3HD1  LEU  35          2HD1      LEU  35  -5.261 -22.158 -22.158
  247   1HD2  LEU  35          2HD2      LEU  35  -2.763 -25.169 -25.169
  248   2HD2  LEU  35          1HD2      LEU  35  -1.590 -24.108 -24.108
  249   3HD2  LEU  35          3HD2      LEU  35  -3.043 -24.605 -24.605
  250    H    LEU  36           H        LEU  36  -4.285 -20.125 -20.125
  251    HA   LEU  36           HA       LEU  36  -2.795 -17.998 -17.998
  252   1HB   LEU  36          2HB       LEU  36  -3.512 -18.503 -18.503
  253   2HB   LEU  36          1HB       LEU  36  -3.010 -16.968 -16.968
  254    HG   LEU  36           HG       LEU  36  -5.489 -18.403 -18.403
  255   1HD1  LEU  36          3HD1      LEU  36  -5.066 -16.608 -16.608
  256   2HD1  LEU  36          2HD1      LEU  36  -6.589 -16.551 -16.551
  257   3HD1  LEU  36          1HD1      LEU  36  -6.059 -18.058 -18.058
  258   1HD2  LEU  36          1HD2      LEU  36  -4.210 -16.437 -16.437
  259   2HD2  LEU  36          3HD2      LEU  36  -5.972 -16.522 -16.522
  260   3HD2  LEU  36          2HD2      LEU  36  -5.111 -15.460 -15.460
  261    HA   PRO  37           HA       PRO  37   1.266 -19.627 -19.627
  262   1HB   PRO  37          2HB       PRO  37   2.706 -17.586 -17.586
  263   2HB   PRO  37          1HB       PRO  37   1.933 -18.811 -18.811
  264   1HG   PRO  37          2HG       PRO  37   1.006 -16.043 -16.043
  265   2HG   PRO  37          1HG       PRO  37   0.990 -16.884 -16.884
  266   1HD   PRO  37          2HD       PRO  37  -1.209 -16.659 -16.659
  267   2HD   PRO  37          1HD       PRO  37  -0.932 -18.043 -18.043
  268    H    ALA  38           H        ALA  38   0.500 -16.191 -16.191
  269    HA   ALA  38           HA       ALA  38   2.048 -16.327 -16.327
  270   1HB   ALA  38          2HB       ALA  38   2.903 -14.780 -14.780
  271   2HB   ALA  38          1HB       ALA  38   1.454 -13.811 -13.811
  272   3HB   ALA  38          3HB       ALA  38   2.614 -14.041 -14.041
  273    H    GLY  39           H        GLY  39   1.010 -15.943 -15.943
  274   1HA   GLY  39          2HA       GLY  39  -1.845 -15.431 -15.431
  275   2HA   GLY  39          1HA       GLY  39  -0.909 -15.859 -15.859
  276    H    THR  40           H        THR  40  -1.366 -14.304 -14.304
  277    HA   THR  40           HA       THR  40  -1.168 -11.504 -11.504
  278    HB   THR  40           HB       THR  40  -2.320 -11.261 -11.261
  279    HG1  THR  40           HG1      THR  40  -3.177 -13.034 -13.034
  280   1HG2  THR  40          1HG2      THR  40  -3.821 -12.047 -12.047
  281   2HG2  THR  40          3HG2      THR  40  -4.512 -11.264 -11.264
  282   3HG2  THR  40          2HG2      THR  40  -3.313 -10.416 -10.416
  283    H    GLU  41           H        GLU  41   0.340 -13.905 -13.905
  284    HA   GLU  41           HA       GLU  41   2.220 -13.892 -13.892
  285   1HB   GLU  41          2HB       GLU  41   2.410 -11.420 -11.420
  286   2HB   GLU  41          1HB       GLU  41   3.249 -11.330 -11.330
  287   1HG   GLU  41          2HG       GLU  41   3.659 -13.531 -13.531
  288   2HG   GLU  41          1HG       GLU  41   4.650 -12.076 -12.076
  289    H    ASP  42           H        ASP  42  -0.532 -12.610 -12.610
  290    HA   ASP  42           HA       ASP  42  -1.460 -11.704 -11.704
  291   1HB   ASP  42          2HB       ASP  42   0.625 -13.563 -13.563
  292   2HB   ASP  42          1HB       ASP  42   0.295 -12.339 -12.339
  293    H    TYR  43           H        TYR  43  -0.591  -9.649  -9.649
  294    HA   TYR  43           HA       TYR  43   1.575  -8.227  -8.227
  295   1HB   TYR  43          2HB       TYR  43  -0.928  -7.161  -7.161
  296   2HB   TYR  43          1HB       TYR  43   0.539  -6.235  -6.235
  297    HD1  TYR  43           HD1      TYR  43   2.251  -8.882  -8.882
  298    HD2  TYR  43           HD2      TYR  43  -0.724  -6.563  -6.563
  299    HE1  TYR  43           HE1      TYR  43   3.137  -9.602  -9.602
  300    HE2  TYR  43           HE2      TYR  43   0.157  -7.276  -7.276
  301    HH   TYR  43           HH       TYR  43   2.233  -9.844  -9.844
  302    H    ILE  44           H        ILE  44   1.337  -6.104  -6.104
  303    HA   ILE  44           HA       ILE  44  -0.549  -6.452  -6.452
  304    HB   ILE  44           HB       ILE  44   2.194  -5.224  -5.224
  305   1HG1  ILE  44          2HG1      ILE  44   2.824  -6.905  -6.905
  306   2HG1  ILE  44          1HG1      ILE  44   1.357  -6.799  -6.799
  307   1HG2  ILE  44          2HG2      ILE  44  -0.056  -4.392  -4.392
  308   2HG2  ILE  44          1HG2      ILE  44   1.456  -4.708  -4.708
  309   3HG2  ILE  44          3HG2      ILE  44   1.408  -3.519  -3.519
  310   1HD1  ILE  44          2HD1      ILE  44   1.593  -8.186  -8.186
  311   2HD1  ILE  44          1HD1      ILE  44   1.617  -8.973  -8.973
  312   3HD1  ILE  44          3HD1      ILE  44   0.164  -8.136  -8.136
  313    H    HIS  45           H        HIS  45  -2.190  -5.525  -5.525
  314    HA   HIS  45           HA       HIS  45  -2.112  -2.989  -2.989
  315   1HB   HIS  45          2HB       HIS  45  -3.949  -5.072  -5.072
  316   2HB   HIS  45          1HB       HIS  45  -4.734  -3.699  -3.699
  317    HD1  HIS  45           HD1      HIS  45  -3.696  -5.036  -5.036
  318    HD2  HIS  45           HD2      HIS  45  -5.373  -1.570  -1.570
  319    HE1  HIS  45           HE1      HIS  45  -4.608  -3.786  -3.786
  320    HE2  HIS  45           HE2      HIS  45  -5.717  -1.744  -1.744
  321    H    ILE  46           H        ILE  46  -1.742  -1.120  -1.120
  322    HA   ILE  46           HA       ILE  46  -2.275  -0.747  -0.747
  323    HB   ILE  46           HB       ILE  46  -1.531   1.361   1.361
  324   1HG1  ILE  46          2HG1      ILE  46   0.059  -0.590  -0.590
  325   2HG1  ILE  46          1HG1      ILE  46   0.761   0.971   0.971
  326   1HG2  ILE  46          1HG2      ILE  46  -1.507   1.297   1.297
  327   2HG2  ILE  46          3HG2      ILE  46  -0.586   2.473   2.473
  328   3HG2  ILE  46          2HG2      ILE  46  -2.344   2.427   2.427
  329   1HD1  ILE  46          3HD1      ILE  46   0.073   0.182   0.182
  330   2HD1  ILE  46          2HD1      ILE  46   0.281  -1.397  -1.397
  331   3HD1  ILE  46          1HD1      ILE  46   1.613  -0.241  -0.241
  332    H    ARG  47           H        ARG  47  -3.226   1.827   1.827
  333    HA   ARG  47           HA       ARG  47  -5.248   2.719   2.719
  334   1HB   ARG  47          2HB       ARG  47  -5.930   0.103   0.103
  335   2HB   ARG  47          1HB       ARG  47  -6.930   0.892   0.892
  336   1HG   ARG  47          2HG       ARG  47  -8.070   2.162   2.162
  337   2HG   ARG  47          1HG       ARG  47  -6.859   1.836   1.836
  338   1HD   ARG  47          2HD       ARG  47  -7.726  -0.195  -0.195
  339   2HD   ARG  47          1HD       ARG  47  -8.206  -0.520  -0.520
