NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
3144 1d8j 4721 cing 1-original 1 EMBOSS distance NOE simple


;Constraint file of TFIIE-beta central core domain 


; 1 ALA is corresponds to  66 ALA in TFIIE-beta
;81 ARG is corresponds to 146 ARG in TFIIE-beta 


;1          11         21         31         41   
;ALSGSSGYKF GVLAKIVNYM KTRHQRGDTH PLTLDEILDE TQHLDIGLKQ
;51         61         71         81 
;KQWLMTEALV NNPKIEVIDG KYAFKPKYNV R


;DISTANCE CONSTRAINT
;--------------------------------------------------------
1   7 GLY  HN   1   6 SER  HA    1.0  1.0  1.90  4.00 
1   7 GLY  HN   1   6 SER  HB*   1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1   8 TYR  HN   1   8 TYR  HB*   1.0  1.0  1.90  4.00 
1   8 TYR  HN   1   8 TYR  HD*   1.0  1.0  1.90  7.00    
1   8 TYR  HN   1   7 GLY  HA*   1.0  1.0  1.90  4.00   
1   8 TYR  HN   1   9 LYS+ HN    1.0  1.0  1.90  5.00        

1   8 TYR  HD*  1   9 LYS+ HG*   1.0  1.0  1.90  8.00  

1   8 TYR  HD*  1   9 LYS+ HD*   1.0  1.0  1.90  8.00 
1   8 TYR  HD*  1   9 LYS+ HB*   1.0  1.0  1.90  8.00 
1   8 TYR  HD*  1  50 GLN  HG*   1.0  1.0  1.90  8.00
1   8 TYR  HD*  1   9 LYS+ HA    1.0  1.0  1.90  7.00 
1   8 TYR  HD*  1   7 GLY  HA*   1.0  1.0  1.90  8.00 


1   8 TYR  HE*  1   9 LYS+ HD*   1.0  1.0  1.90  8.00 
1   8 TYR  HE*  1  50 GLN  HG*   1.0  1.0  1.90  7.00 
1   8 TYR  HE*  1  49 LYS+ HE*   1.0  1.0  1.90  8.00 

1   8 TYR  HD*  1  10 PHE HD*   1.0  1.0  1.90  9.00 
1   8 TYR  HD*  1  10 PHE HE*   1.0  1.0  1.90  9.00  
1   8 TYR  HD*  1  10 PHE HZ    1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1   9 LYS+ HN   1   9 LYS+ HB*   1.0  1.0  1.90  4.00 
1   9 LYS+ HN   1   9 LYS+ HG*   1.0  1.0  1.90  5.00 
1   9 LYS+ HN   1   9 LYS+ HD*   1.0  1.0  1.90  6.00 
1   9 LYS+ HN   1   8 TYR  HB*   1.0  1.0  1.90  5.00 
1   9 LYS+ HN   1   8 TYR  HA    1.0  1.0  1.90  3.00 
1   9 LYS+ HN   1   8 TYR  HD*   1.0  1.0  1.90  7.00 
1   9 LYS+ HN   1   8 TYR  HE*   1.0  1.0  1.90  7.00 
1   9 LYS+ HN   1  10 PHE  HN    1.0  1.0  1.90  4.00 

1   9 LYS+ HA   1  12 VAL  HG*   1.0  1.0  1.90  8.90 
1   9 LYS+ HA   1  12 VAL  HB    1.0  1.0  1.90  3.00 
  
1   9 LYS+ HB*  1  12 VAL  HB    1.0  1.0  1.90  6.00 
1   9 LYS+ HB*  1  50 GLN  HG*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  10 PHE  HN   1  10 PHE  HB1   1.0  1.0  1.90  3.00 
1  10 PHE  HN   1  10 PHE  HB2   1.0  1.0  1.90  4.00 
1  10 PHE  HN   1   9 LYS+ HG*   1.0  1.0  1.90  5.00 
1  10 PHE  HN   1   9 LYS+ HB*   1.0  1.0  1.90  5.00 
1  10 PHE  HN   1   9 LYS+ HA    1.0  1.0  1.90  4.00 
1  10 PHE  HN   1   7 GLY  HA*   1.0  1.0  1.90  6.00 
1  10 PHE  HN   1  11 GLY  HN    1.0  1.0  1.90  4.00 

1  10 PHE  HA   1   9 LYS+ HG*   1.0  1.0  1.90  6.00 
1  10 PHE  HA   1  13 LEU  HD2*  1.0  1.0  1.90  5.50 
1  10 PHE  HA   1   9 LYS+ HB*   1.0  1.0  1.90  6.00   
1  10 PHE  HA   1  13 LEU  HB1   1.0  1.0  1.90  4.00 
1  10 PHE  HA   1  13 LEU  HB2   1.0  1.0  1.90  3.00  
1  10 PHE  HA   1   9 LYS+ HA    1.0  1.0  1.90  5.00

1  10 PHE  HB1  1   7 GLY  HA*   1.0  1.0  1.90  6.00 
1  10 PHE  HB2  1   7 GLY  HA*   1.0  1.0  1.90  6.00 

1  10 PHE  HD*  1   9 LYS+ HG*   1.0  1.0  1.90  8.00 
1  10 PHE  HD*  1  13 LEU  HD1*  1.0  1.0  1.90  8.50 
1  10 PHE  HD*  1   9 LYS+ HB*   1.0  1.0  1.90  8.00 
1  10 PHE  HD*  1  13 LEU  HB1   1.0  1.0  1.90  7.00 
1  10 PHE  HD*  1  13 LEU  HB2   1.0  1.0  1.90  7.00 
1  10 PHE  HD*  1   7 GLY  HA*   1.0  1.0  1.90  7.00 
1  10 PHE  HD*  1  13 LEU  HD2*  1.0  1.0  1.90  8.50 
1  10 PHE  HD*  1   9 LYS+ HE*   1.0  1.0  1.90  8.00
1  10 PHE  HD*  1   9 LYS+ HA    1.0  1.0  1.90  7.00 

1  10 PHE  HE*  1   9 LYS+ HG*   1.0  1.0  1.90  8.00 
1  10 PHE  HE*  1  13 LEU  HD2*  1.0  1.0  1.90  8.50 
1  10 PHE  HE*  1   9 LYS+ HE*   1.0  1.0  1.90  8.00 
1  10 PHE  HE*  1   7 GLY  HA*   1.0  1.0  1.90  8.00 
1  10 PHE  HE*  1   9 LYS+ HA    1.0  1.0  1.90  7.00 

1  10 PHE  HZ   1   9 LYS+ HE*   1.0  1.0  1.90  6.00 

1  10 PHE  HZ*  1   8 TYR HE*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  11 GLY  HN   1  12 VAL  HG*   1.0  1.0  1.90  8.90 
1  11 GLY  HN   1  14 ALA  HB*   1.0  1.0  1.90  6.50 
1  11 GLY  HN   1  10 PHE  HB1   1.0  1.0  1.90  4.00 
1  11 GLY  HN   1  10 PHE  HB2   1.0  1.0  1.90  5.00 
1  11 GLY  HN   1   9 LYS+ HA    1.0  1.0  1.90  5.00 
1  11 GLY  HN   1  10 PHE  HA    1.0  1.0  1.90  4.00 
1  11 GLY  HN   1  12 VAL  HN    1.0  1.0  1.90  4.00 

1  11 GLY  HA*  1  14 ALA  HB*   1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  12 VAL  HN   1  12 VAL  HB    1.0  1.0  1.90  3.00 
1  12 VAL  HN   1  12 VAL  HG*   1.0  1.0  1.90  6.90 
1  12 VAL  HN   1  14 ALA  HB*   1.0  1.0  1.90  6.50 
1  12 VAL  HN   1   9 LYS+ HA    1.0  1.0  1.90  5.00 
1  12 VAL  HN   1  11 GLY  HA*   1.0  1.0  1.90  5.00 
1  12 VAL  HN   1  13 LEU  HN    1.0  1.0  1.90  3.00 

1  12 VAL  HA   1  15 LYS+ HG*   1.0  1.0  1.90  6.00 
1  12 VAL  HA   1  15 LYS+ HB*   1.0  1.0  1.90  5.00 

1  12 VAL  HG*  1  16 ILE  HG1*  1.0  1.0  1.90  9.90 
1  12 VAL  HG*  1  43 HIS  HB*   1.0  1.0  1.90  9.90 

1  12 VAL  HG*  1   9 LYS+ HB*   1.0  1.0  1.90  8.90 
1  12 VAL  HG*  1  50 GLN  HA    1.0  1.0  1.90  8.90 
;---------------------------------------------------------
1  13 LEU  HN   1  13 LEU  HB1   1.0  1.0  1.90  3.00 
1  13 LEU  HN   1  13 LEU  HB2   1.0  1.0  1.90  3.00
1  13 LEU  HN   1  13 LEU  HG    1.0  1.0  1.90  5.00 
1  13 LEU  HN   1  13 LEU  HD1*  1.0  1.0  1.90  5.50 
1  13 LEU  HN   1  13 LEU  HD2*  1.0  1.0  1.90  6.50 
1  13 LEU  HN   1  12 VAL  HB    1.0  1.0  1.90  3.00 
1  13 LEU  HN   1  12 VAL  HA    1.0  1.0  1.90  5.00 
1  13 LEU  HN   1  10 PHE  HA    1.0  1.0  1.90  5.00 
1  13 LEU  HN   1  53 TRP  HZ3   1.0  1.0  1.90  5.00 
1  13 LEU  HN   1  14 ALA  HN    1.0  1.0  1.90  5.00 

1  13 LEU  HA   1  12 VAL  HG*   1.0  1.0  1.90  8.90 

1  13 LEU  HG*  1  16 ILE  HG2*  1.0  1.0  1.90  6.50 
1  13 LEU  HG   1  10 PHE  HA    1.0  1.0  1.90  5.00 

1  13 LEU  HD1* 1  59 LEU  HD1*  1.0  1.0  1.90  8.00 
1  13 LEU  HD1* 1  58 ALA  HB*   1.0  1.0  1.90  6.00 
1  13 LEU  HD1* 1  59 LEU  HD2*  1.0  1.0  1.90  7.00 
1  13 LEU  HD1* 1  59 LEU  HG    1.0  1.0  1.90  6.50 
1  13 LEU  HD1* 1  54 LEU  HG    1.0  1.0  1.90  6.50 
1  13 LEU  HD1* 1  62 ASN  HB*   1.0  1.0  1.90  7.50 
1  13 LEU  HD1* 1  54 LEU  HA    1.0  1.0  1.90  6.50  
1  13 LEU  HD1* 1  14 ALA  HA    1.0  1.0  1.90  6.50 
1  13 LEU  HD1* 1  10 PHE  HA    1.0  1.0  1.90  6.50 

1  13 LEU  HD2* 1  58 ALA  HB*   1.0  1.0  1.90  6.00 
1  13 LEU  HD2* 1  59 LEU  HD2*  1.0  1.0  1.90  8.00 
1  13 LEU  HD2* 1  62 ASN  HB*   1.0  1.0  1.90  7.50 
1  13 LEU  HD2* 1  54 LEU  HA    1.0  1.0  1.90  6.50 
1  13 LEU  HD2* 1  14 ALA  HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  14 ALA  HN   1  14 ALA  HB*   1.0  1.0  1.90  4.50 
1  14 ALA  HN   1  13 LEU  HD1*  1.0  1.0  1.90  5.50 
1  14 ALA  HN   1  13 LEU  HD2*  1.0  1.0  1.90  6.50 
1  14 ALA  HN   1  13 LEU  HG    1.0  1.0  1.90  5.00 
1  14 ALA  HN   1  13 LEU  HB2   1.0  1.0  1.90  3.00
1  14 ALA  HN   1  13 LEU  HA    1.0  1.0  1.90  5.00 
1  14 ALA  HN   1  15 LYS+ HN    1.0  1.0  1.90  4.00 

1  14 ALA  HA   1  17 VAL  HG1*  1.0  1.0  1.90  4.50 
1  14 ALA  HA   1  17 VAL  HG2*  1.0  1.0  1.90  4.50 
1  14 ALA  HA   1  17 VAL  HB    1.0  1.0  1.90  3.00 
;--------------------------------------------------------
1  15 LYS+ HN   1  15 LYS+ HB*   1.0  1.0  1.90  4.00 
1  15 LYS+ HN   1  15 LYS+ HD*   1.0  1.0  1.90  5.00 
1  15 LYS+ HN   1  16 ILE  HD*   1.0  1.0  1.90  6.50 
1  15 LYS+ HN   1  41 THR  HG2*  1.0  1.0  1.90  6.50 
1  15 LYS+ HN   1  14 ALA  HB*   1.0  1.0  1.90  4.50 
1  15 LYS+ HN   1  16 ILE  HG1*  1.0  1.0  1.90  6.00 
1  15 LYS+ HN   1  12 VAL  HA    1.0  1.0  1.90  4.00 
1  15 LYS+ HN   1  14 ALA  HA    1.0  1.0  1.90  5.00 
1  15 LYS+ HN   1  16 ILE  HN    1.0  1.0  1.90  3.00 
1  15 LYS+ HN   1  17 VAL  HN    1.0  1.0  1.90  5.00 

1  15 LYS+ HA   1  18 ASN  HB*   1.0  1.0  1.90  4.00 

1  15 LYS+ HB*  1  16 ILE  HD*   1.0  1.0  1.90  7.50
;--------------------------------------------------------
1  16 ILE  HN   1  16 ILE  HB    1.0  1.0  1.90  3.00 
1  16 ILE  HN   1  16 ILE  HG1*  1.0  1.0  1.90  4.00
1  16 ILE  HN   1  16 ILE  HG2*  1.0  1.0  1.90  5.50 
1  16 ILE  HN   1  16 ILE  HD*   1.0  1.0  1.90  5.50 
1  16 ILE  HN   1  17 VAL  HG2*  1.0  1.0  1.90  6.50 
1  16 ILE  HN   1  15 LYS+ HG*   1.0  1.0  1.90  6.00 
1  16 ILE  HN   1  12 VAL  HA    1.0  1.0  1.90  5.00 
1  16 ILE  HN   1  13 LEU  HA    1.0  1.0  1.90  5.00 
1  16 ILE  HN   1  15 LYS+ HA    1.0  1.0  1.90  5.00 
1  16 ILE  HN   1  17 VAL  HN    1.0  1.0  1.90  3.00 

