*HEADER    PROTEIN BINDING/ONCOPROTEIN             16-OCT-09   2KPL              
*TITLE     MAGI-1 PDZ1 / E6CT                                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MEMBRANE-ASSOCIATED GUANYLATE KINASE, WW AND PDZ DOMAIN-   
*COMPND   3 CONTAINING PROTEIN 1;                                                
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: UNP RESIDUES 455-580;                                      
*COMPND   6 SYNONYM: BAI1-ASSOCIATED PROTEIN 1, BAP-1, MEMBRANE-ASSOCIATED       
*COMPND   7 GUANYLATE KINASE INVERTED 1, MAGI-1, ATROPHIN-1-INTERACTING PROTEIN  
*COMPND   8 3, AIP3, WW DOMAIN-CONTAINING PROTEIN 3, WWP3, TRINUCLEOTIDE REPEAT- 
*COMPND   9 CONTAINING GENE 19 PROTEIN;                                          
*COMPND  10 ENGINEERED: YES;                                                     
*COMPND  11 MOL_ID: 2;                                                           
*COMPND  12 MOLECULE: PROTEIN E6;                                                
*COMPND  13 CHAIN: B;                                                            
*COMPND  14 SYNONYM: E6CT;                                                       
*COMPND  15 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: BAIAP1, BAP1, MAGI1, TNRC19;                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PETM-41;                                  
*SOURCE  10 MOL_ID: 2;                                                           
*SOURCE  11 ORGANISM_SCIENTIFIC: HUMAN PAPILLOMAVIRUS TYPE 16;                   
*SOURCE  12 ORGANISM_TAXID: 333760;                                              
*SOURCE  13 GENE: E6;                                                            
*SOURCE  14 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE  15 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    PDZ DOMAIN, ATP-BINDING, CELL JUNCTION, CELL MEMBRANE, MEMBRANE,      
*KEYWDS   2 NUCLEOTIDE-BINDING, PHOSPHOPROTEIN, TIGHT JUNCTION, ACTIVATOR, DNA-  
*KEYWDS   3 BINDING, EARLY PROTEIN, HOST-VIRUS INTERACTION, METAL-BINDING,       
*KEYWDS   4 NUCLEUS, ONCOGENE, TRANSCRIPTION, TRANSCRIPTION REGULATION, ZINC-    
*KEYWDS   5 FINGER, PROTEIN BINDING-ONCOPROTEIN COMPLEX                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.CHARBONNIER, Y.NOMINE, J.RAMIREZ, K.LUCK, R.H.STOTE, G.TRAVE,       
*AUTHOR   2 B.KIEFFER, R.A.ATKINSON                                              
*REVDAT   1   27-OCT-10 2KPL    0                                                


assign  ((resid   27 and name HB1  )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   27 and name HB2  )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   27 and name HB1  )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   27 and name HB2  )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   84 and name HB1  )) ((resid  161 and name HB   ))   5.00  3.20  0.00 
assign  ((resid   84 and name HB2  )) ((resid  161 and name HB   ))   5.00  3.20  0.00 
assign  ((resid   84 and name HB1  )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   84 and name HB2  )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   84 and name HB1  )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   84 and name HB2  )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HG1* )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HG2* )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HB   )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HG1* )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HG2* )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HB   )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   31 and name HG1* )) ((resid  159 and name HB   ))   5.00  3.20  0.00 
assign  ((resid   31 and name HG2* )) ((resid  159 and name HB   ))   5.00  3.20  0.00 
assign  ((resid   31 and name HB   )) ((resid  159 and name HB   ))   5.00  3.20  0.00 
assign  ((resid   81 and name HA   )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   81 and name HB   )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   81 and name HB   )) ((resid  159 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   81 and name HG1* )) ((resid  159 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   81 and name HG2* )) ((resid  159 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   81 and name HG2* )) ((resid  159 and name HB   ))   5.00  3.20  0.00 