  340    HE   ARG  47           HE       ARG  47  -9.769   1.523   1.523
  341   1HH1  ARG  47          2HH1      ARG  47  -9.428  -1.906  -1.906
  342   2HH1  ARG  47          1HH1      ARG  47 -11.102  -2.245  -2.245
  343   1HH2  ARG  47          1HH2      ARG  47 -11.969   1.079   1.079
  344   2HH2  ARG  47          2HH2      ARG  47 -12.544  -0.550  -0.550
  345    H    ILE  48           H        ILE  48  -5.812   4.547   4.547
  346    HA   ILE  48           HA       ILE  48  -5.892   4.787   4.787
  347    HB   ILE  48           HB       ILE  48  -5.580   6.769   6.769
  348   1HG1  ILE  48          2HG1      ILE  48  -4.061   6.268   6.268
  349   2HG1  ILE  48          1HG1      ILE  48  -3.566   5.776   5.776
  350   1HG2  ILE  48          3HG2      ILE  48  -6.394   7.439   7.439
  351   2HG2  ILE  48          2HG2      ILE  48  -5.759   8.603   8.603
  352   3HG2  ILE  48          1HG2      ILE  48  -7.289   7.786   7.786
  353   1HD1  ILE  48          3HD1      ILE  48  -3.973   8.635   8.635
  354   2HD1  ILE  48          2HD1      ILE  48  -2.418   7.800   7.800
  355   3HD1  ILE  48          1HD1      ILE  48  -3.255   8.043   8.043
  356    H    GLN  49           H        GLN  49  -7.643   5.973   5.973
  357    HA   GLN  49           HA       GLN  49 -10.108   6.195   6.195
  358   1HB   GLN  49          2HB       GLN  49 -11.414   5.006   5.006
  359   2HB   GLN  49          1HB       GLN  49 -10.177   3.958   3.958
  360   1HG   GLN  49          2HG       GLN  49  -8.892   5.001   5.001
  361   2HG   GLN  49          1HG       GLN  49 -10.552   4.907   4.907
  362   1HE2  GLN  49          2HE2      GLN  49 -10.535   1.477   1.477
  363   2HE2  GLN  49          1HE2      GLN  49 -11.365   2.985   2.985
  364    H    GLN  50           H        GLN  50 -10.229   8.373   8.373
  365    HA   GLN  50           HA       GLN  50  -9.939   9.606   9.606
  366   1HB   GLN  50          2HB       GLN  50  -9.140  10.407  10.407
  367   2HB   GLN  50          1HB       GLN  50 -10.590  11.367  11.367
  368   1HG   GLN  50          2HG       GLN  50  -9.685  12.314  12.314
  369   2HG   GLN  50          1HG       GLN  50  -8.304  11.222  11.222
  370   1HE2  GLN  50          2HE2      GLN  50  -6.628  13.965  13.965
  371   2HE2  GLN  50          1HE2      GLN  50  -6.910  13.005  13.005
  372    H    ARG  51           H        ARG  51 -11.600  10.150  10.150
  373    HA   ARG  51           HA       ARG  51 -14.281  10.176  10.176
  374   1HB   ARG  51          2HB       ARG  51 -13.219   9.071   9.071
  375   2HB   ARG  51          1HB       ARG  51 -14.529  10.189  10.189
  376   1HG   ARG  51          2HG       ARG  51 -15.667   8.216   8.216
  377   2HG   ARG  51          1HG       ARG  51 -15.778   8.873   8.873
  378   1HD   ARG  51          2HD       ARG  51 -14.356   7.322   7.322
  379   2HD   ARG  51          1HD       ARG  51 -13.436   7.168   7.168
  380    HE   ARG  51           HE       ARG  51 -14.770   5.412   5.412
  381   1HH1  ARG  51          2HH1      ARG  51 -16.462   7.349   7.349
  382   2HH1  ARG  51          1HH1      ARG  51 -17.794   6.251   6.251
  383   1HH2  ARG  51          1HH2      ARG  51 -16.522   3.966   3.966
  384   2HH2  ARG  51          2HH2      ARG  51 -17.830   4.330   4.330
  385    H    ASN  52           H        ASN  52 -15.423  12.014  12.014
  386    HA   ASN  52           HA       ASN  52 -16.036  14.180  14.180
  387   1HB   ASN  52          2HB       ASN  52 -16.018  13.465  13.465
  388   2HB   ASN  52          1HB       ASN  52 -14.393  14.136  14.136
  389   1HD2  ASN  52          2HD2      ASN  52 -15.511  17.333  17.333
  390   2HD2  ASN  52          1HD2      ASN  52 -14.265  16.141  16.141
  391    H    GLY  53           H        GLY  53 -13.390  13.323  13.323
  392   1HA   GLY  53          2HA       GLY  53 -11.652  14.367  14.367
  393   2HA   GLY  53          1HA       GLY  53 -12.483  15.880  15.880
  394    H    ARG  54           H        ARG  54 -11.077  13.492  13.492
  395    HA   ARG  54           HA       ARG  54  -8.753  14.947  14.947
  396   1HB   ARG  54          2HB       ARG  54  -9.253  16.050  16.050
  397   2HB   ARG  54          1HB       ARG  54 -10.475  16.551  16.551
  398   1HG   ARG  54          2HG       ARG  54 -11.867  16.120  16.120
  399   2HG   ARG  54          1HG       ARG  54 -11.742  14.464  14.464
  400   1HD   ARG  54          2HD       ARG  54 -11.433  14.689  14.689
  401   2HD   ARG  54          1HD       ARG  54 -10.073  13.934  13.934
  402    HE   ARG  54           HE       ARG  54  -8.761  15.658  15.658
  403   1HH1  ARG  54          2HH1      ARG  54 -12.092  16.688  16.688
  404   2HH1  ARG  54          1HH1      ARG  54 -11.719  18.208  18.208
  405   1HH2  ARG  54          1HH2      ARG  54  -8.268  17.656  17.656
  406   2HH2  ARG  54          2HH2      ARG  54  -9.549  18.757  18.757
  407    H    LYS  55           H        LYS  55 -11.232  12.767  12.767
  408    HA   LYS  55           HA       LYS  55  -9.485  11.484  11.484
  409   1HB   LYS  55          2HB       LYS  55 -12.189  10.747  10.747
  410   2HB   LYS  55          1HB       LYS  55 -11.337   9.747   9.747
  411   1HG   LYS  55          2HG       LYS  55 -12.087  12.625  12.625
  412   2HG   LYS  55          1HG       LYS  55 -13.046  11.243  11.243
  413   1HD   LYS  55          2HD       LYS  55 -10.181  11.767  11.767
  414   2HD   LYS  55          1HD       LYS  55 -11.589  12.164  12.164
  415   1HE   LYS  55          2HE       LYS  55 -11.776   9.439   9.439
  416   2HE   LYS  55          1HE       LYS  55 -10.178   9.717   9.717
  417   1HZ   LYS  55          1HZ       LYS  55 -12.450  10.809  10.809
  418   2HZ   LYS  55          3HZ       LYS  55 -12.288   9.124   9.124
  419   3HZ   LYS  55          2HZ       LYS  55 -11.029  10.098  10.098
  420    H    THR  56           H        THR  56  -7.799  11.311  11.311
  421    HA   THR  56           HA       THR  56  -8.146   9.229   9.229
  422    HB   THR  56           HB       THR  56  -5.394   9.995   9.995
  423    HG1  THR  56           HG1      THR  56  -5.619  12.068  12.068
  424   1HG2  THR  56          3HG2      THR  56  -7.009   9.486   9.486
  425   2HG2  THR  56          2HG2      THR  56  -5.982  10.908  10.908
  426   3HG2  THR  56          1HG2      THR  56  -5.266   9.348   9.348
  427    H    LEU  57           H        LEU  57  -7.559   7.131   7.131
  428    HA   LEU  57           HA       LEU  57  -5.998   6.190   6.190
  429   1HB   LEU  57          2HB       LEU  57  -8.816   5.488   5.488
  430   2HB   LEU  57          1HB       LEU  57  -7.774   4.199   4.199
  431    HG   LEU  57           HG       LEU  57  -7.891   6.737   6.737
  432   1HD1  LEU  57          3HD1      LEU  57 -10.113   4.818   4.818
  433   2HD1  LEU  57          2HD1      LEU  57  -9.776   5.358   5.358