1  16 ILE  HA   1  19 TYR  HB*   1.0  1.0  1.90  4.00 
1  16 ILE  HA   1  41 THR  HB    1.0  1.0  1.90  5.00 

1  16 ILE  HB   1  17 VAL  HG2*  1.0  1.0  1.90  6.50 
1  16 ILE  HB   1  13 LEU  HA    1.0  1.0  1.90  3.00 

1  16 ILE  HG1* 1  13 LEU  HA    1.0  1.0  1.90  6.00 

1  16 ILE  HG2* 1  59 LEU  HD1*  1.0  1.0  1.90  7.00 
1  16 ILE  HG2* 1  59 LEU  HD2*  1.0  1.0  1.90  7.00 
1  16 ILE  HG2* 1  20 MET  HB1   1.0  1.0  1.90  6.50 
1  16 ILE  HG2* 1  20 MET  HG*   1.0  1.0  1.90  6.50
1  16 ILE  HG2* 1  17 VAL  HA    1.0  1.0  1.90  5.50 
1  16 ILE  HG2* 1  13 LEU  HA    1.0  1.0  1.90  6.50 

1  16 ILE  HD*  1  59 LEU  HD1*  1.0  1.0  1.90  7.00 
1  16 ILE  HD*  1  13 LEU  HA    1.0  1.0  1.90  4.50 
;-------------------------------------------------------
1  17 VAL  HN   1  17 VAL  HB    1.0  1.0  1.90  3.00 
1  17 VAL  HN   1  17 VAL  HG1*  1.0  1.0  1.90  5.50 
1  17 VAL  HN   1  17 VAL  HG2*  1.0  1.0  1.90  4.50 
1  17 VAL  HN   1  13 LEU  HD1*  1.0  1.0  1.90  5.50 
1  17 VAL  HN   1  16 ILE  HG2*  1.0  1.0  1.90  5.50 
1  17 VAL  HN   1  14 ALA  HB*   1.0  1.0  1.90  6.50 
1  17 VAL  HN   1  16 ILE  HG1*  1.0  1.0  1.90  6.00 
1  17 VAL  HN   1  16 ILE  HA    1.0  1.0  1.90  5.00 
1  17 VAL  HN   1  13 LEU  HA    1.0  1.0  1.90  5.00 
1  17 VAL  HN   1  14 ALA  HA    1.0  1.0  1.90  5.00 
1  17 VAL  HN   1  18 ASN  HN    1.0  1.0  1.90  4.00 

1  17 VAL  HA   1  20 MET  HB1   1.0  1.0  1.90  5.00 
1  17 VAL  HA   1  20 MET  HB2   1.0  1.0  1.90  5.00 
1  17 VAL  HA   1  20 MET  HG*   1.0  1.0  1.90  6.00 

1  17 VAL  HB   1  14 ALA  HB*   1.0  1.0  1.90  6.50 

1  17 VAL  HG2* 1  59 LEU  HD1*  1.0  1.0  1.90  8.00 
1  17 VAL  HG2* 1  59 LEU  HD2*  1.0  1.0  1.90  7.00 
1  17 VAL  HG2* 1  13 LEU  HD1*  1.0  1.0  1.90  6.00 
1  17 VAL  HG2* 1  16 ILE  HG2*  1.0  1.0  1.90  8.00 
1  17 VAL  HG2* 1  65 ILE  HD*   1.0  1.0  1.90  8.00 
1  17 VAL  HG2* 1  65 ILE  HG1*  1.0  1.0  1.90  7.50  
1  17 VAL  HG2* 1  13 LEU  HB1   1.0  1.0  1.90  6.50 
1  17 VAL  HG2* 1  13 LEU  HG    1.0  1.0  1.90  6.50 
1  17 VAL  HG2* 1  62 ASN  HB*   1.0  1.0  1.90  7.50 
1  17 VAL  HG2* 1  59 LEU  HA    1.0  1.0  1.90  6.50 
1  17 VAL  HG2* 1  64 LYS+ HA    1.0  1.0  1.90  6.50 
1  17 VAL  HG2* 1  18 ASN  HA    1.0  1.0  1.90  6.50 

1  17 VAL  HG1* 1  13 LEU  HD1*  1.0  1.0  1.90  8.00 
1  17 VAL  HG1* 1  65 ILE  HD*   1.0  1.0  1.90  8.00 
1  17 VAL  HG1* 1  64 LYS+ HE*   1.0  1.0  1.90  6.50 
1  17 VAL  HG1* 1  64 LYS+ HA    1.0  1.0  1.90  6.50 
1  17 VAL  HG1* 1  18 ASN  HA    1.0  1.0  1.90  5.50 
;-------------------------------------------------------
1  18 ASN  HN   1  18 ASN  HB*   1.0  1.0  1.90  4.00
1  18 ASN  HN   1  41 THR  HG2*  1.0  1.0  1.90  6.50    
1  18 ASN  HN   1  17 VAL  HG2*  1.0  1.0  1.90  6.50 
1  18 ASN  HN   1  17 VAL  HG1*  1.0  1.0  1.90  5.50 
1  18 ASN  HN   1  14 ALA  HB*   1.0  1.0  1.90  6.50
1  18 ASN  HN   1  17 VAL  HB    1.0  1.0  1.90  3.00 
1  18 ASN  HN   1  17 VAL  HA    1.0  1.0  1.90  5.00 
1  18 ASN  HN   1  15 LYS+ HA    1.0  1.0  1.90  4.00 
1  18 ASN  HN   1  19 TYR  HN    1.0  1.0  1.90  4.00    

1  18 ASN  HA   1  21 LYS+ HD*   1.0  1.0  1.90  6.00 
1  18 ASN  HA   1  21 LYS+ HB1   1.0  1.0  1.90  4.00 
1  18 ASN  HA   1  21 LYS+ HG*   1.0  1.0  1.90  6.00 
1  18 ASN  HA   1  21 LYS+ HB2   1.0  1.0  1.90  3.00 
1  18 ASN  HA   1  21 LYS+ HE*   1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  19 TYR  HN   1  19 TYR  HB*   1.0  1.0  1.90  4.00    
1  19 TYR  HN   1  41 THR  HG2*  1.0  1.0  1.90  5.50  
1  19 TYR  HN   1  18 ASN  HB*   1.0  1.0  1.90  5.00 
1  19 TYR  HN   1  16 ILE  HA    1.0  1.0  1.90  5.00 
1  19 TYR  HN   1  18 ASN  HA    1.0  1.0  1.90  4.00 
1  19 TYR  HN   1  17 VAL  HN    1.0  1.0  1.90  5.00   

1  19 TYR  HA   1  22 THR  HG2*  1.0  1.0  1.90  6.50 
1  19 TYR  HA   1  22 THR  HB    1.0  1.0  1.90  3.00 

1  19 TYR  HB*  1  41 THR  HG2*  1.0  1.0  1.90  5.50 

1  19 TYR  HD*  1  41 THR  HG2*  1.0  1.0  1.90  7.50 
1  19 TYR  HD*  1  16 ILE  HG2*  1.0  1.0  1.90  8.50 
1  19 TYR  HD*  1  37 ILE  HG2*  1.0  1.0  1.90  7.50 
1  19 TYR  HD*  1  37 ILE  HG1*  1.0  1.0  1.90  7.00 
1  19 TYR  HD*  1  20 MET  HG*   1.0  1.0  1.90  8.00 
1  19 TYR  HD*  1  37 ILE  HA    1.0  1.0  1.90  6.00 
1  19 TYR  HD*  1  16 ILE  HA    1.0  1.0  1.90  7.00  
1  19 TYR  HD*  1  20 MET  HA    1.0  1.0  1.90  7.00 
1  19 TYR  HD*  1  40 GLU- HB1   1.0  1.0  1.90  7.00  
1  19 TYR  HD*  1  40 GLU- HB2   1.0  1.0  1.90  7.00  
1  19 TYR  HD*  1  23 ARG+ HD*   1.0  1.0  1.90  8.00  
1  19 TYR  HD*  1  32 LEU  HD1*  1.0  1.0  1.90  8.50

1  19 TYR  HE*  1  41 THR  HG2*  1.0  1.0  1.90  8.50 
1  19 TYR  HE*  1  23 ARG+ HD*   1.0  1.0  1.90  8.00 
1  19 TYR  HE*  1  37 ILE  HA    1.0  1.0  1.90  5.00  
1  19 TYR  HE*  1  16 ILE  HA    1.0  1.0  1.90  7.00 
1  19 TYR  HE*  1  40 GLU- HA    1.0  1.0  1.90  7.00 
1  19 TYR  HE*  1  40 GLU- HB1   1.0  1.0  1.90  6.00 
1  19 TYR  HE*  1  40 GLU- HB2   1.0  1.0  1.90  6.00 
1  19 TYR  HE*  1  20 MET  HA    1.0  1.0  1.90  7.00 
1  19 TYR  HE*  1  32 LEU  HD1*  1.0  1.0  1.90  6.50 
1  19 TYR  HE*  1  40 GLU- HG*   1.0  1.0  1.90  8.00 
1  19 TYR  HE*  1  37 ILE  HG1*  1.0  1.0  1.90  8.00 
1  19 TYR  HE*  1  37 ILE  HG2*  1.0  1.0  1.90  8.00 
1  19 TYR  HE*  1  23 ARG+ HB*   1.0  1.0  1.90  8.00 
;--------------------------------------------------------
1  20 MET  HN   1  20 MET  HB1   1.0  1.0  1.90  3.00 
1  20 MET  HN   1  20 MET  HB2   1.0  1.0  1.90  4.00 
1  20 MET  HN   1  20 MET  HG*   1.0  1.0  1.90  4.00 
1  20 MET  HN   1  16 ILE  HG2*  1.0  1.0  1.90  6.50  
1  20 MET  HN   1  21 LYS+ HB2   1.0  1.0  1.90  5.00 
1  20 MET  HN   1  17 VAL  HA    1.0  1.0  1.90  5.00 
1  20 MET  HN   1  16 ILE  HA    1.0  1.0  1.90  5.00 
1  20 MET  HN   1  19 TYR  HA    1.0  1.0  1.90  5.00 
1  20 MET  HN   1  18 ASN  HA    1.0  1.0  1.90  5.00 
1  20 MET  HN   1  19 TYR  HD*   1.0  1.0  1.90  7.00 
1  20 MET  HN   1  21 LYS+ HN    1.0  1.0  1.90  5.00 

1  20 MET  HA   1  23 ARG+ HG*   1.0  1.0  1.90  5.00 
1  20 MET  HA   1  23 ARG+ HB*   1.0  1.0  1.90  6.00 
1  20 MET  HA   1  74 PHE  HB2   1.0  1.0  1.90  5.00 
1  20 MET  HA   1  23 ARG+ HD*   1.0  1.0  1.90  5.00 

1  20 MET  HB2  1  74 PHE  HB2   1.0  1.0  1.90  5.00 
1  20 MET  HB2  1  74 PHE  HB1   1.0  1.0  1.90  4.00 

1  20 MET  HB1  1  74 PHE  HB1   1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  21 LYS+ HN   1  21 LYS+ HB1   1.0  1.0  1.90  3.00
1  21 LYS+ HN   1  21 LYS+ HB2   1.0  1.0  1.90  3.00 
1  21 LYS+ HN   1  21 LYS+ HG*   1.0  1.0  1.90  6.00 
1  21 LYS+ HN   1  17 VAL  HG1*  1.0  1.0  1.90  6.50 
1  21 LYS+ HN   1  20 MET  HB2   1.0  1.0  1.90  5.00 
1  21 LYS+ HN   1  17 VAL  HA    1.0  1.0  1.90  5.00 
1  21 LYS+ HN   1  20 MET  HA    1.0  1.0  1.90  5.00 
1  21 LYS+ HN   1  18 ASN  HA    1.0  1.0  1.90  4.00 
1  21 LYS+ HN   1  22 THR  HN    1.0  1.0  1.90  4.00 

1  21 LYS+ HA   1  24 HIS  HB*   1.0  1.0  1.90  4.00 
;--------------------------------------------------------
1  22 THR  HN   1  22 THR  HB    1.0  1.0  1.90  3.00 
1  22 THR  HN   1  22 THR  HG2*  1.0  1.0  1.90  5.50
1  22 THR  HN   1  21 LYS+ HD*   1.0  1.0  1.90  5.00 
1  22 THR  HN   1  21 LYS+ HB2   1.0  1.0  1.90  3.00 
1  22 THR  HN   1  21 LYS+ HA    1.0  1.0  1.90  5.00 
1  22 THR  HN   1  18 ASN  HA    1.0  1.0  1.90  5.00 

1  22 THR  HA   1  21 LYS+ HD*   1.0  1.0  1.90  6.00 
1  22 THR  HA   1  25 GLN  HB1   1.0  1.0  1.90  4.00 
1  22 THR  HA   1  25 GLN  HB2   1.0  1.0  1.90  4.00 
1  22 THR  HA   1  25 GLN  HG1   1.0  1.0  1.90  5.00 
1  22 THR  HA   1  25 GLN  HG2   1.0  1.0  1.90  5.00 

1  22 THR  HG2* 1  26 ARG+ HG*   1.0  1.0  1.90  7.50 
1  22 THR  HG2* 1  25 GLN  HB2   1.0  1.0  1.90  6.50 
1  22 THR  HG2* 1  21 LYS+ HE*   1.0  1.0  1.90  7.50
1  22 THR  HG2* 1  26 ARG+ HD*   1.0  1.0  1.90  5.50 
1  22 THR  HG2* 1  23 ARG+ HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  23 ARG+ HN   1  23 ARG+ HB*   1.0  1.0  1.90  4.00 
1  23 ARG+ HN   1  23 ARG+ HG*   1.0  1.0  1.90  6.00 
1  23 ARG+ HN   1  22 THR  HG2*  1.0  1.0  1.90  6.50 
1  23 ARG+ HN   1  22 THR  HA    1.0  1.0  1.90  5.00 
1  23 ARG+ HN   1  19 TYR  HA    1.0  1.0  1.90  5.00 
1  23 ARG+ HN   1  24 HIS  HN    1.0  1.0  1.90  4.00 

1  23 ARG+ HA   1  28 ASP- HB*   1.0  1.0  1.90  6.00 
1  23 ARG+ HA   1  26 ARG+ HB*   1.0  1.0  1.90  5.00 
1  23 ARG+ HA   1  26 ARG+ HD*   1.0  1.0  1.90  4.00 
1  23 ARG+ HA   1  26 ARG+ HG*   1.0  1.0  1.90  5.00 
  