  434   3HD1  LEU  57          1HD1      LEU  57 -10.150   6.538   6.538
  435   1HD2  LEU  57          2HD2      LEU  57  -7.079   3.937   3.937
  436   2HD2  LEU  57          1HD2      LEU  57  -6.459   5.412   5.412
  437   3HD2  LEU  57          3HD2      LEU  57  -7.928   4.663   4.663
  438    H    THR  58           H        THR  58  -4.271   5.477   5.477
  439    HA   THR  58           HA       THR  58  -4.548   4.109   4.109
  440    HB   THR  58           HB       THR  58  -2.145   4.390   4.390
  441    HG1  THR  58           HG1      THR  58  -3.239   6.324   6.324
  442   1HG2  THR  58          3HG2      THR  58  -2.304   2.659   2.659
  443   2HG2  THR  58          2HG2      THR  58  -1.769   4.119   4.119
  444   3HG2  THR  58          1HG2      THR  58  -0.823   3.472   3.472
  445    H    THR  59           H        THR  59  -5.207   2.068   2.068
  446    HA   THR  59           HA       THR  59  -4.772   0.234   0.234
  447    HB   THR  59           HB       THR  59  -6.303  -1.162  -1.162
  448    HG1  THR  59           HG1      THR  59  -7.787   0.250   0.250
  449   1HG2  THR  59          2HG2      THR  59  -7.006   0.579   0.579
  450   2HG2  THR  59          1HG2      THR  59  -8.287  -0.141  -0.141
  451   3HG2  THR  59          3HG2      THR  59  -7.108  -1.175  -1.175
  452    H    VAL  60           H        VAL  60  -4.180  -2.012  -2.012
  453    HA   VAL  60           HA       VAL  60  -2.456  -2.256  -2.256
  454    HB   VAL  60           HB       VAL  60  -1.795  -3.347  -3.347
  455   1HG1  VAL  60          2HG1      VAL  60  -1.000  -4.376  -4.376
  456   2HG1  VAL  60          1HG1      VAL  60   0.255  -3.164  -3.164
  457   3HG1  VAL  60          3HG1      VAL  60  -0.016  -4.415  -4.415
  458   1HG2  VAL  60          3HG2      VAL  60  -1.011  -0.847  -0.847
  459   2HG2  VAL  60          2HG2      VAL  60  -1.348  -1.117  -1.117
  460   3HG2  VAL  60          1HG2      VAL  60   0.181  -1.657  -1.657
  461    H    GLN  61           H        GLN  61  -3.433  -3.697  -3.697
  462    HA   GLN  61           HA       GLN  61  -4.995  -5.863  -5.863
  463   1HB   GLN  61          2HB       GLN  61  -4.856  -4.491  -4.491
  464   2HB   GLN  61          1HB       GLN  61  -4.840  -6.231  -6.231
  465   1HG   GLN  61          2HG       GLN  61  -7.037  -6.212  -6.212
  466   2HG   GLN  61          1HG       GLN  61  -6.823  -5.765  -5.765
  467   1HE2  GLN  61          2HE2      GLN  61  -7.024  -2.181  -2.181
  468   2HE2  GLN  61          1HE2      GLN  61  -5.741  -3.174  -3.174
  469    H    GLY  62           H        GLY  62  -2.598  -6.365  -6.365
  470   1HA   GLY  62          2HA       GLY  62  -1.904  -8.851  -8.851
  471   2HA   GLY  62          1HA       GLY  62  -0.666  -7.624  -7.624
  472    H    ILE  63           H        ILE  63   0.878  -8.555  -8.555
  473    HA   ILE  63           HA       ILE  63   2.026  -9.063  -9.063
  474    HB   ILE  63           HB       ILE  63   0.031  -7.063  -7.063
  475   1HG1  ILE  63          2HG1      ILE  63   1.809  -5.555  -5.555
  476   2HG1  ILE  63          1HG1      ILE  63   3.015  -6.827  -6.827
  477   1HG2  ILE  63          3HG2      ILE  63   1.614  -8.861  -8.861
  478   2HG2  ILE  63          2HG2      ILE  63   1.841  -7.153  -7.153
  479   3HG2  ILE  63          1HG2      ILE  63   0.224  -7.857  -7.857
  480   1HD1  ILE  63          1HD1      ILE  63   1.346  -6.384  -6.384
  481   2HD1  ILE  63          3HD1      ILE  63   2.932  -5.658  -5.658
  482   3HD1  ILE  63          2HD1      ILE  63   2.768  -7.412  -7.412
  483    H    ALA  64           H        ALA  64   2.070 -10.532 -10.532
  484    HA   ALA  64           HA       ALA  64  -0.381 -12.127 -12.127
  485   1HB   ALA  64          2HB       ALA  64   2.497 -12.783 -12.783
  486   2HB   ALA  64          1HB       ALA  64   1.503 -13.740 -13.740
  487   3HB   ALA  64          3HB       ALA  64   1.109 -13.676 -13.676
  488    H    ASP  65           H        ASP  65  -0.903 -13.037 -13.037
  489    HA   ASP  65           HA       ASP  65  -0.857 -11.173 -11.173
  490   1HB   ASP  65          2HB       ASP  65  -2.351 -13.352 -13.352
  491   2HB   ASP  65          1HB       ASP  65  -1.285 -14.022 -14.022
  492    H    ASP  66           H        ASP  66   1.452 -13.517 -13.517
  493    HA   ASP  66           HA       ASP  66   2.736 -13.555 -13.555
  494   1HB   ASP  66          2HB       ASP  66   3.525 -15.000 -15.000
  495   2HB   ASP  66          1HB       ASP  66   4.198 -15.267 -15.267
  496    H    TYR  67           H        TYR  67   2.670 -11.075 -11.075
  497    HA   TYR  67           HA       TYR  67   5.422 -10.738 -10.738
  498   1HB   TYR  67          2HB       TYR  67   2.883  -9.218  -9.218
  499   2HB   TYR  67          1HB       TYR  67   4.389  -8.313  -8.313
  500    HD1  TYR  67           HD2      TYR  67   4.484 -11.748 -11.748
  501    HD2  TYR  67           HD1      TYR  67   3.816  -7.708  -7.708
  502    HE1  TYR  67           HE2      TYR  67   4.782 -12.376 -12.376
  503    HE2  TYR  67           HE1      TYR  67   4.108  -8.321  -8.321
  504    HH   TYR  67           HH       TYR  67   5.565 -10.743 -10.743
  505    H    ASP  68           H        ASP  68   4.753 -11.163 -11.163
  506    HA   ASP  68           HA       ASP  68   5.667 -10.474 -10.474
  507   1HB   ASP  68          2HB       ASP  68   7.210  -9.123  -9.123
  508   2HB   ASP  68          1HB       ASP  68   6.458  -7.779  -7.779
  509    H    LYS  69           H        LYS  69   3.255  -8.854  -8.854
  510    HA   LYS  69           HA       LYS  69   1.468  -7.605  -7.605
  511   1HB   LYS  69          2HB       LYS  69   2.094  -9.273  -9.273
  512   2HB   LYS  69          1HB       LYS  69   1.475  -7.729  -7.729
  513   1HG   LYS  69          2HG       LYS  69  -0.441  -8.067  -8.067
  514   2HG   LYS  69          1HG       LYS  69   0.130  -9.729  -9.729
  515   1HD   LYS  69          2HD       LYS  69  -0.496 -10.287 -10.287
  516   2HD   LYS  69          1HD       LYS  69  -0.269  -8.647  -8.647
  517   1HE   LYS  69          2HE       LYS  69  -2.389  -8.059  -8.059
  518   2HE   LYS  69          1HE       LYS  69  -2.394  -8.903  -8.903
  519   1HZ   LYS  69          3HZ       LYS  69  -2.411 -10.553 -10.553
  520   2HZ   LYS  69          2HZ       LYS  69  -3.831  -9.700  -9.700
  521   3HZ   LYS  69          1HZ       LYS  69  -3.202 -10.785 -10.785
  522    H    LYS  70           H        LYS  70   3.336  -7.017  -7.017
  523    HA   LYS  70           HA       LYS  70   2.883  -4.288  -4.288
  524   1HB   LYS  70          2HB       LYS  70   5.292  -5.792  -5.792
  525   2HB   LYS  70          1HB       LYS  70   4.802  -4.180  -4.180
  526   1HG   LYS  70          2HG       LYS  70   2.589  -5.276  -5.276
  527   2HG   LYS  70          1HG       LYS  70   3.463  -6.803  -6.803