1  23 ARG+ HB*  1  28 ASP- HB*   1.0  1.0  1.90  6.00 

1  23 ARG+ HG*  1  28 ASP- HB*   1.0  1.0  1.90  7.00 

1  23 ARG+ HD*  1  32 LEU  HD1*   1.0  1.0  1.90  6.50 

1  23 ARG+ HE   1  32 LEU  HD*   1.0  1.0  1.90  7.90 
1  23 ARG+ HE   1  28 ASP- HB*   1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  24 HIS  HN   1  24 HIS  HB*  1.0  1.0  1.90  4.00 
1  24 HIS  HN   1  23 ARG+ HG*  1.0  1.0  1.90  5.00 
1  24 HIS  HN   1  23 ARG+ HB*  1.0  1.0  1.90  5.00 
1  24 HIS  HN   1  21 LYS+ HA   1.0  1.0  1.90  5.00
1  24 HIS  HN   1  74 PHE  HB2  1.0  1.0  1.90  5.00 
1  24 HIS  HN   1  23 ARG+ HA   1.0  1.0  1.90  5.00 
1  24 HIS  HN   1  25 GLN  HN   1.0  1.0  1.90  3.00 

1  24 HIS  HA   1  29 THR  HG2*  1.0  1.0  1.90  4.50 
1  24 HIS  HA   1  29 THR  HA    1.0  1.0  1.90  3.00 
1  24 HIS  HA   1  29 THR  HB    1.0  1.0  1.90  5.00 

1  24 HIS  HB*  1  29 THR  HG2*  1.0  1.0  1.90  7.50 
1  24 HIS  HB*  1  74 PHE  HB2   1.0  1.0  1.90  4.00 
1  24 HIS  HB*  1  74 PHE  HB1   1.0  1.0  1.90  5.00 

1  24 HIS  HD2  1  76 PRO  HB*   1.0  1.0  1.90  6.00 
1  24 HIS  HD2  1  76 PRO  HG*   1.0  1.0  1.90  6.00 
1  24 HIS  HD2  1  25 GLN  HA    1.0  1.0  1.90  5.00 
1  24 HIS  HD2  1  25 GLN  HG*   1.0  1.0  1.90  6.00 
1  24 HIS  HD2  1  29 THR  HG2*  1.0  1.0  1.90  6.50 
1  24 HIS  HD2  1  29 THR  HA    1.0  1.0  1.90  5.00 
1  24 HIS  HD2  1  29 THR  HB    1.0  1.0  1.90  5.00
1  24 HIS  HD2  1  25 GLN  HB*   1.0  1.0  1.90  6.00 
1  24 HIS  HD2  1  21 LYS+ HA    1.0  1.0  1.90  5.00 

1  24 HIS  HE1  1  76 PRO  HB*   1.0  1.0  1.90  6.00 
1  24 HIS  HE1  1  76 PRO  HA    1.0  1.0  1.90  5.00  
1  24 HIS  HE1  1  76 PRO  HG*   1.0  1.0  1.90  6.00
1  24 HIS  HE1  1  76 PRO  HD*   1.0  1.0  1.90  6.00  
1  24 HIS  HE1  1  29 THR  HG2*  1.0  1.0  1.90  6.50 
1  24 HIS  HE1  1  73 ALA  HB*   1.0  1.0  1.90  6.50 
1  24 HIS  HE1  1  29 THR  HA    1.0  1.0  1.90  5.00 
1  24 HIS  HE1  1  29 THR  HB    1.0  1.0  1.90  4.00 

1  24 HIS  HE1  1  74 PHE  HD*   1.0  1.0  1.90  7.00 
1  24 HIS  HE1  1  74 PHE  HE*   1.0  1.0  1.90  7.00
1  24 HIS  HD2  1  74 PHE  HD*   1.0  1.0  1.90  6.00 
1  24 HIS  HD2  1  74 PHE  HE*   1.0  1.0  1.90  6.00 
1  24 HIS  HD2  1  74 PHE  HZ    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  25 GLN  HN   1  25 GLN  HB*   1.0  1.0  1.90  4.00 
1  25 GLN  HN   1  25 GLN  HG*   1.0  1.0  1.90  5.00 
1  25 GLN  HN   1  24 HIS  HB*   1.0  1.0  1.90  4.00 
1  25 GLN  HN   1  22 THR  HA    1.0  1.0  1.90  5.00 
1  25 GLN  HN   1  24 HIS  HA    1.0  1.0  1.90  5.00 

1  25 GLN  HG*  1  21 LYS+ HD*   1.0  1.0  1.90  7.00 

1  25 GLN  HE*  1  21 LYS+ HD*   1.0  1.0  1.90  7.00 
1  25 GLN  HE*  1  21 LYS+ HE*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  26 ARG+ HN   1  26 ARG+ HB*   1.0  1.0  1.90  5.00 
1  26 ARG+ HN   1  26 ARG+ HG*   1.0  1.0  1.90  5.00 
1  26 ARG+ HN   1  25 GLN  HB*   1.0  1.0  1.90  6.00 
1  26 ARG+ HN   1  24 HIS  HA    1.0  1.0  1.90  5.00 
1  26 ARG+ HN   1  23 ARG+ HA    1.0  1.0  1.90  5.00 
1  26 ARG+ HN   1  25 GLN  HA    1.0  1.0  1.90  5.00 
1  26 ARG+ HN   1  27 GLY  HN    1.0  1.0  1.90  3.00 
1  26 ARG+ HN   1  25 GLN  HN    1.0  1.0  1.90  4.00 
1  26 ARG+ HN   1  28 ASP- HN    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  27 GLY  HN   1  29 THR  HG2*  1.0  1.0  1.90  6.50 
1  27 GLY  HN   1  26 ARG+ HG*   1.0  1.0  1.90  6.00 
1  27 GLY  HN   1  26 ARG+ HB*   1.0  1.0  1.90  6.00 
1  27 GLY  HN   1  24 HIS  HA    1.0  1.0  1.90  5.00 
1  27 GLY  HN   1  25 GLN  HA    1.0  1.0  1.90  5.00
1  27 GLY  HN   1  28 ASP- HN    1.0  1.0  1.90  3.00

1  27 GLY  HA*  1  29 THR  HG2*  1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  28 ASP- HN   1  28 ASP- HB*   1.0  1.0  1.90  4.00
1  28 ASP- HN   1  29 THR  HG2*  1.0  1.0  1.90  6.50 
1  28 ASP- HN   1  26 ARG+ HG*   1.0  1.0  1.90  6.00 
1  28 ASP- HN   1  26 ARG+ HB*   1.0  1.0  1.90  6.00 
1  28 ASP- HN   1  27 GLY  HA*   1.0  1.0  1.90  6.00 
1  28 ASP- HN   1  24 HIS  HA    1.0  1.0  1.90  5.00 

1  28 ASP- HA   1  29 THR  HG2*  1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  29 THR  HN   1  29 THR  HB    1.0  1.0  1.90  5.00 
1  29 THR  HN   1  29 THR  HG2*  1.0  1.0  1.90  4.50 
1  29 THR  HN   1  28 ASP- HB*   1.0  1.0  1.90  6.00
1  29 THR  HN   1  28 ASP- HA    1.0  1.0  1.90  3.00 
1  29 THR  HN   1  30 HIS  HN    1.0  1.0  1.90  4.00 
1  29 THR  HN   1  28 ASP- HN    1.0  1.0  1.90  5.00
;--------------------------------------------------------
1  30 HIS  HN   1  30 HIS  HB*   1.0  1.0  1.90  5.00 
1  30 HIS  HN   1  29 THR  HG2*  1.0  1.0  1.90  6.50
1  30 HIS  HN   1  31 PRO  HD*   1.0  1.0  1.90  6.00 
1  30 HIS  HN   1  29 THR  HA    1.0  1.0  1.90  5.00 
1  30 HIS  HN   1  28 ASP- HA    1.0  1.0  1.90  4.00 

1  30 HIS  HA   1  31 PRO  HG*   1.0  1.0  1.90  6.00 
1  30 HIS  HA   1  31 PRO  HD*   1.0  1.0  1.90  4.00 

1  30 HIS  HB*  1  31 PRO  HD*   1.0  1.0  1.90  6.00 

1  30 HIS  HD2  1  32 LEU  HD2*  1.0  1.0  1.90  6.50 
1  30 HIS  HD2  1  31 PRO  HD*   1.0  1.0  1.90  6.00 
1  30 HIS  HD2  1  32 LEU  HA    1.0  1.0  1.90  5.00 

1  30 HIS  HE1  1  32 LEU  HD2*  1.0  1.0  1.90  6.50 
1  30 HIS  HE1  1  28 ASP- HB*   1.0  1.0  1.90  6.00 
1  30 HIS  HE1  1  28 ASP- HA    1.0  1.0  1.90  5.00 
1  30 HIS  HE1  1  32 LEU  HA    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  31 PRO  HA   1  73 ALA  HB*   1.0  1.0  1.90  4.50 

1  31 PRO  HB*  1  68 ILE  HG2*  1.0  1.0  1.90  6.50 
1  31 PRO  HB*  1  71 LYS+ HB2   1.0  1.0  1.90  5.00 
1  31 PRO  HB*  1  71 LYS+ HB1   1.0  1.0  1.90  5.00 
1  31 PRO  HB*  1  73 ALA  HB*   1.0  1.0  1.90  5.50 

1  31 PRO  HG*  1  68 ILE  HG2*  1.0  1.0  1.90  6.50 
1  31 PRO  HG*  1  68 ILE  HD*   1.0  1.0  1.90  6.50 
1  31 PRO  HG*  1  73 ALA  HB*   1.0  1.0  1.90  6.50 

1  31 PRO  HD*  1  68 ILE  HG2*  1.0  1.0  1.90  7.50 
1  31 PRO  HD*  1  68 ILE  HD*   1.0  1.0  1.90  7.50 
1  31 PRO  HD*  1  73 ALA  HB*   1.0  1.0  1.90  7.50 
;--------------------------------------------------------
1  32 LEU  HN   1  32 LEU  HB1   1.0  1.0  1.90  3.00 
1  32 LEU  HN   1  32 LEU  HB2   1.0  1.0  1.90  4.00 
1  32 LEU  HN   1  37 ILE  HD*   1.0  1.0  1.90  6.50 
1  32 LEU  HN   1  73 ALA  HB*   1.0  1.0  1.90  6.50 
1  32 LEU  HN   1  71 LYS+ HB2   1.0  1.0  1.90  5.00 
1  32 LEU  HN   1  71 LYS+ HB1   1.0  1.0  1.90  5.00 
1  32 LEU  HN   1  20 MET  HE*   1.0  1.0  1.90  6.50 
1  32 LEU  HN   1  72 TYR  HN    1.0  1.0  1.90  4.00

1  32 LEU  HA   1  71 LYS+ HB2   1.0  1.0  1.90  5.00 
1  32 LEU  HA   1  71 LYS+ HB1   1.0  1.0  1.90  5.00
1  32 LEU  HA   1  36 GLU- HB2   1.0  1.0  1.90  5.00 
1  32 LEU  HA   1  36 GLU- HB1   1.0  1.0  1.90  5.00 
1  32 LEU  HA   1  33 THR  HA    1.0  1.0  1.90  6.50 

1  32 LEU  HB1  1  36 GLU- HB2   1.0  1.0  1.90  5.00
1  32 LEU  HB1  1  36 GLU- HB1   1.0  1.0  1.90  5.00 
1  32 LEU  HB2  1  36 GLU- HB2   1.0  1.0  1.90  3.00  
1  32 LEU  HB2  1  36 GLU- HB1   1.0  1.0  1.90  4.00 
1  32 LEU  HB1  1  37 ILE HG1*   1.0  1.0  1.90  6.00 
1  32 LEU  HB2  1  37 ILE HG1*   1.0  1.0  1.90  6.00

1  32 LEU  HD2* 1  36 GLU- HB2   1.0  1.0  1.90  4.50 
1  32 LEU  HD2* 1  36 GLU- HB1   1.0  1.0  1.90  4.50

1  32 LEU  HD1* 1  37 ILE  HG1*  1.0  1.0  1.90  7.50 
1  32 LEU  HD1* 1  36 GLU- HB2   1.0  1.0  1.90  4.50 
1  32 LEU  HD1* 1  36 GLU- HB1   1.0  1.0  1.90  4.50 
1  32 LEU  HD1* 1  37 ILE  HA    1.0  1.0  1.90  5.50 
1  32 LEU  HD1*  1  31 PRO  HA   1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  33 THR  HN   1  33 THR  HG2*  1.0  1.0  1.90  4.50 
1  33 THR  HN   1  32 LEU  HD*   1.0  1.0  1.90  7.90 
1  33 THR  HN   1  71 LYS+ HB1   1.0  1.0  1.90  5.00
1  33 THR  HN   1  32 LEU  HB1   1.0  1.0  1.90  5.00 
1  33 THR  HN   1  32 LEU  HB2   1.0  1.0  1.90  4.00 
1  33 THR  HN   1  36 GLU- HB2   1.0  1.0  1.90  5.00 
1  33 THR  HN   1  36 GLU- HB1   1.0  1.0  1.90  5.00 
1  33 THR  HN   1  36 GLU- HG*   1.0  1.0  1.90  6.00 
1  33 THR  HN   1  32 LEU  HA    1.0  1.0  1.90  3.00 
1  33 THR  HN   1  36 GLU- HN    1.0  1.0  1.90  5.00 

1  33 THR  HA   1  71 LYS+ HD*   1.0  1.0  1.90  4.00 
1  33 THR  HA   1  71 LYS+ HB2   1.0  1.0  1.90  5.00 
1  33 THR  HA   1  71 LYS+ HA    1.0  1.0  1.90  3.00 

1  33 THR  HB   1  35 ASP- HB1   1.0  1.0  1.90  5.00 

1  33 THR  HG2* 1  32 LEU  HD2*  1.0  1.0  1.90  8.00
1  33 THR  HG2* 1  71 LYS+ HD*   1.0  1.0  1.90  5.50 
1  33 THR  HG2* 1  71 LYS+ HE*   1.0  1.0  1.90  5.50 
1  33 THR  HG2* 1  71 LYS+ HA    1.0  1.0  1.90  5.50 
;--------------------------------------------------------
1  34 LEU  HN   1  34 LEU  HB1   1.0  1.0  1.90  3.00 
1  34 LEU  HN   1  34 LEU  HB2   1.0  1.0  1.90  3.00 
1  34 LEU  HN   1  34 LEU  HG    1.0  1.0  1.90  5.00 
1  34 LEU  HN   1  34 LEU  HD*   1.0  1.0  1.90  8.90 
1  34 LEU  HN   1  33 THR  HG2*  1.0  1.0  1.90  6.50  
1  34 LEU  HN   1  33 THR  HA    1.0  1.0  1.90  4.00 
1  34 LEU  HN   1  33 THR  HB    1.0  1.0  1.90  4.00 
1  34 LEU  HN   1  72 TYR  HE*   1.0  1.0  1.90  5.00 
1  34 LEU  HN   1  72 TYR  HD*   1.0  1.0  1.90  6.00 
1  34 LEU  HN   1  35 ASP- HN    1.0  1.0  1.90  4.00 