  528   1HD   LYS  70          2HD       LYS  70   3.768  -6.293  -6.293
  529   2HD   LYS  70          1HD       LYS  70   5.226  -5.610  -5.610
  530   1HE   LYS  70          2HE       LYS  70   3.463  -3.531  -3.531
  531   2HE   LYS  70          1HE       LYS  70   2.973  -4.283  -4.283
  532   1HZ   LYS  70          2HZ       LYS  70   5.830  -3.915  -3.915
  533   2HZ   LYS  70          1HZ       LYS  70   4.929  -2.494  -2.494
  534   3HZ   LYS  70          3HZ       LYS  70   4.874  -3.683  -3.683
  535    H    LYS  71           H        LYS  71   5.994  -5.775  -5.775
  536    HA   LYS  71           HA       LYS  71   7.263  -3.540  -3.540
  537   1HB   LYS  71          2HB       LYS  71   8.091  -5.987  -5.987
  538   2HB   LYS  71          1HB       LYS  71   7.522  -6.162  -6.162
  539   1HG   LYS  71          2HG       LYS  71   8.987  -4.258  -4.258
  540   2HG   LYS  71          1HG       LYS  71   9.632  -4.267  -4.267
  541   1HD   LYS  71          2HD       LYS  71  11.119  -5.781  -5.781
  542   2HD   LYS  71          1HD       LYS  71   9.787  -6.921  -6.921
  543   1HE   LYS  71          2HE       LYS  71   9.523  -5.649  -5.649
  544   2HE   LYS  71          1HE       LYS  71  11.232  -5.308  -5.308
  545   1HZ   LYS  71          1HZ       LYS  71  11.237  -7.886  -7.886
  546   2HZ   LYS  71          3HZ       LYS  71   9.907  -7.851  -7.851
  547   3HZ   LYS  71          2HZ       LYS  71  11.410  -7.280  -7.280
  548    H    LEU  72           H        LEU  72   4.630  -5.263  -5.263
  549    HA   LEU  72           HA       LEU  72   4.978  -4.371  -4.371
  550   1HB   LEU  72          2HB       LEU  72   3.481  -6.265  -6.265
  551   2HB   LEU  72          1HB       LEU  72   2.297  -4.995  -4.995
  552    HG   LEU  72           HG       LEU  72   3.441  -6.034  -6.034
  553   1HD1  LEU  72          1HD1      LEU  72   0.780  -6.016  -6.016
  554   2HD1  LEU  72          3HD1      LEU  72   0.862  -6.029  -6.029
  555   3HD1  LEU  72          2HD1      LEU  72   1.614  -7.327  -7.327
  556   1HD2  LEU  72          2HD2      LEU  72   2.000  -3.453  -3.453
  557   2HD2  LEU  72          1HD2      LEU  72   3.487  -3.719  -3.719
  558   3HD2  LEU  72          3HD2      LEU  72   1.941  -4.249  -4.249
  559    H    VAL  73           H        VAL  73   2.180  -3.443  -3.443
  560    HA   VAL  73           HA       VAL  73   2.115  -0.869  -0.869
  561    HB   VAL  73           HB       VAL  73   0.088  -2.335  -2.335
  562   1HG1  VAL  73          1HG1      VAL  73   0.678  -2.693  -2.693
  563   2HG1  VAL  73          3HG1      VAL  73   0.431  -0.975  -0.975
  564   3HG1  VAL  73          2HG1      VAL  73  -0.926  -1.985  -1.985
  565   1HG2  VAL  73          3HG2      VAL  73   0.167   0.109   0.109
  566   2HG2  VAL  73          2HG2      VAL  73  -1.322  -0.483  -0.483
  567   3HG2  VAL  73          1HG2      VAL  73  -0.203   0.506   0.506
  568    H    LYS  74           H        LYS  74   2.594  -2.076  -2.076
  569    HA   LYS  74           HA       LYS  74   2.688   0.302   0.302
  570   1HB   LYS  74          2HB       LYS  74   3.059  -2.227  -2.227
  571   2HB   LYS  74          1HB       LYS  74   4.750  -1.754  -1.754
  572   1HG   LYS  74          2HG       LYS  74   2.617  -0.489  -0.489
  573   2HG   LYS  74          1HG       LYS  74   3.943  -1.516  -1.516
  574   1HD   LYS  74          2HD       LYS  74   5.473   0.250   0.250
  575   2HD   LYS  74          1HD       LYS  74   4.044   1.287   1.287
  576   1HE   LYS  74          2HE       LYS  74   4.933  -0.137  -0.137
  577   2HE   LYS  74          1HE       LYS  74   5.694   1.377   1.377
  578   1HZ   LYS  74          3HZ       LYS  74   2.764   1.070   1.070
  579   2HZ   LYS  74          2HZ       LYS  74   3.787   1.600   1.600
  580   3HZ   LYS  74          1HZ       LYS  74   3.639   2.508   2.508
  581    H    ALA  75           H        ALA  75   5.257  -1.244  -1.244
  582    HA   ALA  75           HA       ALA  75   7.287   0.610   0.610
  583   1HB   ALA  75          3HB       ALA  75   7.494  -1.727  -1.727
  584   2HB   ALA  75          2HB       ALA  75   7.241  -0.883  -0.883
  585   3HB   ALA  75          1HB       ALA  75   8.615  -0.464  -0.464
  586    H    PHE  76           H        PHE  76   4.813   0.562   0.562
  587    HA   PHE  76           HA       PHE  76   5.788   2.510   2.510
  588   1HB   PHE  76          2HB       PHE  76   3.583   1.085   1.085
  589   2HB   PHE  76          1HB       PHE  76   2.873   2.492   2.492
  590    HD1  PHE  76           HD2      PHE  76   4.666   1.341   1.341
  591    HD2  PHE  76           HD1      PHE  76   2.393   4.467   4.467
  592    HE1  PHE  76           HE2      PHE  76   4.490   2.452   2.452
  593    HE2  PHE  76           HE1      PHE  76   2.215   5.583   5.583
  594    HZ   PHE  76           HZ       PHE  76   3.261   4.577   4.577
  595    H    LYS  77           H        LYS  77   3.695   2.954   2.954
  596    HA   LYS  77           HA       LYS  77   3.620   5.762   5.762
  597   1HB   LYS  77          2HB       LYS  77   3.355   3.992   3.992
  598   2HB   LYS  77          1HB       LYS  77   2.764   5.640   5.640
  599   1HG   LYS  77          2HG       LYS  77   0.836   4.848   4.848
  600   2HG   LYS  77          1HG       LYS  77   1.665   4.170   4.170
  601   1HD   LYS  77          2HD       LYS  77   0.713   2.275   2.275
  602   2HD   LYS  77          1HD       LYS  77   2.272   2.254   2.254
  603   1HE   LYS  77          2HE       LYS  77   0.310   1.817   1.817
  604   2HE   LYS  77          1HE       LYS  77   1.315   3.176   3.176
  605   1HZ   LYS  77          1HZ       LYS  77  -1.016   3.678   3.678
  606   2HZ   LYS  77          3HZ       LYS  77  -1.259   3.399   3.399
  607   3HZ   LYS  77          2HZ       LYS  77  -0.288   4.688   4.688
  608    H    LYS  78           H        LYS  78   6.159   3.663   3.663
  609    HA   LYS  78           HA       LYS  78   7.479   5.689   5.689
  610   1HB   LYS  78          2HB       LYS  78   7.320   3.090   3.090
  611   2HB   LYS  78          1HB       LYS  78   8.715   3.038   3.038
  612   1HG   LYS  78          2HG       LYS  78   8.911   5.085   5.085
  613   2HG   LYS  78          1HG       LYS  78   8.789   3.441   3.441
  614   1HD   LYS  78          2HD       LYS  78  10.642   3.805   3.805
  615   2HD   LYS  78          1HD       LYS  78  11.108   4.604   4.604
  616   1HE   LYS  78          2HE       LYS  78  10.789   2.436   2.436
  617   2HE   LYS  78          1HE       LYS  78  10.493   1.677   1.677
  618   1HZ   LYS  78          3HZ       LYS  78  12.963   3.217   3.217
  619   2HZ   LYS  78          2HZ       LYS  78  12.854   1.639   1.639
  620   3HZ   LYS  78          1HZ       LYS  78  12.672   1.929   1.929
  621    H    LYS  79           H        LYS  79   7.485   4.370   4.370
  622    HA   LYS  79           HA       LYS  79  10.160   5.395   5.395