1  34 LEU  HA   1  37 ILE  HG2*  1.0  1.0  1.90  5.50 
1  34 LEU  HA   1  37 ILE  HD*   1.0  1.0  1.90  4.50
1  34 LEU  HA   1  37 ILE  HB    1.0  1.0  1.90  3.00 

1  34 LEU  HG   1  59 LEU  HD1*  1.0  1.0  1.90  5.50 
1  34 LEU  HG   1  51 LYS+ HG*   1.0  1.0  1.90  6.00 
1  34 LEU  HG   1  55 MET  HB*   1.0  1.0  1.90  5.00 
1  34 LEU  HG   1  54 LEU  HB1   1.0  1.0  1.90  5.00 
1  34 LEU  HG   1  55 MET  HG*   1.0  1.0  1.90  5.00 
1  34 LEU  HG   1  51 LYS+ HA    1.0  1.0  1.90  5.00 
1  34 LEU  HG   1  55 MET  HA    1.0  1.0  1.90  5.00 

1  34 LEU  HD*  1  59 LEU  HD1*  1.0  1.0  1.90  8.40 
1  34 LEU  HD*  1  59 LEU  HD2*  1.0  1.0  1.90 10.40 
1  34 LEU  HD*  1  37 ILE  HG2*  1.0  1.0  1.90 10.40 
1  34 LEU  HD*  1  38 LEU  HB2   1.0  1.0  1.90  8.90
1  34 LEU  HD*  1  38 LEU  HG    1.0  1.0  1.90  7.90 
1  34 LEU  HD*  1  54 LEU  HB1   1.0  1.0  1.90  8.90
1  34 LEU  HD*  1  72 TYR  HB*   1.0  1.0  1.90  9.90
1  34 LEU  HD*  1  51 LYS+ HA    1.0  1.0  1.90  7.40 
1  34 LEU  HD*  1  55 MET  HA    1.0  1.0  1.90  8.90 
;--------------------------------------------------------
1  35 ASP- HN   1  35 ASP- HB1   1.0  1.0  1.90  3.00 
1  35 ASP- HN   1  35 ASP- HB2   1.0  1.0  1.90  4.00 
1  35 ASP- HN   1  34 LEU  HD*   1.0  1.0  1.90  8.90 
1  35 ASP- HN   1  34 LEU  HG    1.0  1.0  1.90  5.00 
1  35 ASP- HN   1  33 THR  HG2*  1.0  1.0  1.90  6.50 
1  35 ASP- HN   1  34 LEU  HB1   1.0  1.0  1.90  4.00 
1  35 ASP- HN   1  34 LEU  HB2   1.0  1.0  1.90  3.00 
1  35 ASP- HN   1  34 LEU  HA    1.0  1.0  1.90  5.00 
1  35 ASP- HN   1  33 THR  HB    1.0  1.0  1.90  4.00 
1  35 ASP- HN   1  36 GLU- HN    1.0  1.0  1.90  4.00  

1  35 ASP- HA   1  38 LEU  HD2*  1.0  1.0  1.90  6.50 
1  35 ASP- HA   1  38 LEU  HD1*  1.0  1.0  1.90  4.50 
1  35 ASP- HA   1  38 LEU  HB2   1.0  1.0  1.90  5.00 
1  35 ASP- HA   1  38 LEU  HB1   1.0  1.0  1.90  4.00 
1  35 ASP- HA   1  38 LEU  HG    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  36 GLU- HN   1  36 GLU- HB1   1.0  1.0  1.90  3.00 
1  36 GLU- HN   1  36 GLU- HB2   1.0  1.0  1.90  4.00 
1  36 GLU- HN   1  36 GLU- HG*   1.0  1.0  1.90  5.00
1  36 GLU- HN   1  32 LEU  HD*   1.0  1.0  1.90  7.90 
1  36 GLU- HN   1  33 THR  HG2*  1.0  1.0  1.90  6.50 
1  36 GLU- HN   1  32 LEU  HB2   1.0  1.0  1.90  5.00 
1  36 GLU- HN   1  35 ASP- HB2   1.0  1.0  1.90  5.00
1  36 GLU- HN   1  35 ASP- HA    1.0  1.0  1.90  5.00 
1  36 GLU- HN   1  37 ILE  HN    1.0  1.0  1.90  4.00

1  36 GLU- HA   1  35 ASP- HB2   1.0  1.0  1.90  5.00 
1  36 GLU- HA   1  32 LEU  HD1*  1.0  1.0  1.90  5.50 

1  36 GLU- HG*  1  32 LEU  HD2*  1.0  1.0  1.90  7.50 
;--------------------------------------------------------
1  37 ILE  HN   1  37 ILE  HB    1.0  1.0  1.90  3.00 
1  37 ILE  HN   1  37 ILE  HG1*  1.0  1.0  1.90  5.00 
1  37 ILE  HN   1  37 ILE  HG2*  1.0  1.0  1.90  6.50
1  37 ILE  HN   1  34 LEU  HD*   1.0  1.0  1.90  8.90
1  37 ILE  HN   1  32 LEU  HB2   1.0  1.0  1.90  5.00 
1  37 ILE  HN   1  36 GLU- HB1   1.0  1.0  1.90  3.00 
1  37 ILE  HN   1  38 LEU  HN    1.0  1.0  1.90  3.00 

1  37 ILE  HA   1  34 LEU  HD*   1.0  1.0  1.90  8.90 
1  37 ILE  HA   1  40 GLU- HB1   1.0  1.0  1.90  4.00 
1  37 ILE  HA   1  40 GLU- HB2   1.0  1.0  1.90  5.00 
1  37 ILE  HA   1  40 GLU- HG*   1.0  1.0  1.90  6.00 

1  37 ILE  HB   1  34 LEU  HD*   1.0  1.0  1.90  6.90 

1  37 ILE  HG1* 1  20 MET  HG*   1.0  1.0  1.90  7.00 

1  37 ILE  HG2* 1  59 LEU  HD1*  1.0  1.0  1.90  8.00 
1  37 ILE  HG2* 1  16 ILE  HD*   1.0  1.0  1.90  8.00 
1  37 ILE  HG2* 1  16 ILE  HG1*  1.0  1.0  1.90  6.50 
1  37 ILE  HG2* 1  20 MET  HG*   1.0  1.0  1.90  7.50 
1  37 ILE  HG2* 1  16 ILE  HA    1.0  1.0  1.90  5.50 
1  37 ILE  HG2* 1  38 LEU  HA    1.0  1.0  1.90  5.50 

1  37 ILE  HD*  1  59 LEU  HD1*  1.0  1.0  1.90  8.00 
1  37 ILE  HD*  1  59 LEU  HD2*  1.0  1.0  1.90  8.00 
1  37 ILE  HD*  1  32 LEU  HB1   1.0  1.0  1.90  5.50 
1  37 ILE  HD*  1  32 LEU  HB2   1.0  1.0  1.90  6.50 
1  37 ILE  HD*  1  20 MET  HG*   1.0  1.0  1.90  7.50 
1  37 ILE  HD*  1  72 TYR  HB*   1.0  1.0  1.90  5.50 
1  37 ILE  HD*  1  32 LEU  HA    1.0  1.0  1.90  6.50 
1  37 ILE  HD*  1  72 TYR  HA    1.0  1.0  1.90  6.50
;--------------------------------------------------------
1  38 LEU  HN   1  38 LEU  HB2   1.0  1.0  1.90  4.00 
1  38 LEU  HN   1  38 LEU  HB1   1.0  1.0  1.90  3.00
1  38 LEU  HN   1  38 LEU  HG    1.0  1.0  1.90  3.00 
1  38 LEU  HN   1  38 LEU  HD2*  1.0  1.0  1.90  5.50 
1  38 LEU  HN   1  37 ILE  HG2*  1.0  1.0  1.90  5.50 
1  38 LEU  HN   1  37 ILE  HB    1.0  1.0  1.90  3.00 
1  38 LEU  HN   1  37 ILE  HA    1.0  1.0  1.90  5.00
1  38 LEU  HN   1  36 GLU- HA    1.0  1.0  1.90  5.00  
1  38 LEU  HN   1  35 ASP- HA    1.0  1.0  1.90  5.00 
1  38 LEU  HN   1  39 ASP- HN    1.0  1.0  1.90  4.00 

1  38 LEU  HA   1  43 HIS  HB*   1.0  1.0  1.90  6.00 

1  38 LEU  HB2  1  44 LEU  HA    1.0  1.0  1.90  4.00 
1  38 LEU  HB1  1  44 LEU  HA    1.0  1.0  1.90  4.00 

1  38 LEU  HG   1  44 LEU  HG    1.0  1.0  1.90  5.00 
1  38 LEU  HG   1  34 LEU  HA    1.0  1.0  1.90  5.00 

1  38 LEU  HD2* 1  54 LEU  HD1*  1.0  1.0  1.90  7.00 
1  38 LEU  HD2* 1  54 LEU  HG    1.0  1.0  1.90  6.50 
1  38 LEU  HD2* 1  54 LEU  HB1   1.0  1.0  1.90  6.50 
1  38 LEU  HD2* 1  43 HIS  HB*   1.0  1.0  1.90  5.50 
1  38 LEU  HD2* 1  34 LEU  HA    1.0  1.0  1.90  6.50 

1  38 LEU  HD1* 1  51 LYS+ HE*   1.0  1.0  1.90  6.50 
1  38 LEU  HD1* 1  34 LEU  HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  39 ASP- HN   1  39 ASP- HB*   1.0  1.0  1.90  4.00 
1  39 ASP- HN   1  44 LEU  HD*   1.0  1.0  1.90  8.90 
1  39 ASP- HN   1  38 LEU  HB2   1.0  1.0  1.90  4.00 
1  39 ASP- HN   1  38 LEU  HB1   1.0  1.0  1.90  3.00 
1  39 ASP- HN   1  38 LEU  HA    1.0  1.0  1.90  5.00 
1  39 ASP- HN   1  36 GLU- HA    1.0  1.0  1.90  5.00 

1  39 ASP- HA   1  44 LEU  HD*   1.0  1.0  1.90  6.90 
1  39 ASP- HA   1  44 LEU  HG    1.0  1.0  1.90  3.00 

1  39 ASP- HB*  1  36 GLU- HA    1.0  1.0  1.90  4.00 
;--------------------------------------------------------
1  40 GLU- HN   1  40 GLU- HB1   1.0  1.0  1.90  3.00 
1  40 GLU- HN   1  40 GLU- HB2   1.0  1.0  1.90  4.00 
1  40 GLU- HN   1  40 GLU- HG*   1.0  1.0  1.90  5.00
1  40 GLU- HN   1  39 ASP- HB*   1.0  1.0  1.90  5.00
1  40 GLU- HN   1  39 ASP- HA    1.0  1.0  1.90  5.00 
1  40 GLU- HN   1  41 THR  HN    1.0  1.0  1.90  4.00 

1  40 GLU- HG*  1  32 LEU  HD2*  1.0  1.0  1.90  9.90 
1  40 GLU- HG*  1  39 ASP- HB*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  41 THR  HN   1  41 THR  HG2*  1.0  1.0  1.90  5.50
1  41 THR  HN   1  40 GLU- HB1   1.0  1.0  1.90  5.00 
1  41 THR  HN   1  40 GLU- HB2   1.0  1.0  1.90  5.00
1  41 THR  HN   1  38 LEU  HA    1.0  1.0  1.90  5.00 
1  41 THR  HN   1  42 GLN  HN    1.0  1.0  1.90  4.00 
 
1  41 THR  HA   1  40 GLU- HB2   1.0  1.0  1.90  5.00 
1  41 THR  HA   1  15 LYS+ HE*   1.0  1.0  1.90  6.00 

1  41 THR  HB   1  16 ILE  HD*   1.0  1.0  1.90  6.50 
1  41 THR  HB   1  15 LYS+ HG*   1.0  1.0  1.90  6.00 
1  41 THR  HB   1  16 ILE  HG1*  1.0  1.0  1.90  6.00 
1  41 THR  HB   1  15 LYS+ HB*   1.0  1.0  1.90  6.00 
1  41 THR  HB   1  15 LYS+ HE*   1.0  1.0  1.90  6.00 

1  41 THR  HG2* 1  16 ILE  HD*   1.0  1.0  1.90  8.00 
1  41 THR  HG2* 1  15 LYS+ HG*   1.0  1.0  1.90  7.50 
1  41 THR  HG2* 1  15 LYS+ HD*   1.0  1.0  1.90  7.50 
1  41 THR  HG2* 1  15 LYS+ HB*   1.0  1.0  1.90  7.50 
1  41 THR  HG2* 1  16 ILE  HA    1.0  1.0  1.90  4.50 
;--------------------------------------------------------
1  42 GLN  HN   1  42 GLN  HB*    1.0  1.0  1.90  5.00 
1  42 GLN  HN   1  42 GLN  HG*    1.0  1.0  1.90  6.00 

1  42 GLN  HG*  1  12 VAL  HG*   1.0  1.0  1.90  9.90

1  42 GLN  HE*  1  12 VAL  HG*   1.0  1.0  1.90  9.90 
;--------------------------------------------------------
1  43 HIS  HN   1  42 GLN  HA    1.0  1.0  1.90  5.00 

1  43 HIS  HA   1  38 LEU  HD2*  1.0  1.0  1.90  6.50 
1  43 HIS  HA   1  46 ILE  HG2*  1.0  1.0  1.90  5.50 

1  43 HIS  HB*  1  46 ILE  HD*   1.0  1.0  1.90  7.50 
1  43 HIS  HB*  1  46 ILE  HG2*  1.0  1.0  1.90  6.50 

1  43 HIS  HD2  1  12 VAL  HG*   1.0  1.0  1.90  8.90 
1  43 HIS  HD2  1  41 THR  HB    1.0  1.0  1.90  5.00 
1  43 HIS  HD2  1  16 ILE  HG1*  1.0  1.0  1.90  6.00
1  43 HIS  HD2  1  41 THR  HA    1.0  1.0  1.90  5.00

1  43 HIS  HE1  1  12 VAL  HG*   1.0  1.0  1.90  8.90 
1  43 HIS  HE1  1  41 THR  HG2*  1.0  1.0  1.90  6.50 
1  43 HIS  HE1  1  15 LYS+ HG*   1.0  1.0  1.90  6.00 
1  43 HIS  HE1  1  16 ILE  HG1*  1.0  1.0  1.90  6.00  
1  43 HIS  HE1  1  15 LYS+ HB*   1.0  1.0  1.90  6.00  
1  43 HIS  HE1  1  12 VAL  HA    1.0  1.0  1.90  5.00   
1  43 HIS  HE1  1  41 THR  HA    1.0  1.0  1.90  5.00
1  43 HIS  HE1  1  41 THR  HB    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  44 LEU  HN   1  44 LEU  HB*   1.0  1.0  1.90  4.00 
1  44 LEU  HN   1  44 LEU  HD*   1.0  1.0  1.90  7.90 
1  44 LEU  HN   1  45 ASP- HB*   1.0  1.0  1.90  6.00      
1  44 LEU  HN   1  43 HIS  HA    1.0  1.0  1.90  4.00
1  44 LEU  HN   1  45 ASP- HN    1.0  1.0  1.90  4.00 

1  44 LEU  HA   1  38 LEU  HD2*  1.0  1.0  1.90  6.50 

1  44 LEU  HD*  1  38 LEU  HB2   1.0  1.0  1.90  7.90
1  44 LEU  HD*  1  38 LEU  HB1   1.0  1.0  1.90  6.90 
1  44 LEU  HD*  1  39 ASP- HB*   1.0  1.0  1.90  8.90 
;--------------------------------------------------------
1  45 ASP- HN   1  45 ASP- HB*   1.0  1.0  1.90  4.00 
1  45 ASP- HN   1  44 LEU  HD*   1.0  1.0  1.90  8.90
1  45 ASP- HN   1  46 ILE  HG2*  1.0  1.0  1.90  6.50 
1  45 ASP- HN   1  44 LEU  HB*   1.0  1.0  1.90  5.00 
1  45 ASP- HN   1  46 ILE  HB    1.0  1.0  1.90  5.00 
1  45 ASP- HN   1  44 LEU  HA    1.0  1.0  1.90  4.00 
1  45 ASP- HN   1  43 HIS  HA    1.0  1.0  1.90  5.00 
1  45 ASP- HN   1  46 ILE  HN    1.0  1.0  1.90  4.00 

1  45 ASP- HA   1  44 LEU  HB*   1.0  1.0  1.90  6.00 
1  45 ASP- HA   1  44 LEU  HA    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  46 ILE  HN   1  46 ILE  HG1*  1.0  1.0  1.90  6.00  
1  46 ILE  HN   1  46 ILE  HG2*  1.0  1.0  1.90  5.50 
1  46 ILE  HN   1  46 ILE  HD*   1.0  1.0  1.90  6.50 
1  46 ILE  HN   1  45 ASP- HB*   1.0  1.0  1.90  6.00 
1  46 ILE  HN   1  45 ASP- HA    1.0  1.0  1.90  5.00

1  46 ILE  HA   1  38 LEU  HD2* 1.0  1.0  1.90  6.50 
1  46 ILE  HA   1  38 LEU  HD1*  1.0  1.0  1.90  6.50 
1  46 ILE  HA   1  50 GLN  HB1   1.0  1.0  1.90  5.00 

1  46 ILE  HB   1  38 LEU  HD2*  1.0  1.0  1.90  6.50 
1  46 ILE  HB   1  50 GLN  HB1   1.0  1.0  1.90  5.00 
1  46 ILE  HB   1  43 HIS  HB*   1.0  1.0  1.90  6.00 

1  46 ILE  HG1* 1  38 LEU  HD2*  1.0  1.0  1.90  7.50 
1  46 ILE  HG1* 1  50 GLN  HB1   1.0  1.0  1.90  6.00 

1  46 ILE  HG2* 1  12 VAL  HG*   1.0  1.0  1.90  9.40 
1  46 ILE  HG2* 1  38 LEU  HD2*  1.0  1.0  1.90  7.00 
1  46 ILE  HG2* 1  38 LEU  HD1*  1.0  1.0  1.90  8.00 
1  46 ILE  HG2* 1  51 LYS+ HB*   1.0  1.0  1.90  6.50 
1  46 ILE  HG2* 1  50 GLN  HB1   1.0  1.0  1.90  6.50 
1  46 ILE  HG2* 1  50 GLN  HG*   1.0  1.0  1.90  7.50 
1  46 ILE  HG2* 1  51 LYS+ HA    1.0  1.0  1.90  5.50 

1  46 ILE  HD*  1  38 LEU  HD2*  1.0  1.0  1.90  7.00 
1  46 ILE  HD*  1  38 LEU  HD1*  1.0  1.0  1.90  8.00 
1  46 ILE  HD*  1  50 GLN  HB1   1.0  1.0  1.90  5.50 
1  46 ILE  HD*  1  50 GLN  HG*   1.0  1.0  1.90  6.50 
1  46 ILE  HD*  1  51 LYS+ HA    1.0  1.0  1.90  4.50 
1  46 ILE  HD*  1  51 LYS+ HG*   1.0  1.0  1.90  7.50 
1  46 ILE  HD*  1  51 LYS+ HE*   1.0  1.0  1.90  7.50
;--------------------------------------------------------
1  47 GLY  HN   1  46 ILE  HD*   1.0  1.0  1.90  6.50 
1  47 GLY  HN   1  46 ILE  HG2*  1.0  1.0  1.90  5.50  
1  47 GLY  HN   1  46 ILE  HG1*  1.0  1.0  1.90  5.00 
1  47 GLY  HN   1  46 ILE  HB    1.0  1.0  1.90  4.00 
1  47 GLY  HN   1  50 GLN  HB1   1.0  1.0  1.90  5.00 
1  47 GLY  HN   1  50 GLN  HG*   1.0  1.0  1.90  6.00 
1  47 GLY  HN   1  46 ILE  HN    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  48 LEU  HN   1  48 LEU  HB*   1.0  1.0  1.90  4.00 
1  48 LEU  HN   1  48 LEU  HD*   1.0  1.0  1.90  8.90
1  48 LEU  HN   1  47 GLY  HA*   1.0  1.0  1.90  4.00 
1  48 LEU  HN   1  49 LYS+ HN    1.0  1.0  1.90  4.00 

1  48 LEU  HA   1  46 ILE  HD*   1.0  1.0  1.90  6.50 
1  48 LEU  HA   1  51 LYS+ HG*   1.0  1.0  1.90  6.00 
1  48 LEU  HA   1  51 LYS+ HB*   1.0  1.0  1.90  4.00 

1  48 LEU  HG   1  52 GLN  HG*   1.0  1.0  1.90  6.00 

1  48 LEU  HD*  1  52 GLN  HG*   1.0  1.0  1.90  8.90
;--------------------------------------------------------
1  49 LYS+ HN   1  49 LYS+ HB*   1.0  1.0  1.90  4.00 
1  49 LYS+ HN   1  49 LYS+ HG*   1.0  1.0  1.90  5.00 
1  49 LYS+ HN   1  49 LYS+ HD*   1.0  1.0  1.90  5.00 
1  49 LYS+ HN   1  48 LEU  HA    1.0  1.0  1.90  5.00 
1  49 LYS+ HN   1  50 GLN  HN    1.0  1.0  1.90  3.00 
;--------------------------------------------------------
1  50 GLN  HN   1  50 GLN  HB1   1.0  1.0  1.90  3.00 
1  50 GLN  HN   1  50 GLN  HB2   1.0  1.0  1.90  4.00 
1  50 GLN  HN   1  50 GLN  HG*   1.0  1.0  1.90  4.00 
1  50 GLN  HN   1  46 ILE  HD*   1.0  1.0  1.90  6.50 
1  50 GLN  HN   1  49 LYS+ HG*   1.0  1.0  1.90  6.00 
1  50 GLN  HN   1  49 LYS+ HB*   1.0  1.0  1.90  5.00 
1  50 GLN  HN   1  49 LYS+ HA    1.0  1.0  1.90  5.00 
1  50 GLN  HN   1  51 LYS+ HN    1.0  1.0  1.90  3.00 

1  50 GLN  HA   1  54 LEU  HD1*  1.0  1.0  1.90  6.50 
1  50 GLN  HA   1  53 TRP  HB*   1.0  1.0  1.90  4.00 
 
1  50 GLN  HG*  1  54 LEU  HD1*  1.0  1.0  1.90  7.50
1  50 GLN  HG*  1  46 ILE  HG1*  1.0  1.0  1.90  7.00 
1  50 GLN  HG*  1  53 TRP  HB*   1.0  1.0  1.90  7.00 
1  50 GLN  HG*  1   9 LYS+ HA    1.0  1.0  1.90  6.00 

1  50 GLN  HB2  1  46 ILE  HG2*  1.0  1.0  1.90  6.50 
1  50 GLN  HB2  1  46 ILE  HG1*  1.0  1.0  1.90  6.00

1  50 GLN  HE*  1  12 VAL  HG*   1.0  1.0  1.90  9.90
;--------------------------------------------------------
1  51 LYS+ HN   1  51 LYS+ HB*   1.0  1.0  1.90  4.00 
1  51 LYS+ HN   1  51 LYS+ HG*   1.0  1.0  1.90  5.00
1  51 LYS+ HN   1  38 LEU  HD2*  1.0  1.0  1.90  6.50 
1  51 LYS+ HN   1  46 ILE  HD*   1.0  1.0  1.90  5.50 
1  51 LYS+ HN   1  46 ILE  HG2*  1.0  1.0  1.90  6.50 
1  51 LYS+ HN   1  46 ILE  HG1*  1.0  1.0  1.90  6.00 
1  51 LYS+ HN   1  50 GLN  HB1   1.0  1.0  1.90  4.00 
1  51 LYS+ HN   1  50 GLN  HG*   1.0  1.0  1.90  6.00 
1  51 LYS+ HN   1  48 LEU  HA    1.0  1.0  1.90  4.00 
1  51 LYS+ HN   1  50 GLN  HA    1.0  1.0  1.90  5.00
1  51 LYS+ HN   1  52 GLN  HN    1.0  1.0  1.90  3.00 

1  51 LYS+ HA   1  54 LEU  HD2*  1.0  1.0  1.90  6.50 
1  51 LYS+ HA   1  54 LEU  HD1*  1.0  1.0  1.90  4.50 
1  51 LYS+ HA   1  54 LEU  HB2   1.0  1.0  1.90  5.00 
1  51 LYS+ HA   1  54 LEU  HB1   1.0  1.0  1.90  3.00 
1  51 LYS+ HA   1  54 LEU  HG    1.0  1.0  1.90  5.00 

1  51 LYS+ HD*  1  46 ILE  HD*   1.0  1.0  1.90  7.50 

1  51 LYS+ HE*  1  46 ILE  HB    1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  52 GLN  HN   1  52 GLN  HB1   1.0  1.0  1.90  3.00 
1  52 GLN  HN   1  52 GLN  HB2   1.0  1.0  1.90  3.00 
1  52 GLN  HN   1  52 GLN  HG*   1.0  1.0  1.90  5.00 
1  52 GLN  HN   1  46 ILE  HD*   1.0  1.0  1.90  6.50 
1  52 GLN  HN   1  46 ILE  HG2*  1.0  1.0  1.90  6.50 
1  52 GLN  HN   1  51 LYS+ HG*   1.0  1.0  1.90  6.00 
1  52 GLN  HN   1  51 LYS+ HB*   1.0  1.0  1.90  4.00 
1  52 GLN  HN   1  51 LYS+ HA    1.0  1.0  1.90  5.00 
1  52 GLN  HN   1  50 GLN  HA    1.0  1.0  1.90  5.00 
1  52 GLN  HN   1  53 TRP  HN    1.0  1.0  1.90  3.00 

1  52 GLN  HA   1  56 THR  HG2*  1.0  1.0  1.90  5.50 

1  52 GLN  HG*  1  56 THR  HG2*  1.0  1.0  1.90  7.50 

1  52 GLN  HB1  1  56 THR  HG2*  1.0  1.0  1.90  6.50 
1  52 GLN  HB2  1  56 THR  HG2*  1.0  1.0  1.90  6.50 

1  52 GLN  HE*  1  48 LEU  HD*   1.0  1.0  1.90  9.90 
;--------------------------------------------------------
1  53 TRP  HN   1  53 TRP  HB*   1.0  1.0  1.90  4.00 
1  53 TRP  HN   1  54 LEU  HD1*  1.0  1.0  1.90  6.50
1  53 TRP  HN   1  51 LYS+ HB*   1.0  1.0  1.90  6.00 
1  53 TRP  HN   1  52 GLN  HB1   1.0  1.0  1.90  4.00 
1  53 TRP  HN   1  52 GLN  HB2   1.0  1.0  1.90  4.00 
1  53 TRP  HN   1  52 GLN  HA    1.0  1.0  1.90  5.00
1  53 TRP  HN   1  54 LEU  HN    1.0  1.0  1.90  3.00 

1  53 TRP  HA   1  56 THR  HG2*  1.0  1.0  1.90  6.50 
1  53 TRP  HA   1  57 GLU- HB*   1.0  1.0  1.90  6.00
1  53 TRP  HA   1  57 GLU- HG*   1.0  1.0  1.90  6.00 

1  53 TRP  HE1  1  58 ALA  HB*   1.0  1.0  1.90  5.50 
1  53 TRP  HE1  1  57 GLU- HB*   1.0  1.0  1.90  6.00 
1  53 TRP  HE1  1  57 GLU- HG*   1.0  1.0  1.90  6.00 
1  53 TRP  HE1  1  58 ALA  HA    1.0  1.0  1.90  5.00 

1  53 TRP  HE3  1  58 ALA  HB*   1.0  1.0  1.90  5.50 
1  53 TRP  HZ2  1  58 ALA  HB*   1.0  1.0  1.90  5.50 
1  53 TRP  HZ3  1  58 ALA  HB*   1.0  1.0  1.90  5.50 
1  53 TRP  HH2  1  58 ALA  HB*   1.0  1.0  1.90  5.50

1  53 TRP  HE3  1   9 LYS+ HG*   1.0  1.0  1.90  6.00 
1  53 TRP  HZ2  1   9 LYS+ HG*   1.0  1.0  1.90  6.00  
1  53 TRP  HZ3  1   9 LYS+ HG*   1.0  1.0  1.90  6.00 