  623   1HB   LYS  79          2HB       LYS  79   9.262   3.103   3.103
  624   2HB   LYS  79          1HB       LYS  79   8.361   4.020   4.020
  625   1HG   LYS  79          2HG       LYS  79  10.706   5.059   5.059
  626   2HG   LYS  79          1HG       LYS  79  11.293   3.581   3.581
  627   1HD   LYS  79          2HD       LYS  79  10.294   2.214   2.214
  628   2HD   LYS  79          1HD       LYS  79   9.221   3.500   3.500
  629   1HE   LYS  79          2HE       LYS  79  11.085   2.998   2.998
  630   2HE   LYS  79          1HE       LYS  79  11.046   4.672   4.672
  631   1HZ   LYS  79          1HZ       LYS  79  12.768   4.116   4.116
  632   2HZ   LYS  79          3HZ       LYS  79  12.825   2.531   2.531
  633   3HZ   LYS  79          2HZ       LYS  79  13.288   3.818   3.818
  634    H    PHE  80           H        PHE  80   6.779   5.931   5.931
  635    HA   PHE  80           HA       PHE  80   7.613   8.294   8.294
  636   1HB   PHE  80          2HB       PHE  80   4.936   6.918   6.918
  637   2HB   PHE  80          1HB       PHE  80   5.614   8.106   8.106
  638    HD1  PHE  80           HD2      PHE  80   5.716   4.613   4.613
  639    HD2  PHE  80           HD1      PHE  80   7.202   7.477   7.477
  640    HE1  PHE  80           HE2      PHE  80   6.613   2.792   2.792
  641    HE2  PHE  80           HE1      PHE  80   8.102   5.664   5.664
  642    HZ   PHE  80           HZ       PHE  80   7.808   3.321   3.321
  643    H    ALA  81           H        ALA  81   5.919   7.241   7.241
  644    HA   ALA  81           HA       ALA  81   5.018   8.451   8.451
  645   1HB   ALA  81          2HB       ALA  81   6.643  10.297  10.297
  646   2HB   ALA  81          1HB       ALA  81   5.079  11.066  11.066
  647   3HB   ALA  81          3HB       ALA  81   5.572  10.625  10.625
  648    H    CYS  82           H        CYS  82   3.583   7.359   7.359
  649    HA   CYS  82           HA       CYS  82   1.260   9.135   9.135
  650   1HB   CYS  82          2HB       CYS  82   1.741   6.579   6.579
  651   2HB   CYS  82          1HB       CYS  82   0.556   7.832   7.832
  652    HG   CYS  82           HG       CYS  82   3.575   8.491   8.491
  653    H    ASN  83           H        ASN  83  -0.850   7.632   7.632
  654    HA   ASN  83           HA       ASN  83  -0.958   6.044   6.044
  655   1HB   ASN  83          2HB       ASN  83  -2.703   8.047   8.047
  656   2HB   ASN  83          1HB       ASN  83  -3.581   6.538   6.538
  657   1HD2  ASN  83          2HD2      ASN  83  -1.734   7.902   7.902
  658   2HD2  ASN  83          1HD2      ASN  83  -0.867   7.736   7.736
  659    H    GLY  84           H        GLY  84  -0.593   3.989   3.989
  660   1HA   GLY  84          2HA       GLY  84  -1.954   2.864   2.864
  661   2HA   GLY  84          1HA       GLY  84  -0.519   2.188   2.188
  662    H    THR  85           H        THR  85  -3.397   1.257   1.257
  663    HA   THR  85           HA       THR  85  -3.713  -0.129  -0.129
  664    HB   THR  85           HB       THR  85  -6.157   0.224   0.224
  665    HG1  THR  85           HG1      THR  85  -7.077   1.178   1.178
  666   1HG2  THR  85          1HG2      THR  85  -4.591   2.791   2.791
  667   2HG2  THR  85          3HG2      THR  85  -6.217   2.580   2.580
  668   3HG2  THR  85          2HG2      THR  85  -4.856   1.735   1.735
  669    H    VAL  86           H        VAL  86  -3.862  -2.235  -2.235
  670    HA   VAL  86           HA       VAL  86  -4.319  -3.300  -3.300
  671    HB   VAL  86           HB       VAL  86  -2.559  -4.268  -4.268
  672   1HG1  VAL  86          2HG1      VAL  86  -4.284  -3.996  -3.996
  673   2HG1  VAL  86          1HG1      VAL  86  -4.423  -5.722  -5.722
  674   3HG1  VAL  86          3HG1      VAL  86  -2.847  -5.018  -5.018
  675   1HG2  VAL  86          1HG2      VAL  86  -4.267  -5.604  -5.604
  676   2HG2  VAL  86          3HG2      VAL  86  -2.846  -6.329  -6.329
  677   3HG2  VAL  86          2HG2      VAL  86  -4.435  -6.530  -6.530
  678    H    ILE  87           H        ILE  87  -6.355  -3.542  -3.542
  679    HA   ILE  87           HA       ILE  87  -8.342  -4.624  -4.624
  680    HB   ILE  87           HB       ILE  87 -10.088  -3.336  -3.336
  681   1HG1  ILE  87          2HG1      ILE  87  -8.491  -1.352  -1.352
  682   2HG1  ILE  87          1HG1      ILE  87  -8.048  -2.932  -2.932
  683   1HG2  ILE  87          1HG2      ILE  87  -7.789  -1.798  -1.798
  684   2HG2  ILE  87          3HG2      ILE  87  -9.335  -1.048  -1.048
  685   3HG2  ILE  87          2HG2      ILE  87  -9.264  -2.343  -2.343
  686   1HD1  ILE  87          2HD1      ILE  87 -10.604  -3.270  -3.270
  687   2HD1  ILE  87          1HD1      ILE  87 -10.668  -1.512  -1.512
  688   3HD1  ILE  87          3HD1      ILE  87  -9.746  -2.274  -2.274
  689    H    GLU  88           H        GLU  88  -9.990  -5.946  -5.946
  690    HA   GLU  88           HA       GLU  88  -9.128  -7.334  -7.334
  691   1HB   GLU  88          2HB       GLU  88  -9.613  -8.522  -8.522
  692   2HB   GLU  88          1HB       GLU  88 -11.309  -8.245  -8.245
  693   1HG   GLU  88          2HG       GLU  88 -11.281  -9.673  -9.673
  694   2HG   GLU  88          1HG       GLU  88  -9.531  -9.565  -9.565
  695    H    HIS  89           H        HIS  89  -9.953  -5.360  -5.360
  696    HA   HIS  89           HA       HIS  89 -12.557  -4.520  -4.520
  697   1HB   HIS  89          2HB       HIS  89 -10.347  -3.842  -3.842
  698   2HB   HIS  89          1HB       HIS  89 -11.108  -4.814  -4.814
  699    HD1  HIS  89           HD1      HIS  89 -12.856  -3.691  -3.691
  700    HD2  HIS  89           HD2      HIS  89 -12.026  -1.613  -1.613
  701    HE1  HIS  89           HE1      HIS  89 -14.151  -1.542  -1.542
  702    HE2  HIS  89           HE2      HIS  89 -13.564  -0.261  -0.261
  703    HA   PRO  90           HA       PRO  90 -14.720  -8.076  -8.076
  704   1HB   PRO  90          2HB       PRO  90 -17.127  -6.942  -6.942
  705   2HB   PRO  90          1HB       PRO  90 -16.496  -7.259  -7.259
  706   1HG   PRO  90          2HG       PRO  90 -16.538  -4.698  -4.698
  707   2HG   PRO  90          1HG       PRO  90 -16.910  -4.976  -4.976
  708   1HD   PRO  90          2HD       PRO  90 -14.510  -4.018  -4.018
  709   2HD   PRO  90          1HD       PRO  90 -14.699  -4.956  -4.956
  710    H    GLU  91           H        GLU  91 -14.258  -5.116  -5.116
  711    HA   GLU  91           HA       GLU  91 -15.427  -6.095  -6.095
  712   1HB   GLU  91          2HB       GLU  91 -14.657  -3.553  -3.553
  713   2HB   GLU  91          1HB       GLU  91 -13.856  -3.788  -3.788
  714   1HG   GLU  91          2HG       GLU  91 -16.777  -4.331  -4.331
  715   2HG   GLU  91          1HG       GLU  91 -16.196  -2.673  -2.673
  716    H    TYR  92           H        TYR  92 -12.310  -5.933  -5.933