1  53 TRP  HE3  1  54 LEU  HD2*  1.0  1.0  1.90  5.50
1  53 TRP  HZ2  1  54 LEU  HD2*  1.0  1.0  1.90  6.50 
1  53 TRP  HZ3  1  54 LEU  HD2*  1.0  1.0  1.90  5.50 
1  53 TRP  HH2  1  54 LEU  HD2*  1.0  1.0  1.90  5.50 

1  53 TRP  HE3  1  13 LEU  HD1*  1.0  1.0  1.90  6.50 
1  53 TRP  HZ2  1  13 LEU  HD1*  1.0  1.0  1.90  6.50 
1  53 TRP  HZ3  1  13 LEU  HD1*  1.0  1.0  1.90  6.50  
1  53 TRP  HH2  1  13 LEU  HD1*  1.0  1.0  1.90  6.50 

1  53 TRP  HE3  1  54 LEU  HD1*  1.0  1.0  1.90  6.50 
1  53 TRP  HZ3  1  54 LEU  HD1*  1.0  1.0  1.90  6.50 

1  53 TRP  HE3  1  13 LEU  HD2*  1.0  1.0  1.90  6.50  
1  53 TRP  HZ2  1  13 LEU  HD2*  1.0  1.0  1.90  5.50 
1  53 TRP  HZ3  1  13 LEU  HD2*  1.0  1.0  1.90  5.50  
1  53 TRP  HH2  1  13 LEU  HD2*  1.0  1.0  1.90  5.50 

1  53 TRP  HE3  1   9 LYS+ HB*   1.0  1.0  1.90  6.00 
1  53 TRP  HZ2  1   9 LYS+ HB*   1.0  1.0  1.90  6.00  
1  53 TRP  HZ3  1   9 LYS+ HB*   1.0  1.0  1.90  5.00 
1  53 TRP  HH2  1   9 LYS+ HB*   1.0  1.0  1.90  6.00 

1  53 TRP  HE3  1  13 LEU  HB1   1.0  1.0  1.90  5.00 
1  53 TRP  HZ2  1  13 LEU  HB1   1.0  1.0  1.90  5.00
1  53 TRP  HZ3  1  13 LEU  HB1   1.0  1.0  1.90  4.00 
1  53 TRP  HH2  1  13 LEU  HB1   1.0  1.0  1.90  4.00 

1  53 TRP  HZ3  1  13 LEU  HB2   1.0  1.0  1.90  5.00 
1  53 TRP  HH2  1  13 LEU  HB2   1.0  1.0  1.90  5.00 

1  53 TRP  HD1  1  57 GLU- HB*   1.0  1.0  1.90  5.00 

1  53 TRP  HE3  1   9 LYS+ HE*   1.0  1.0  1.90  6.00  
1  53 TRP  HD1  1   9 LYS+ HE*   1.0  1.0  1.90  6.00 

1  53 TRP  HE3  1  54 LEU  HG    1.0  1.0  1.90  3.00 
1  53 TRP  HZ3  1  54 LEU  HG    1.0  1.0  1.90  4.00 

1  53 TRP  HD1  1  57 GLU- HG*   1.0  1.0  1.90  6.00  

1  53 TRP  HE3  1  50 GLN  HG*   1.0  1.0  1.90  5.00 
1  53 TRP  HZ3  1  50 GLN  HG*   1.0  1.0  1.90  6.00 

1  53 TRP  HE3  1  54 LEU  HB1   1.0  1.0  1.90  5.00 

1  53 TRP  HE3  1  54 LEU  HA    1.0  1.0  1.90  5.00 

1  53 TRP  HZ2  1  58 ALA  HA    1.0  1.0  1.90  5.00 

1  53 TRP  HE3  1  50 GLN  HA    1.0  1.0  1.90  4.00 
1  53 TRP  HZ3  1  50 GLN  HA    1.0  1.0  1.90  5.00 

1  53 TRP  HD1  1  57 GLU- HA    1.0  1.0  1.90  5.00 

1  53 TRP  HZ3  1  10 PHE  HA    1.0  1.0  1.90  5.00 
1  53 TRP  HH2  1  10 PHE  HA    1.0  1.0  1.90  5.00 

1  53 TRP  HE3  1   9 LYS+ HA    1.0  1.0  1.90  4.00 
1  53 TRP  HZ3  1   9 LYS+ HA    1.0  1.0  1.90  4.00 
1  53 TRP  HH2  1   9 LYS+ HA    1.0  1.0  1.90  4.00 

1  53 TRP  HH2  1  10 PHE  HD*    1.0  1.0  1.90  7.00
1  53 TRP  HH2  1  10 PHE  HE*    1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  54 LEU  HN   1  54 LEU  HB1   1.0  1.0  1.90  3.00 
1  54 LEU  HN   1  54 LEU  HB2   1.0  1.0  1.90  4.00 
1  54 LEU  HN   1  54 LEU  HG    1.0  1.0  1.90  3.00 
1  54 LEU  HN   1  54 LEU  HD1*  1.0  1.0  1.90  6.50
1  54 LEU  HN   1  54 LEU  HD2*  1.0  1.0  1.90  6.50 
1  54 LEU  HN   1  58 ALA  HB*   1.0  1.0  1.90  6.50 
1  54 LEU  HN   1  53 TRP  HB*   1.0  1.0  1.90  4.00 
1  54 LEU  HN   1  51 LYS+ HA    1.0  1.0  1.90  4.00 
1  54 LEU  HN   1  53 TRP  HA    1.0  1.0  1.90  5.00 
1  54 LEU  HN   1  53 TRP  HE3   1.0  1.0  1.90  4.00 
1  54 LEU  HN   1  55 MET  HN    1.0  1.0  1.90  3.00 

1  54 LEU  HA   1  59 LEU  HD1*  1.0  1.0  1.90  6.50  
1  54 LEU  HA   1  58 ALA  HB*   1.0  1.0  1.90  4.50 
1  54 LEU  HA   1  59 LEU  HG    1.0  1.0  1.90  5.00 

1  54 LEU  HB2  1  59 LEU  HD1*  1.0  1.0  1.90  4.50
1  54 LEU  HB1  1  59 LEU  HD1*  1.0  1.0  1.90  5.50 
1  54 LEU  HB2  1  58 ALA  HB*   1.0  1.0  1.90  6.50 
1  54 LEU  HB1  1  58 ALA  HB*   1.0  1.0  1.90  6.50 

1  54 LEU  HD2* 1  59 LEU  HD1*  1.0  1.0  1.90  7.00 
1  54 LEU  HD2* 1  58 ALA  HB*   1.0  1.0  1.90  6.00 
1  54 LEU  HD2* 1  34 LEU  HD*   1.0  1.0  1.90  8.00 
1  54 LEU  HD2* 1  13 LEU  HD2*  1.0  1.0  1.90  8.00 
1  54 LEU  HD2* 1  59 LEU  HG    1.0  1.0  1.90  5.50 
1  54 LEU  HD2* 1  13 LEU  HB1   1.0  1.0  1.90  5.50 
1  54 LEU  HD2* 1  13 LEU  HA    1.0  1.0  1.90   5.50 

1  54 LEU  HD1* 1  59 LEU  HD1*  1.0  1.0  1.90  7.00 
1  54 LEU  HD1* 1  58 ALA  HB*   1.0  1.0  1.90  8.00 
;--------------------------------------------------------
1  55 MET  HN   1  55 MET  HB*   1.0  1.0  1.90  4.00
1  55 MET  HN   1  55 MET  HG*   1.0  1.0  1.90  5.00 
1  55 MET  HN   1  59 LEU  HD1*  1.0  1.0  1.90  6.50 
1  55 MET  HN   1  54 LEU  HD2*  1.0  1.0  1.90  6.50 
1  55 MET  HN   1  54 LEU  HD1*  1.0  1.0  1.90  6.50 
1  55 MET  HN   1  54 LEU  HB2   1.0  1.0  1.90  4.00 
1  55 MET  HN   1  56 THR  HG2*  1.0  1.0  1.90  6.50
1  55 MET  HN   1  54 LEU  HA    1.0  1.0  1.90  5.00 
1  55 MET  HN   1  52 GLN  HA    1.0  1.0  1.90  5.00 
1  55 MET  HN   1  56 THR  HN    1.0  1.0  1.90  3.00 

1  55 MET  HA   1  59 LEU  HD1*  1.0  1.0  1.90  5.50 
1  55 MET  HA   1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  55 MET  HA   1  59 LEU  HB2   1.0  1.0  1.90  5.00 
1  55 MET  HA   1  59 LEU  HB1   1.0  1.0  1.90  4.00 

1  55 MET  HB*  1  56 THR  HG2*  1.0  1.0  1.90  5.50 
1  55 MET  HB*  1  52 GLN  HA    1.0  1.0  1.90  4.00 

1  55 MET  HG*  1  51 LYS+ HG*   1.0  1.0  1.90  7.00 
1  55 MET  HG*  1  56 THR  HG2*  1.0  1.0  1.90  7.50 
1  55 MET  HG*  1  34 LEU  HD*   1.0  1.0  1.90  9.90 
1  55 MET  HG*  1  52 GLN  HA    1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  56 THR  HN   1  56 THR  HG2*  1.0  1.0  1.90  4.50 
1  56 THR  HN   1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  56 THR  HN   1  55 MET  HB*   1.0  1.0  1.90  4.00 
1  56 THR  HN   1  55 MET  HA    1.0  1.0  1.90  5.00 
1  56 THR  HN   1  58 ALA  HN    1.0  1.0  1.90  5.00 
1  56 THR  HN   1  57 GLU- HN    1.0  1.0  1.90  3.00 

1  56 THR  HA   1  60 VAL  HG2*  1.0  1.0  1.90  4.50 
1  56 THR  HA   1  60 VAL  HG1*  1.0  1.0  1.90  6.50 
1  56 THR  HA   1  55 MET  HB*   1.0  1.0  1.90  6.00 

1  56 THR  HB   1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  56 THR  HB   1  60 VAL  HG1*  1.0  1.0  1.90  6.50 
1  56 THR  HB   1  55 MET  HB*   1.0  1.0  1.90  6.00 

1  56 THR  HG2* 1  60 VAL  HG2*  1.0  1.0  1.90  8.00 
;--------------------------------------------------------
1  57 GLU- HN   1  57 GLU- HB*   1.0  1.0  1.90  5.00
1  57 GLU- HN   1  57 GLU- HG*   1.0  1.0  1.90  6.00 
1  57 GLU- HN   1  58 ALA  HB*   1.0  1.0  1.90  6.50
1  57 GLU- HN   1  60 VAL  HG2*  1.0  1.0  1.90  8.90 
1  57 GLU- HN   1  56 THR  HB    1.0  1.0  1.90  5.00 
1  57 GLU- HN   1  58 ALA  HN    1.0  1.0  1.90  3.00 
1  57 GLU- HN   1  59 LEU  HN    1.0  1.0  1.90  5.00 

1  57 GLU- HA   1  60 VAL  HG2*  1.0  1.0  1.90  4.50 
1  57 GLU- HA   1  60 VAL  HG1*  1.0  1.0  1.90  5.50 
1  57 GLU- HA   1  60 VAL  HB    1.0  1.0  1.90  5.00 

1  57 GLU- HB*  1  58 ALA  HA    1.0  1.0  1.90  6.00 

1  57 GLU- HG*  1  58 ALA  HA    1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  58 ALA  HN   1  58 ALA  HB*   1.0  1.0  1.90  4.50 
1  58 ALA  HN   1  54 LEU  HD2*  1.0  1.0  1.90  6.50 
1  58 ALA  HN   1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  58 ALA  HN   1  13 LEU  HD2*  1.0  1.0  1.90  6.50 
1  58 ALA  HN   1  57 GLU- HB*   1.0  1.0  1.90  4.00 
1  58 ALA  HN   1  57 GLU- HG*   1.0  1.0  1.90  6.00 
1  58 ALA  HN   1  54 LEU  HA    1.0  1.0  1.90  4.00 
1  58 ALA  HN   1  57 GLU- HA    1.0  1.0  1.90  5.00 
1  58 ALA  HN   1  59 LEU  HN    1.0  1.0  1.90  4.00 
1  58 ALA  HN   1  53 TRP  HE1   1.0  1.0  1.90  5.00 

1  58 ALA  HA   1  62 ASN  HB*   1.0  1.0  1.90  6.00 
1  58 ALA  HA   1  57 GLU- HA    1.0  1.0  1.90  5.00 

1  58 ALA  HB*  1  59 LEU  HG    1.0  1.0  1.90  6.50 
1  58 ALA  HB*  1  13 LEU  HB1   1.0  1.0  1.90  6.50
1  58 ALA  HB*  1  57 GLU- HB*   1.0  1.0  1.90  7.50 
1  58 ALA  HB*  1  55 MET  HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  59 LEU  HN   1  59 LEU  HB1   1.0  1.0  1.90  3.00 
1  59 LEU  HN   1  59 LEU  HB2   1.0  1.0  1.90  4.00 
1  59 LEU  HN   1  59 LEU  HG    1.0  1.0  1.90  3.00 
1  59 LEU  HN   1  59 LEU  HD1*  1.0  1.0  1.90  6.50 
1  59 LEU  HN   1  59 LEU  HD2*  1.0  1.0  1.90  6.50 
1  59 LEU  HN   1  58 ALA  HB*   1.0  1.0  1.90  4.50
1  59 LEU  HN   1  54 LEU  HD2*  1.0  1.0  1.90  6.50 
1  59 LEU  HN   1  13 LEU  HD1*  1.0  1.0  1.90  6.50 
1  59 LEU  HN   1  60 VAL  HG2*  1.0  1.0  1.90  6.50  
1  59 LEU  HN   1  13 LEU  HD2*  1.0  1.0  1.90  6.50 
1  59 LEU  HN   1  54 LEU  HA    1.0  1.0  1.90  4.00 
1  59 LEU  HN   1  58 ALA  HA    1.0  1.0  1.90  5.00 
1  59 LEU  HN   1  60 VAL  HN    1.0  1.0  1.90  3.00 

1  59 LEU  HA   1  13 LEU  HD1*  1.0  1.0  1.90  5.50 
1  59 LEU  HA   1  62 ASN  HB*   1.0  1.0  1.90  4.00 

1  59 LEU  HB2  1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  59 LEU  HB1  1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  59 LEU  HB1  1  65 ILE  HG2*  1.0  1.0  1.90  6.50 
1  59 LEU  HB2  1  65 ILE  HG2*  1.0  1.0  1.90  6.50 

1  59 LEU  HG   1  60 VAL  HG2*  1.0  1.0  1.90  6.50 
1  59 LEU  HG   1  65 ILE  HG2*  1.0  1.0  1.90  6.50 

1  59 LEU  HD1* 1  16 ILE  HB    1.0  1.0  1.90  6.50 
1  59 LEU  HD1* 1  62 ASN  HB*   1.0  1.0  1.90  7.50 
1  59 LEU  HD1* 1  34 LEU  HA    1.0  1.0  1.90  6.50 

1  59 LEU  HD2* 1  65 ILE  HG2*  1.0  1.0  1.90  6.00 
1  59 LEU  HD2* 1  65 ILE  HG1*  1.0  1.0  1.90  6.50 
1  59 LEU  HD2* 1  65 ILE  HD*   1.0  1.0  1.90  6.00 
1  59 LEU  HD2* 1  65 ILE  HB    1.0  1.0  1.90  6.50 
1  59 LEU  HD2* 1  16 ILE  HB    1.0  1.0  1.90  6.50 
1  59 LEU  HD2* 1  54 LEU  HB1   1.0  1.0  1.90  6.50  
1  59 LEU  HD2* 1  54 LEU  HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  60 VAL  HN   1  60 VAL  HB    1.0  1.0  1.90  4.00 
1  60 VAL  HN   1  60 VAL  HG1*  1.0  1.0  1.90  6.50 
1  60 VAL  HN   1  60 VAL  HG2*  1.0  1.0  1.90  5.50 
1  60 VAL  HN   1  59 LEU  HG    1.0  1.0  1.90  5.00
1  60 VAL  HN   1  59 LEU  HB1   1.0  1.0  1.90  5.00
1  60 VAL  HN   1  61 ASN  HN    1.0  1.0  1.90  5.00 

1  60 VAL  HG1* 1  61 ASN  HB*   1.0  1.0  1.90  7.50 
;--------------------------------------------------------
1  61 ASN  HD*  1  60 VAL  HG2*  1.0  1.0  1.90  7.50
1  61 ASN  HD*  1  60 VAL  HG1*  1.0  1.0  1.90  7.50 
1  61 ASN  HD*  1  57 GLU- HA    1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  62 ASN  HN   1  62 ASN  HB*   1.0  1.0  1.90  5.00 
1  62 ASN  HN   1  61 ASN  HN    1.0  1.0  1.90  5.00 

1  62 ASN  HA   1  63 PRO  HG*   1.0  1.0  1.90  6.00 
1  62 ASN  HA   1  63 PRO  HD*   1.0  1.0  1.90  4.00 
1  62 ASN  HA   1  63 PRO  HA    1.0  1.0  1.90  5.00 

1  62 ASN  HB*  1  59 LEU  HD2*  1.0  1.0  1.90  7.50 
1  62 ASN  HB*  1  65 ILE  HG1*  1.0  1.0  1.90  6.00 
1  62 ASN  HB*  1  65 ILE  HG2*  1.0  1.0  1.90  6.50 
1  62 ASN  HB*  1  65 ILE  HB    1.0  1.0  1.90  4.00 

1  62 ASN  HD*  1  13 LEU  HD1*  1.0  1.0  1.90  6.50 
1  62 ASN  HD*  1  13 LEU  HD2*  1.0  1.0  1.90  6.50 
1  62 ASN  HD*  1  17 VAL  HG1*  1.0  1.0  1.90  7.50 
1  62 ASN  HD*  1  63 PRO  HD*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  63 PRO  HA   1  75 LYS+ HD*   1.0  1.0  1.90  6.00 

1  63 PRO  HB*  1  62 ASN  HA    1.0  1.0  1.90  6.00 

1  63 PRO  HD*  1  62 ASN  HB*   1.0  1.0  1.90  7.00
;--------------------------------------------------------
1  64 LYS+ HN   1  64 LYS+ HB1   1.0  1.0  1.90  3.00 
1  64 LYS+ HN   1  64 LYS+ HB2   1.0  1.0  1.90  4.00 
1  64 LYS+ HN   1  64 LYS+ HG*   1.0  1.0  1.90  5.00 
1  64 LYS+ HN   1  62 ASN  HB*   1.0  1.0  1.90  6.00 
1  64 LYS+ HN   1  63 PRO  HD*   1.0  1.0  1.90  6.00 
1  64 LYS+ HN   1  63 PRO  HA    1.0  1.0  1.90  5.00
1  64 LYS+ HN   1  62 ASN  HA    1.0  1.0  1.90  5.00
1  64 LYS+ HN   1  65 ILE  HN    1.0  1.0  1.90  3.00 

1  64 LYS+ HA   1  75 LYS+ HB1   1.0  1.0  1.90  4.00 
1  64 LYS+ HA   1  75 LYS+ HB2   1.0  1.0  1.90  3.00 

1  64 LYS+ HB1  1  17 VAL  HG1*  1.0  1.0  1.90  5.50 
1  64 LYS+ HB2  1  17 VAL  HG1*  1.0  1.0  1.90  5.50 
1  64 LYS+ HB2  1  74 PHE  HA    1.0  1.0  1.90  5.00

1  64 LYS+ HD*  1  17 VAL  HG1*  1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  65 ILE  HN   1  65 ILE  HB    1.0  1.0  1.90  3.00 
1  65 ILE  HN   1  65 ILE  HG1*  1.0  1.0  1.90  5.00 
1  65 ILE  HN   1  65 ILE  HG2*  1.0  1.0  1.90  6.50 
1  65 ILE  HN   1  65 ILE  HD*   1.0  1.0  1.90  6.50
1  65 ILE  HN   1  64 LYS+ HB1   1.0  1.0  1.90  5.00 
1  65 ILE  HN   1  62 ASN  HB*   1.0  1.0  1.90  5.00 
1  65 ILE  HN   1  64 LYS+ HA    1.0  1.0  1.90  5.00 

1  65 ILE  HA   1  74 PHE  HA    1.0  1.0  1.90  3.00 

1  65 ILE  HB   1  59 LEU  HA    1.0  1.0  1.90  5.00 

1  65 ILE  HG2* 1  59 LEU  HD1*  1.0  1.0  1.90  7.00 
1  65 ILE  HG2* 1  72 TYR  HB*   1.0  1.0  1.90  5.50 
1  65 ILE  HG2* 1  59 LEU  HA    1.0  1.0  1.90  5.50
1  65 ILE  HG2* 1  66 GLU- HA    1.0  1.0  1.90  6.50 
1  65 ILE  HG2* 1  72 TYR  HA    1.0  1.0  1.90  5.50 

1  65 ILE  HD*  1  20 MET  HB2   1.0  1.0  1.90  6.50
1  65 ILE  HD*  1  20 MET  HB1   1.0  1.0  1.90  6.50 
1  65 ILE  HD*  1  20 MET  HG*   1.0  1.0  1.90  6.50 
1  65 ILE  HD*  1  72 TYR  HB*   1.0  1.0  1.90  7.50 
1  65 ILE  HD*  1  74 PHE  HB2   1.0  1.0  1.90  6.50 
1  65 ILE  HD*  1  74 PHE  HB1   1.0  1.0  1.90  6.50 
1  65 ILE  HD*  1  17 VAL  HA    1.0  1.0  1.90  4.50 
1  65 ILE  HD*  1  74 PHE  HA    1.0  1.0  1.90  4.50 
;--------------------------------------------------------
1  66 GLU- HN   1  66 GLU- HB*   1.0  1.0  1.90  5.00 
1  66 GLU- HN   1  66 GLU- HG*   1.0  1.0  1.90  6.00 
1  66 GLU- HN   1  65 ILE  HD*   1.0  1.0  1.90  6.50 
1  66 GLU- HN   1  65 ILE  HG2*  1.0  1.0  1.90  4.50
1  66 GLU- HN   1  75 LYS+ HB2   1.0  1.0  1.90  5.00 
1  66 GLU- HN   1  65 ILE  HA    1.0  1.0  1.90  3.00 
1  66 GLU- HN   1  73 ALA  HN    1.0  1.0  1.90  5.00 

1  66 GLU- HB*  1  68 ILE  HD*   1.0  1.0  1.90  7.50 
1  66 GLU- HB*  1  75 LYS+ HB1   1.0  1.0  1.90  6.00 
1  66 GLU- HB*  1  75 LYS+ HB2   1.0  1.0  1.90  6.00 
1  66 GLU- HB*  1  73 ALA  HB*   1.0  1.0  1.90  6.50 

1  66 GLU- HG*  1  68 ILE  HD*   1.0  1.0  1.90  6.50 
1  66 GLU- HG*  1  68 ILE  HG1*  1.0  1.0  1.90  6.00 
1  66 GLU- HG*  1  75 LYS+ HG*   1.0  1.0  1.90  7.00 
1  66 GLU- HG*  1  73 ALA  HB*   1.0  1.0  1.90  6.50 
1  66 GLU- HG*  1  75 LYS+ HE*   1.0  1.0  1.90  7.00 
1  66 GLU- HG*  1  68 ILE  HA    1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  67 VAL  HN   1  67 VAL  HB    1.0  1.0  1.90  3.00 
1  67 VAL  HN   1  67 VAL  HG1*  1.0  1.0  1.90  5.50 
1  67 VAL  HN   1  67 VAL  HG2*  1.0  1.0  1.90  4.50 
1  67 VAL  HN   1  66 GLU- HB*   1.0  1.0  1.90  6.00 
1  67 VAL  HN   1  66 GLU- HG*   1.0  1.0  1.90  6.00 
1  67 VAL  HN   1  66 GLU- HA    1.0  1.0  1.90  3.00 
1  67 VAL  HN   1  68 ILE  HN    1.0  1.0  1.90  5.00
1  67 VAL  HN   1  66 GLU- HN    1.0  1.0  1.90  5.00 

1  67 VAL  HA   1  72 TYR  HB*   1.0  1.0  1.90  6.00 
1  67 VAL  HA   1  72 TYR  HA    1.0  1.0  1.90  3.00 

1  67 VAL  HG1* 1  70 GLY  HA*   1.0  1.0  1.90  6.50 
1  67 VAL  HG1* 1  68 ILE  HA    1.0  1.0  1.90  6.50
1  67 VAL  HG1* 1  72 TYR  HA    1.0  1.0  1.90  6.50

1  67 VAL  HG2* 1  72 TYR  HB*   1.0  1.0  1.90  7.50 
1  67 VAL  HG2* 1  60 VAL  HA    1.0  1.0  1.90  5.50 
1  67 VAL  HG2* 1  72 TYR  HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  68 ILE  HN   1  68 ILE  HB    1.0  1.0  1.90  3.00 
1  68 ILE  HN   1  68 ILE  HG2*  1.0  1.0  1.90  6.50 
1  68 ILE  HN   1  68 ILE  HD*   1.0  1.0  1.90  6.50 
1  68 ILE  HN   1  67 VAL  HG1*  1.0  1.0  1.90  5.50 
1  68 ILE  HN   1  67 VAL  HG2*  1.0  1.0  1.90  5.50 
1  68 ILE  HN   1  67 VAL  HB    1.0  1.0  1.90  5.00 
1  68 ILE  HN   1  67 VAL  HA    1.0  1.0  1.90  3.00 
1  68 ILE  HN   1  72 TYR  HA    1.0  1.0  1.90  5.00 
1  68 ILE  HN   1  71 LYS+ HN    1.0  1.0  1.90  4.00 

1  68 ILE  HB   1  31 PRO  HB*   1.0  1.0  1.90  6.00 
1  68 ILE  HB   1  31 PRO  HG*   1.0  1.0  1.90  5.00 

1  68 ILE  HG2* 1  69 ASP- HB2   1.0  1.0  1.90  4.50 
1  68 ILE  HG2* 1  69 ASP- HB1   1.0  1.0  1.90  5.50 
;--------------------------------------------------------
1  69 ASP- HN   1  69 ASP- HB2   1.0  1.0  1.90  4.00 
1  69 ASP- HN   1  69 ASP- HB1   1.0  1.0  1.90  5.00 
1  69 ASP- HN   1  68 ILE  HG2*  1.0  1.0  1.90  5.50 
1  69 ASP- HN   1  68 ILE  HG1*  1.0  1.0  1.90  6.00 
1  69 ASP- HN   1  68 ILE  HB    1.0  1.0  1.90  5.00 
1  69 ASP- HN   1  70 GLY  HN    1.0  1.0  1.90  4.00 

1  69 ASP- HA   1  70 GLY  HA*   1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  70 GLY  HN   1  67 VAL  HG1*  1.0  1.0  1.90  5.50 
1  70 GLY  HN   1  69 ASP- HB2   1.0  1.0  1.90  5.00 
1  70 GLY  HN   1  69 ASP- HB1   1.0  1.0  1.90  5.00 
1  70 GLY  HN   1  69 ASP- HA    1.0  1.0  1.90  3.00 
1  70 GLY  HN   1  71 LYS+ HN    1.0  1.0  1.90  4.00 
;--------------------------------------------------------
1  71 LYS+ HN   1  71 LYS+ HB1   1.0  1.0  1.90  3.00 
1  71 LYS+ HN   1  71 LYS+ HB2   1.0  1.0  1.90  4.00 
1  71 LYS+ HN   1  71 LYS+ HD*   1.0  1.0  1.90  5.00 
1  71 LYS+ HN   1  67 VAL  HG1*  1.0  1.0  1.90  5.50
1  71 LYS+ HN   1  68 ILE  HG2*  1.0  1.0  1.90  6.50 
1  71 LYS+ HN   1  70 GLY  HA*   1.0  1.0  1.90  6.00 
1  71 LYS+ HN   1  72 TYR  HN    1.0  1.0  1.90  5.00 

1  71 LYS+ HA   1  31 PRO  HB*   1.0  1.0  1.90  6.00 
;--------------------------------------------------------
1  72 TYR  HN   1  72 TYR  HB*   1.0  1.0  1.90  4.00
1  72 TYR  HN   1  37 ILE  HD*   1.0  1.0  1.90  6.50 
1  72 TYR  HN   1  71 LYS+ HD*   1.0  1.0  1.90  6.00 
1  72 TYR  HN   1  71 LYS+ HB2   1.0  1.0  1.90  3.00 
1  72 TYR  HN   1  71 LYS+ HB1   1.0  1.0  1.90  4.00 
1  72 TYR  HN   1  32 LEU  HB1   1.0  1.0  1.90  5.00 
1  72 TYR  HN   1  32 LEU  HB2   1.0  1.0  1.90  5.00 
1  72 TYR  HN   1  71 LYS+ HA    1.0  1.0  1.90  3.00 