  717    HA   TYR  92           HA       TYR  92 -11.066  -6.943  -6.943
  718   1HB   TYR  92          2HB       TYR  92  -9.465  -5.790  -5.790
  719   2HB   TYR  92          1HB       TYR  92  -9.061  -5.891  -5.891
  720    HD1  TYR  92           HD1      TYR  92 -11.681  -4.736  -4.736
  721    HD2  TYR  92           HD2      TYR  92  -9.060  -3.477  -3.477
  722    HE1  TYR  92           HE1      TYR  92 -12.436  -2.418  -2.418
  723    HE2  TYR  92           HE2      TYR  92  -9.808  -1.154  -1.154
  724    HH   TYR  92           HH       TYR  92 -12.121  -0.079  -0.079
  725    H    GLY  93           H        GLY  93 -10.807  -7.158  -7.158
  726   1HA   GLY  93          2HA       GLY  93 -10.926  -9.250  -9.250
  727   2HA   GLY  93          1HA       GLY  93 -10.354 -10.048 -10.048
  728    H    GLU  94           H        GLU  94  -9.475  -8.472  -8.472
  729    HA   GLU  94           HA       GLU  94  -7.511  -8.299  -8.299
  730   1HB   GLU  94          2HB       GLU  94  -7.480 -10.776 -10.776
  731   2HB   GLU  94          1HB       GLU  94  -6.114 -10.142 -10.142
  732   1HG   GLU  94          2HG       GLU  94  -4.858  -9.757  -9.757
  733   2HG   GLU  94          1HG       GLU  94  -6.273  -9.789  -9.789
  734    H    VAL  95           H        VAL  95  -7.252  -6.127  -6.127
  735    HA   VAL  95           HA       VAL  95  -4.922  -5.792  -5.792
  736    HB   VAL  95           HB       VAL  95  -5.949  -3.816  -3.816
  737   1HG1  VAL  95          1HG1      VAL  95  -6.032  -6.219  -6.219
  738   2HG1  VAL  95          3HG1      VAL  95  -7.745  -6.164  -6.164
  739   3HG1  VAL  95          2HG1      VAL  95  -7.081  -5.008  -5.008
  740   1HG2  VAL  95          1HG2      VAL  95  -7.766  -3.869  -3.869
  741   2HG2  VAL  95          3HG2      VAL  95  -8.007  -3.026  -3.026
  742   3HG2  VAL  95          2HG2      VAL  95  -8.686  -4.636  -4.636
  743    H    ILE  96           H        ILE  96  -3.569  -4.116  -4.116
  744    HA   ILE  96           HA       ILE  96  -3.940  -3.066  -3.066
  745    HB   ILE  96           HB       ILE  96  -1.704  -3.191  -3.191
  746   1HG1  ILE  96          2HG1      ILE  96  -2.220  -4.620  -4.620
  747   2HG1  ILE  96          1HG1      ILE  96  -0.559  -4.135  -4.135
  748   1HG2  ILE  96          2HG2      ILE  96  -2.069  -0.888  -0.888
  749   2HG2  ILE  96          1HG2      ILE  96  -0.454  -1.506  -1.506
  750   3HG2  ILE  96          3HG2      ILE  96  -1.465  -0.899  -0.899
  751   1HD1  ILE  96          1HD1      ILE  96  -0.796  -2.301  -2.301
  752   2HD1  ILE  96          3HD1      ILE  96  -2.449  -2.817  -2.817
  753   3HD1  ILE  96          2HD1      ILE  96  -1.096  -3.873  -3.873
  754    H    GLN  97           H        GLN  97  -4.762  -1.146  -1.146
  755    HA   GLN  97           HA       GLN  97  -5.336   0.724   0.724
  756   1HB   GLN  97          2HB       GLN  97  -6.877  -0.244  -0.244
  757   2HB   GLN  97          1HB       GLN  97  -6.684   1.495   1.495
  758   1HG   GLN  97          2HG       GLN  97  -7.491   1.755   1.755
  759   2HG   GLN  97          1HG       GLN  97  -7.840   0.026   0.026
  760   1HE2  GLN  97          2HE2      GLN  97 -10.012   2.343   2.343
  761   2HE2  GLN  97          1HE2      GLN  97  -8.324   2.630   2.630
  762    H    LEU  98           H        LEU  98  -3.898   2.283   2.283
  763    HA   LEU  98           HA       LEU  98  -2.549   3.362   3.362
  764   1HB   LEU  98          2HB       LEU  98  -1.947   3.165   3.165
  765   2HB   LEU  98          1HB       LEU  98  -1.574   4.734   4.734
  766    HG   LEU  98           HG       LEU  98   0.015   3.838   3.838
  767   1HD1  LEU  98          2HD1      LEU  98  -1.525   1.369   1.369
  768   2HD1  LEU  98          1HD1      LEU  98   0.222   1.143   1.143
  769   3HD1  LEU  98          3HD1      LEU  98  -0.622   1.970   1.970
  770   1HD2  LEU  98          3HD2      LEU  98   0.158   2.457   2.457
  771   2HD2  LEU  98          2HD2      LEU  98   0.915   3.976   3.976
  772   3HD2  LEU  98          1HD2      LEU  98   1.479   2.455   2.455
  773    H    GLN  99           H        GLN  99  -2.289   5.788   5.788
  774    HA   GLN  99           HA       GLN  99  -4.871   7.024   7.024
  775   1HB   GLN  99          2HB       GLN  99  -3.060   7.233   7.233
  776   2HB   GLN  99          1HB       GLN  99  -3.652   8.782   8.782
  777   1HG   GLN  99          2HG       GLN  99  -5.507   6.497   6.497
  778   2HG   GLN  99          1HG       GLN  99  -4.984   7.607   7.607
  779   1HE2  GLN  99          2HE2      GLN  99  -8.165   8.592   8.592
  780   2HE2  GLN  99          1HE2      GLN  99  -7.580   7.017   7.017
  781    H    GLY 100           H        GLY 100  -4.987   8.871   8.871
  782   1HA   GLY 100          2HA       GLY 100  -4.271  10.687  10.687
  783   2HA   GLY 100          1HA       GLY 100  -2.655  10.448  10.448
  784    H    ASP 101           H        ASP 101  -2.502  11.113  11.113
  785    HA   ASP 101           HA       ASP 101  -2.810   8.909   8.909
  786   1HB   ASP 101          2HB       ASP 101  -1.705  10.418  10.418
  787   2HB   ASP 101          1HB       ASP 101  -3.092  11.163  11.163
  788    H    GLN 102           H        GLN 102  -1.546   7.299   7.299
  789    HA   GLN 102           HA       GLN 102   1.349   7.756   7.756
  790   1HB   GLN 102          2HB       GLN 102  -0.510   6.036   6.036
  791   2HB   GLN 102          1HB       GLN 102   1.028   5.295   5.295
  792   1HG   GLN 102          2HG       GLN 102   0.861   6.460   6.460
  793   2HG   GLN 102          1HG       GLN 102   2.249   6.857   6.857
  794   1HE2  GLN 102          2HE2      GLN 102  -0.718   9.664   9.664
  795   2HE2  GLN 102          1HE2      GLN 102  -1.073   7.993   7.993
  796    H    ARG 103           H        ARG 103  -0.707   6.887   6.887
  797    HA   ARG 103           HA       ARG 103  -0.134   4.359   4.359
  798   1HB   ARG 103          2HB       ARG 103  -0.546   5.248   5.248
  799   2HB   ARG 103          1HB       ARG 103  -1.775   5.701   5.701
  800   1HG   ARG 103          2HG       ARG 103  -0.669   7.903   7.903
  801   2HG   ARG 103          1HG       ARG 103   0.452   7.437   7.437
  802   1HD   ARG 103          2HD       ARG 103  -2.427   7.134   7.134
  803   2HD   ARG 103          1HD       ARG 103  -1.828   8.786   8.786
  804    HE   ARG 103           HE       ARG 103  -1.248   6.904   6.904
  805   1HH1  ARG 103          2HH1      ARG 103  -0.201   9.803   9.803
  806   2HH1  ARG 103          1HH1      ARG 103   0.733  10.373  10.373
  807   1HH2  ARG 103          1HH2      ARG 103  -0.018   7.652   7.652
  808   2HH2  ARG 103          2HH2      ARG 103   0.839   9.152   9.152
  809    H    LYS 104           H        LYS 104   1.911   7.169   7.169
  810    HA   LYS 104           HA       LYS 104   3.901   5.821   5.821
  811   1HB   LYS 104          2HB       LYS 104   3.707   8.639   8.639
  812   2HB   LYS 104          1HB       LYS 104   5.121   8.030   8.030
  813   1HG   LYS 104          2HG       LYS 104   4.096   8.060   8.060
  814   2HG   LYS 104          1HG       LYS 104   2.510   7.681   7.681
  815   1HD   LYS 104          2HD       LYS 104   2.551   9.947   9.947
  816   2HD   LYS 104          1HD       LYS 104   2.329   9.970   9.970
  817   1HE   LYS 104          2HE       LYS 104   4.065  11.349  11.349
  818   2HE   LYS 104          1HE       LYS 104   5.100  10.041  10.041
  819   1HZ   LYS 104          3HZ       LYS 104   4.096  10.923  10.923
  820   2HZ   LYS 104          2HZ       LYS 104   4.112  12.367  12.367
  821   3HZ   LYS 104          1HZ       LYS 104   5.543  11.492  11.492
  822    H    ASN 105           H        ASN 105   3.197   6.553   6.553
  823    HA   ASN 105           HA       ASN 105   5.932   6.197   6.197
  824   1HB   ASN 105          2HB       ASN 105   3.347   6.946   6.946
  825   2HB   ASN 105          1HB       ASN 105   4.555   6.183   6.183
  826   1HD2  ASN 105          2HD2      ASN 105   4.858  10.036  10.036
  827   2HD2  ASN 105          1HD2      ASN 105   3.482   9.054   9.054
  828    H    ILE 106           H        ILE 106   2.915   4.361   4.361
  829    HA   ILE 106           HA       ILE 106   3.816   2.244   2.244
  830    HB   ILE 106           HB       ILE 106   1.432   2.630   2.630
  831   1HG1  ILE 106          2HG1      ILE 106   0.805   0.263   0.263
  832   2HG1  ILE 106          1HG1      ILE 106   2.431  -0.095  -0.095
  833   1HG2  ILE 106          3HG2      ILE 106   1.694   3.200   3.200
  834   2HG2  ILE 106          2HG2      ILE 106   1.988   1.496   1.496
  835   3HG2  ILE 106          1HG2      ILE 106   0.429   2.009   2.009
  836   1HD1  ILE 106          2HD1      ILE 106   3.328   0.567   0.567
  837   2HD1  ILE 106          1HD1      ILE 106   1.683   0.865   0.865
  838   3HD1  ILE 106          3HD1      ILE 106   2.179  -0.766  -0.766
  839    H    CYS 107           H        CYS 107   3.718   2.621   2.621
  840    HA   CYS 107           HA       CYS 107   4.741   0.120   0.120
  841   1HB   CYS 107          2HB       CYS 107   5.494   1.193   1.193
  842   2HB   CYS 107          1HB       CYS 107   3.855   1.674   1.674
  843    HG   CYS 107           HG       CYS 107   4.656   4.019   4.019
  844    H    GLN 108           H        GLN 108   6.277   2.998   2.998
  845    HA   GLN 108           HA       GLN 108   8.978   2.246   2.246
  846   1HB   GLN 108          2HB       GLN 108   7.586   4.304   4.304
  847   2HB   GLN 108          1HB       GLN 108   9.255   3.931   3.931
  848   1HG   GLN 108          2HG       GLN 108   8.720   4.418   4.418
  849   2HG   GLN 108          1HG       GLN 108   8.498   5.799   5.799
  850   1HE2  GLN 108          2HE2      GLN 108  12.214   4.128   4.128
  851   2HE2  GLN 108          1HE2      GLN 108  10.791   3.160   3.160
  852    H    PHE 109           H        PHE 109   6.856   2.085   2.085
  853    HA   PHE 109           HA       PHE 109   8.627   0.988   0.988
  854   1HB   PHE 109          2HB       PHE 109   6.402   1.943   1.943
  855   2HB   PHE 109          1HB       PHE 109   5.643   0.543   0.543
  856    HD1  PHE 109           HD2      PHE 109   8.152   1.359   1.359
  857    HD2  PHE 109           HD1      PHE 109   4.981  -1.169  -1.169
  858    HE1  PHE 109           HE2      PHE 109   8.216   0.190   0.190
  859    HE2  PHE 109           HE1      PHE 109   5.040  -2.344  -2.344
  860    HZ   PHE 109           HZ       PHE 109   6.659  -1.662  -1.662
  861    H    LEU 110           H        LEU 110   6.176  -0.710  -0.710
  862    HA   LEU 110           HA       LEU 110   6.820  -3.302  -3.302
  863   1HB   LEU 110          2HB       LEU 110   5.626  -2.110  -2.110
  864   2HB   LEU 110          1HB       LEU 110   5.965  -3.829  -3.829
  865    HG   LEU 110           HG       LEU 110   4.426  -4.148  -4.148
  866   1HD1  LEU 110          1HD1      LEU 110   4.962  -2.075  -2.075
  867   2HD1  LEU 110          3HD1      LEU 110   4.028  -1.161  -1.161
  868   3HD1  LEU 110          2HD1      LEU 110   3.226  -2.345  -2.345
  869   1HD2  LEU 110          1HD2      LEU 110   3.528  -3.912  -3.912
  870   2HD2  LEU 110          3HD2      LEU 110   2.363  -3.593  -3.593
  871   3HD2  LEU 110          2HD2      LEU 110   3.097  -2.251  -2.251
  872    H    VAL 111           H        VAL 111   8.454  -1.132  -1.132
  873    HA   VAL 111           HA       VAL 111  10.165  -3.248  -3.248
  874    HB   VAL 111           HB       VAL 111  10.154  -0.281  -0.281
  875   1HG1  VAL 111          1HG1      VAL 111  11.699  -2.561  -2.561
  876   2HG1  VAL 111          3HG1      VAL 111  11.507  -0.992  -0.992
  877   3HG1  VAL 111          2HG1      VAL 111  12.337  -1.107  -1.107
  878   1HG2  VAL 111          2HG2      VAL 111   8.182  -1.889  -1.889
  879   2HG2  VAL 111          1HG2      VAL 111   8.795  -0.658  -0.658
  880   3HG2  VAL 111          3HG2      VAL 111   9.309  -2.335  -2.335
  881    H    GLU 112           H        GLU 112  10.184  -0.719  -0.719
  882    HA   GLU 112           HA       GLU 112  13.043  -0.622  -0.622
  883   1HB   GLU 112          2HB       GLU 112  10.772   0.497   0.497
  884   2HB   GLU 112          1HB       GLU 112  12.460   0.693   0.693
  885   1HG   GLU 112          2HG       GLU 112  11.913   1.453   1.453
  886   2HG   GLU 112          1HG       GLU 112  11.010   2.397   2.397
  887    H    ILE 113           H        ILE 113  10.354  -1.976  -1.976
  888    HA   ILE 113           HA       ILE 113  12.170  -3.261  -3.261
  889    HB   ILE 113           HB       ILE 113  10.259  -3.979  -3.979
  890   1HG1  ILE 113          2HG1      ILE 113   8.599  -3.230  -3.230
  891   2HG1  ILE 113          1HG1      ILE 113   8.963  -4.869  -4.869
  892   1HG2  ILE 113          2HG2      ILE 113  10.798  -1.492  -1.492
  893   2HG2  ILE 113          1HG2      ILE 113   9.374  -1.336  -1.336
  894   3HG2  ILE 113          3HG2      ILE 113   9.210  -1.948  -1.948
  895   1HD1  ILE 113          2HD1      ILE 113   7.732  -3.233  -3.233
  896   2HD1  ILE 113          1HD1      ILE 113   6.726  -3.457  -3.457
  897   3HD1  ILE 113          3HD1      ILE 113   7.336  -4.859  -4.859
  898    H    GLY 114           H        GLY 114  11.284  -3.975  -3.975
  899   1HA   GLY 114          2HA       GLY 114  11.555  -5.890  -5.890
  900   2HA   GLY 114          1HA       GLY 114  12.164  -6.684  -6.684
  901    H    LEU 115           H        LEU 115   9.054  -5.112  -5.112
  902    HA   LEU 115           HA       LEU 115   7.720  -7.483  -7.483
  903   1HB   LEU 115          2HB       LEU 115   7.216  -4.833  -4.833
  904   2HB   LEU 115          1HB       LEU 115   6.101  -5.239  -5.239