1  72 TYR  HA   1  71 LYS+ HA    1.0  1.0  1.90  5.00 
1  72 TYR  HA   1  20 MET  HE*   1.0  1.0  1.90  6.50 

1  72 TYR  HB*  1  20 MET  HE*   1.0  1.0  1.90  6.50 

1  72 TYR  HD*  1  59 LEU  HD1*  1.0  1.0  1.90  7.50
1  72 TYR  HE*  1  59 LEU  HD1*  1.0  1.0  1.90  7.50 
1  72 TYR  HD*  1  59 LEU  HD2*  1.0  1.0  1.90  7.50 
1  72 TYR  HE*  1  59 LEU  HD2*  1.0  1.0  1.90  7.50 
1  72 TYR  HD*  1  67 VAL  HG1*  1.0  1.0  1.90  7.50 
1  72 TYR  HE*  1  67 VAL  HG1*  1.0  1.0  1.90  7.50 
1  72 TYR  HD*  1  34 LEU  HD*   1.0  1.0  1.90 10.90 
1  72 TYR  HE*  1  34 LEU  HD*   1.0  1.0  1.90  8.90 
1  72 TYR  HD*  1  37 ILE  HD*   1.0  1.0  1.90  7.50 
1  72 TYR  HE*  1  37 ILE  HD*   1.0  1.0  1.90  8.50
1  72 TYR  HD*  1  67 VAL  HG2*  1.0  1.0  1.90  9.90 
1  72 TYR  HE*  1  67 VAL  HG2*  1.0  1.0  1.90  9.90 
1  72 TYR  HD*  1  34 LEU  HG    1.0  1.0  1.90  7.00
1  72 TYR  HE*  1  34 LEU  HG    1.0  1.0  1.90  5.00 
1  72 TYR  HD*  1  65 ILE  HG2*  1.0  1.0  1.90  7.50 
1  72 TYR  HE*  1  65 ILE  HG2*  1.0  1.0  1.90  7.50 
1  72 TYR  HD*  1  59 LEU  HB2   1.0  1.0  1.90  7.00  
1  72 TYR  HD*  1  59 LEU  HB1   1.0  1.0  1.90  7.00
1  72 TYR  HE*  1  59 LEU  HB2   1.0  1.0  1.90  7.00 
1  72 TYR  HE*  1  59 LEU  HB1   1.0  1.0  1.90  7.00 
1  72 TYR  HD*  1  33 THR  HG2*  1.0  1.0  1.90  8.50 
1  72 TYR  HE*  1  33 THR  HG2*  1.0  1.0  1.90  8.50 
1  72 TYR  HE*  1  34 LEU  HB1   1.0  1.0  1.90  6.00 
1  72 TYR  HE*  1  34 LEU  HB2   1.0  1.0  1.90  6.00 
1  72 TYR  HD*  1  34 LEU  HB1   1.0  1.0  1.90  6.00 
1  72 TYR  HD*  1  34 LEU  HB2   1.0  1.0  1.90  6.00
1  72 TYR  HE*  1  55 MET  HG*   1.0  1.0  1.90  8.00 
1  72 TYR  HE*  1  60 VAL  HA    1.0  1.0  1.90  7.00
1  72 TYR  HE*  1  55 MET  HA    1.0  1.0  1.90  7.00
1  72 TYR  HE*  1  34 LEU  HA    1.0  1.0  1.90  7.00 
1  72 TYR  HD*  1  34 LEU  HA    1.0  1.0  1.90  7.00 
1  72 TYR  HE*  1  71 LYS+ HA    1.0  1.0  1.90  7.00 
1  72 TYR  HD*  1  71 LYS+ HA    1.0  1.0  1.90  7.00 
1  72 TYR  HD*  1  67 VAL  HA    1.0  1.0  1.90  6.00 
1  72 TYR  HE*  1  67 VAL  HA    1.0  1.0  1.90  7.00 
1  72 TYR  HD*  1  33 THR  HA    1.0  1.0  1.90  6.00
1  72 TYR  HE*  1  33 THR  HA    1.0  1.0  1.90  7.00
1  72 TYR  HE*  1  33 THR  HB    1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  73 ALA  HN   1  73 ALA  HB*   1.0  1.0  1.90  4.50 
1  73 ALA  HN   1  68 ILE  HD*   1.0  1.0  1.90  6.50 
1  73 ALA  HN   1  65 ILE  HG2*  1.0  1.0  1.90  5.50 
1  73 ALA  HN   1  31 PRO  HB*   1.0  1.0  1.90  6.00 
1  73 ALA  HN   1  72 TYR  HB*   1.0  1.0  1.90  4.00 
1  73 ALA  HN   1  67 VAL  HA    1.0  1.0  1.90  5.00 
1  73 ALA  HN   1  72 TYR  HA    1.0  1.0  1.90  3.00 
1  73 ALA  HN   1  72 TYR  HD*   1.0  1.0  1.90  7.00 

1  73 ALA  HA   1  20 MET  HE*   1.0  1.0  1.90  5.50 

1  73 ALA  HB*  1  68 ILE  HD*   1.0  1.0  1.90  6.00 
1  73 ALA  HB*  1  67 VAL  HG2*  1.0  1.0  1.90  8.00 
1  73 ALA  HB*  1  65 ILE  HG2*  1.0  1.0  1.90  8.00 
1  73 ALA  HB*  1  72 TYR  HA    1.0  1.0  1.90  6.50 
;--------------------------------------------------------
1  74 PHE  HN   1  74 PHE  HB1   1.0  1.0  1.90  3.00 
1  74 PHE  HN   1  74 PHE  HB2   1.0  1.0  1.90  3.00
1  74 PHE  HN   1  65 ILE  HD*   1.0  1.0  1.90  6.50
1  74 PHE  HN   1  73 ALA  HB*   1.0  1.0  1.90  4.50 
1  74 PHE  HN   1  20 MET  HE*   1.0  1.0  1.90  5.50 
1  74 PHE  HN   1  24 HIS  HB*   1.0  1.0  1.90  6.00 
1  74 PHE  HN   1  73 ALA  HA    1.0  1.0  1.90  5.00 

1  74 PHE  HA   1  20 MET  HE*   1.0  1.0  1.90  6.50 

1  74 PHE  HE*  1  17 VAL  HA    1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  17 VAL  HA    1.0  1.0  1.90  7.00 
1  74 PHE  HE*  1  17 VAL  HG2*  1.0  1.0  1.90  8.50 
1  74 PHE  HD*  1  17 VAL  HG2*  1.0  1.0  1.90  8.50
1  74 PHE  HZ   1  17 VAL  HG1*  1.0  1.0  1.90  6.50
1  74 PHE  HE*  1  17 VAL  HG1*  1.0  1.0  1.90  7.50 
1  74 PHE  HD*  1  17 VAL  HG1*  1.0  1.0  1.90  7.50 

1  74 PHE  HD*  1  20 MET  HB2   1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  20 MET  HB1   1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  20 MET  HG*   1.0  1.0  1.90  8.00 

1  74 PHE  HZ   1  21 LYS+ HA    1.0  1.0  1.90  5.00 
1  74 PHE  HE*  1  21 LYS+ HA    1.0  1.0  1.90  6.00 
1  74 PHE  HD*  1  21 LYS+ HA    1.0  1.0  1.90  6.00 
1  74 PHE  HZ   1  21 LYS+ HB1   1.0  1.0  1.90  5.00 
1  74 PHE  HE*  1  21 LYS+ HB1   1.0  1.0  1.90  6.00
1  74 PHE  HD*  1  21 LYS+ HB1   1.0  1.0  1.90  7.00
1  74 PHE  HZ   1  21 LYS+ HG*   1.0  1.0  1.90  5.00 
1  74 PHE  HE*  1  21 LYS+ HG*   1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  21 LYS+ HG*   1.0  1.0  1.90  8.00  
1  74 PHE  HZ   1  21 LYS+ HD*   1.0  1.0  1.90  5.00
1  74 PHE  HE*  1  21 LYS+ HD*   1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  21 LYS+ HD*   1.0  1.0  1.90  8.00 
1  74 PHE  HZ   1  21 LYS+ HE*   1.0  1.0  1.90  5.00 
1  74 PHE  HE*  1  21 LYS+ HE*   1.0  1.0  1.90  8.00 

1  74 PHE  HD*  1  24 HIS  HA    1.0  1.0  1.90  7.00 
1  74 PHE  HE*  1  24 HIS  HB*   1.0  1.0  1.90  8.00 
1  74 PHE  HD*  1  24 HIS  HB*   1.0  1.0  1.90  7.00

1  74 PHE  HE*  1  64 LYS+ HA    1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  64 LYS+ HA    1.0  1.0  1.90  7.00 
1  74 PHE  HZ   1  64 LYS+ HB2   1.0  1.0  1.90  5.00 
1  74 PHE  HE*  1  64 LYS+ HB2   1.0  1.0  1.90  6.00 
1  74 PHE  HD*  1  64 LYS+ HB2   1.0  1.0  1.90  7.00 
1  74 PHE  HE*  1  64 LYS+ HG*   1.0  1.0  1.90  8.00 
1  74 PHE  HD*  1  64 LYS+ HG*   1.0  1.0  1.90  8.00 
1  74 PHE  HZ   1  64 LYS+ HD*   1.0  1.0  1.90  6.00  
1  74 PHE  HE*  1  64 LYS+ HD*   1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  64 LYS+ HD*   1.0  1.0  1.90  8.00 
1  74 PHE  HZ   1  64 LYS+ HE*   1.0  1.0  1.90  6.00 
1  74 PHE  HE*  1  64 LYS+ HE*   1.0  1.0  1.90  8.00 

1  74 PHE  HD*  1  65 ILE  HA    1.0  1.0  1.90  7.00 
1  74 PHE  HE*  1  65 ILE  HD*   1.0  1.0  1.90  8.50 
1  74 PHE  HD*  1  65 ILE  HD*   1.0  1.0  1.90  7.50 

1  74 PHE  HE*  1  75 LYS+ HA    1.0  1.0  1.90  7.00  
1  74 PHE  HD*  1  75 LYS+ HA    1.0  1.0  1.90  7.00 

1  74 PHE  HZ   1  76 PRO  HA    1.0  1.0  1.90  4.00
1  74 PHE  HE*  1  76 PRO  HA    1.0  1.0  1.90  6.00 
1  74 PHE  HD*  1  76 PRO  HA    1.0  1.0  1.90  6.00 
1  74 PHE  HZ   1  76 PRO  HB*   1.0  1.0  1.90  6.00
1  74 PHE  HE*  1  76 PRO  HB*   1.0  1.0  1.90  7.00 
1  74 PHE  HD*  1  76 PRO  HB*   1.0  1.0  1.90  8.00 
1  74 PHE  HE*  1  76 PRO  HG*   1.0  1.0  1.90  8.00  
1  74 PHE  HD*  1  76 PRO  HG*   1.0  1.0  1.90  8.00 
1  74 PHE  HE*  1  76 PRO  HD*   1.0  1.0  1.90  8.00 
1  74 PHE  HD*  1  76 PRO  HD*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  75 LYS+ HN   1  75 LYS+ HB1   1.0  1.0  1.90  3.00 
1  75 LYS+ HN   1  75 LYS+ HB2   1.0  1.0  1.90  3.00  
  
1  75 LYS+ HN   1  65 ILE  HD*   1.0  1.0  1.90  6.50 
1  75 LYS+ HN   1  64 LYS+ HA    1.0  1.0  1.90  5.00 
1  75 LYS+ HN   1  74 PHE  HA    1.0  1.0  1.90  4.00 
1  75 LYS+ HN   1  65 ILE  HA    1.0  1.0  1.90  5.00 
1  75 LYS+ HN   1  74 PHE  HD*   1.0  1.0  1.90  7.00 

1  75 LYS+ HA   1  76 PRO  HG*   1.0  1.0  1.90  6.00 
1  75 LYS+ HA   1  76 PRO  HB*   1.0  1.0  1.90  6.00 
1  75 LYS+ HA   1  76 PRO  HD*   1.0  1.0  1.90  4.00 
1  75 LYS+ HA   1  74 PHE  HA    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  76 PRO  HD*  1  75 LYS+ HB1   1.0  1.0  1.90  6.00 
1  76 PRO  HD*  1  75 LYS+ HB2   1.0  1.0  1.90  6.00 
1  76 PRO  HD*  1  75 LYS+ HG*   1.0  1.0  1.90  7.00
;--------------------------------------------------------
1  77 LYS+ HN   1  77 LYS+ HB*   1.0  1.0  1.90  4.00 
1  77 LYS+ HN   1  77 LYS+ HG*   1.0  1.0  1.90  6.00 
1  77 LYS+ HN   1  76 PRO  HB*   1.0  1.0  1.90  5.00 
1  77 LYS+ HN   1  78 TYR  HD*   1.0  1.0  1.90  7.00
;--------------------------------------------------------
1  78 TYR  HN   1  78 TYR  HB*   1.0  1.0  1.90  4.00 
1  78 TYR  HN   1  77 LYS+ HD*   1.0  1.0  1.90  6.00 
1  78 TYR  HN   1  77 LYS+ HB*   1.0  1.0  1.90  6.00 
1  78 TYR  HN   1  77 LYS+ HA    1.0  1.0  1.90  4.00 
1  78 TYR  HN   1  79 ASN  HN    1.0  1.0  1.90  5.00 

1  78 TYR  HA   1  77 LYS+ HB*   1.0  1.0  1.90  6.00 

1  78 TYR  HD*  1  77 LYS+ HB*   1.0  1.0  1.90  8.00
 
1  78 TYR  HE*  1  77 LYS+ HB*   1.0  1.0  1.90  8.00 
1  78 TYR  HE*  1  77 LYS+ HE*   1.0  1.0  1.90  8.00 
;--------------------------------------------------------
1  79 ASN  HN   1  79 ASN  HB*   1.0  1.0  1.90  6.00 
1  79 ASN  HN   1  77 LYS+ HG*   1.0  1.0  1.90  6.00 
1  79 ASN  HN   1  78 TYR  HB*   1.0  1.0  1.90  6.00 
1  79 ASN  HN   1  78 TYR  HA    1.0  1.0  1.90  4.00 
1  79 ASN  HN   1  78 TYR  HD*   1.0  1.0  1.90  7.00 
;--------------------------------------------------------
1  80 VAL  HN   1  80 VAL  HB    1.0  1.0  1.90  3.00 
1  80 VAL  HN   1  80 VAL  HG*   1.0  1.0  1.90  7.90  
1  80 VAL  HN   1  79 ASN  HA    1.0  1.0  1.90  5.00 
;--------------------------------------------------------
1  81 ARG+ HN   1  80 VAL  HG*   1.0  1.0  1.90  8.90 
;--------------------------------------------------------



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