  905    HG   LEU 115           HG       LEU 115   4.973  -6.834  -6.834
  906   1HD1  LEU 115          2HD1      LEU 115   7.375  -6.557  -6.557
  907   2HD1  LEU 115          1HD1      LEU 115   5.841  -6.739  -6.739
  908   3HD1  LEU 115          3HD1      LEU 115   6.358  -7.963  -7.963
  909   1HD2  LEU 115          1HD2      LEU 115   4.864  -4.164  -4.164
  910   2HD2  LEU 115          3HD2      LEU 115   3.799  -5.326  -5.326
  911   3HD2  LEU 115          2HD2      LEU 115   5.226  -4.719  -4.719
  912    H    ALA 116           H        ALA 116   6.902  -5.413  -5.413
  913    HA   ALA 116           HA       ALA 116   5.863  -7.764  -7.764
  914   1HB   ALA 116          3HB       ALA 116   4.555  -5.615  -5.615
  915   2HB   ALA 116          2HB       ALA 116   5.709  -4.908  -4.908
  916   3HB   ALA 116          1HB       ALA 116   4.711  -6.273  -6.273
  917    H    LYS 117           H        LYS 117   6.138  -7.119  -7.119
  918    HA   LYS 117           HA       LYS 117   9.049  -6.943  -6.943
  919   1HB   LYS 117          2HB       LYS 117   7.081  -8.948  -8.948
  920   2HB   LYS 117          1HB       LYS 117   8.503  -8.546  -8.546
  921   1HG   LYS 117          2HG       LYS 117   9.060  -9.155  -9.155
  922   2HG   LYS 117          1HG       LYS 117   8.390 -10.497 -10.497
  923   1HD   LYS 117          2HD       LYS 117  10.730 -10.672 -10.672
  924   2HD   LYS 117          1HD       LYS 117  10.155  -9.976  -9.976
  925   1HE   LYS 117          2HE       LYS 117  11.154  -7.980  -7.980
  926   2HE   LYS 117          1HE       LYS 117  10.879  -8.056  -8.056
  927   1HZ   LYS 117          2HZ       LYS 117  12.951  -9.591  -9.591
  928   2HZ   LYS 117          1HZ       LYS 117  13.233  -8.198  -8.198
  929   3HZ   LYS 117          3HZ       LYS 117  12.702  -9.617  -9.617
  930    H    ASP 118           H        ASP 118   9.708  -6.141  -6.141
  931    HA   ASP 118           HA       ASP 118   8.312  -3.894  -3.894
  932   1HB   ASP 118          2HB       ASP 118   9.831  -4.084  -4.084
  933   2HB   ASP 118          1HB       ASP 118  10.599  -3.898  -3.898
  934    H    ASP 119           H        ASP 119   7.978  -7.207  -7.207
  935    HA   ASP 119           HA       ASP 119   6.542  -6.689  -6.689
  936   1HB   ASP 119          2HB       ASP 119   7.306  -9.082  -9.082
  937   2HB   ASP 119          1HB       ASP 119   5.853  -9.229  -9.229
  938    H    GLN 120           H        GLN 120   5.844  -6.862  -6.862
  939    HA   GLN 120           HA       GLN 120   2.958  -6.943  -6.943
  940   1HB   GLN 120          2HB       GLN 120   4.326  -7.213  -7.213
  941   2HB   GLN 120          1HB       GLN 120   2.660  -7.605  -7.605
  942   1HG   GLN 120          2HG       GLN 120   3.662  -9.334  -9.334
  943   2HG   GLN 120          1HG       GLN 120   5.159  -9.089  -9.089
  944   1HE2  GLN 120          2HE2      GLN 120   3.235 -10.137 -10.137
  945   2HE2  GLN 120          1HE2      GLN 120   3.829  -8.614  -8.614
  946    H    LEU 121           H        LEU 121   5.100  -4.644  -4.644
  947    HA   LEU 121           HA       LEU 121   4.078  -2.867  -2.867
  948   1HB   LEU 121          2HB       LEU 121   6.160  -2.686  -2.686
  949   2HB   LEU 121          1HB       LEU 121   5.521  -1.201  -1.201
  950    HG   LEU 121           HG       LEU 121   6.785  -3.409  -3.409
  951   1HD1  LEU 121          1HD1      LEU 121   8.063  -1.607  -1.607
  952   2HD1  LEU 121          3HD1      LEU 121   8.217  -0.895  -0.895
  953   3HD1  LEU 121          2HD1      LEU 121   8.800  -2.534  -2.534
  954   1HD2  LEU 121          3HD2      LEU 121   5.058  -1.464  -1.464
  955   2HD2  LEU 121          2HD2      LEU 121   6.263  -2.259  -2.259
  956   3HD2  LEU 121          1HD2      LEU 121   6.628  -0.705  -0.705
  957    H    LYS 122           H        LYS 122   1.907  -3.511  -3.511
  958    HA   LYS 122           HA       LYS 122   1.082  -2.386  -2.386
  959   1HB   LYS 122          2HB       LYS 122  -0.195  -3.360  -3.360
  960   2HB   LYS 122          1HB       LYS 122  -1.145  -2.135  -2.135
  961   1HG   LYS 122          2HG       LYS 122  -0.052  -4.664  -4.664
  962   2HG   LYS 122          1HG       LYS 122  -1.739  -4.357  -4.357
  963   1HD   LYS 122          2HD       LYS 122  -2.030  -3.555  -3.555
  964   2HD   LYS 122          1HD       LYS 122  -0.990  -2.203  -2.203
  965   1HE   LYS 122          2HE       LYS 122   0.909  -3.196  -3.196
  966   2HE   LYS 122          1HE       LYS 122   0.161  -4.790  -4.790
  967   1HZ   LYS 122          2HZ       LYS 122  -1.482  -3.491  -3.491
  968   2HZ   LYS 122          1HZ       LYS 122  -0.102  -2.548  -2.548
  969   3HZ   LYS 122          3HZ       LYS 122  -0.063  -4.211  -4.211
  970    H    VAL 123           H        VAL 123   0.145  -0.865  -0.865
  971    HA   VAL 123           HA       VAL 123  -0.418   1.254   1.254
  972    HB   VAL 123           HB       VAL 123   1.763   1.625   1.625
  973   1HG1  VAL 123          2HG1      VAL 123   2.679   0.171   0.171
  974   2HG1  VAL 123          1HG1      VAL 123   2.548   1.488   1.488
  975   3HG1  VAL 123          3HG1      VAL 123   3.635   1.638   1.638
  976   1HG2  VAL 123          3HG2      VAL 123   0.513   3.713   3.713
  977   2HG2  VAL 123          2HG2      VAL 123   2.188   3.818   3.818
  978   3HG2  VAL 123          1HG2      VAL 123   1.829   3.627   3.627
  979    H    HIS 124           H        HIS 124  -2.162   2.052   2.052
  980    HA   HIS 124           HA       HIS 124  -1.938   3.239   3.239
  981   1HB   HIS 124          2HB       HIS 124  -4.491   2.246   2.246
  982   2HB   HIS 124          1HB       HIS 124  -4.216   2.679   2.679
  983    HD1  HIS 124           HD1      HIS 124  -3.733   0.782   0.782
  984    HD2  HIS 124           HD2      HIS 124  -2.917  -0.154  -0.154
  985    HE1  HIS 124           HE1      HIS 124  -3.065  -1.643  -1.643
  986    HE2  HIS 124           HE2      HIS 124  -2.694  -2.209  -2.209
  987    H    GLY 125           H        GLY 125  -4.155   3.456   3.456
  988   1HA   GLY 125          2HA       GLY 125  -4.109   5.530   5.530
  989   2HA   GLY 125          1HA       GLY 125  -3.910   6.395   6.395
  990    H    PHE 126           HN       PHE 126  -5.709   7.537   7.537
  991    HA   PHE 126           HA       PHE 126  -8.186   6.188   6.188
  992   1HB   PHE 126          2HB       PHE 126  -9.520   7.151   7.151
  993   2HB   PHE 126          1HB       PHE 126  -8.126   6.413   6.413
  994    HD1  PHE 126           HD1      PHE 126  -6.030   8.213   8.213
  995    HD2  PHE 126           HD2      PHE 126 -10.187   9.105   9.105
  996    HE1  PHE 126           HE1      PHE 126  -5.524  10.350  10.350
  997    HE2  PHE 126           HE2      PHE 126  -9.690  11.244  11.244
  998    HZ   PHE 126           HZ       PHE 126  -7.354  11.870  11.870