assign  ((resid   80 and name HA   )) ((resid  159 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   80 and name HG2* )) ((resid  161 and name HG1* ))   5.00  3.20  0.00 
assign  ((resid   80 and name HG2* )) ((resid  161 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid   32 and name HG1* )) ((resid  158 and name HA   ))   5.00  3.20  0.00 
assign  ((resid   32 and name HG1* )) ((resid  158 and name HB*  ))   5.00  3.20  0.00 
assign  ((resid   32 and name HG1* )) ((resid  158 and name HG*  ))   5.00  3.20  0.00 
assign  ((resid   30 and name HG2* )) ((resid  160 and name HA   ))   5.00  3.20  0.00 
assign  ((resid   30 and name HG2* )) ((resid  161 and name HA   ))   5.00  3.20  0.00 
assign  ((resid   30 and name HA   )) ((resid  160 and name HA   ))   5.00  3.20  0.00 
assign  ((resid   30 and name HA   )) ((resid  160 and name HB*  ))   5.00  3.20  0.00 
assign  ((resid   47 and name HG2* )) ((resid  160 and name HB*  ))   5.00  3.20  0.00 
assign  ((resid   47 and name HG2* )) ((resid  160 and name HG*  ))   5.00  3.20  0.00 
assign  ((resid  115 and name HG*  )) ((resid  155 and name HA   ))   5.00  3.20  0.00 
assign  ((resid  115 and name HG*  )) ((resid  155 and name HB   ))   5.00  3.20  0.00 
assign  ((resid  115 and name HG*  )) ((resid  155 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid  114 and name HD1* )) ((resid  155 and name HA   ))   5.00  3.20  0.00 
assign  ((resid  114 and name HD1* )) ((resid  156 and name HG*  ))   5.00  3.20  0.00 
assign  ((resid  114 and name HD2* )) ((resid  155 and name HA   ))   5.00  3.20  0.00 
assign  ((resid  114 and name HD2* )) ((resid  155 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid  114 and name HD2* )) ((resid  156 and name HG*  ))   5.00  3.20  0.00 
assign  ((resid  113 and name HB1* )) ((resid  155 and name HA   ))   5.00  3.20  0.00 
assign  ((resid  113 and name HB1* )) ((resid  155 and name HG2* ))   5.00  3.20  0.00 
assign  ((resid  113 and name HB2* )) ((resid  155 and name HA   ))   5.00  3.20  0.00 
assign  ((resid  113 and name HB2* )) ((resid  155 and name HG2* ))   5.00  3.20  0.00 
 assign (resid 161 and name HN) (resid 29 and name O)  1.80  0.00  0.50   
 assign (resid 161 and name N ) (resid 29 and name O)  2.80  0.00  0.50
 assign (resid 159 and name HN) (resid 31 and name O)  1.80  0.00  0.50   
 assign (resid 159 and name N ) (resid 31 and name O)  2.80  0.00  0.50
 assign (resid 157 and name HN) (resid 33 and name O)  1.80  0.00  0.50   
 assign (resid 157 and name N ) (resid 33 and name O)  2.80  0.00  0.50
 assign (resid 10 and name HN)  (resid 7  and name O)  1.80  0.00  0.50   
 assign (resid 10 and name N )  (resid 7  and name O)  2.80  0.00  0.50
 assign (resid 11 and name HN)  (resid 7  and name O)  1.80  0.00  0.50
 assign (resid 11 and name N )  (resid 7  and name O)  2.80  0.00  0.50
 assign (resid 16 and name HN)  (resid 97 and name O)  1.80  0.00  0.50
 assign (resid 16 and name N )  (resid 97 and name O)  2.80  0.00  0.50
 assign (resid 18 and name HN)  (resid 95 and name O)  1.80  0.00  0.50
 assign (resid 18 and name N )  (resid 95 and name O)  2.80  0.00  0.50
 assign (resid 20 and name HN)  (resid 93 and name O)  1.80  0.00  0.50
 assign (resid 20 and name N )  (resid 93 and name O)  2.80  0.00  0.50
 assign (resid 22 and name HN)  (resid 91 and name O)  1.80  0.00  0.50
 assign (resid 22 and name N )  (resid 91 and name O)  2.80  0.00  0.50
 assign (resid 23 and name HN)  (resid 26 and name O)  1.80  0.00  0.50
 assign (resid 23 and name N )  (resid 26 and name O)  2.80  0.00  0.50
 assign (resid 28 and name HN)  (resid 161 and name OT1)  1.80  0.00  0.50
 assign (resid 28 and name N )  (resid 161 and name OT1)  2.80  0.00  0.50
 assign (resid 29 and name HN)  (resid 161 and name OT2)  1.80  0.00  0.50
 assign (resid 29 and name N )  (resid 161 and name OT2)  2.80  0.00  0.50
 assign (resid 30 and name HN)  (resid 45 and name O)  1.80  0.00  0.50 
 assign (resid 30 and name N )  (resid 45 and name O)  2.80  0.00  0.50  
 assign (resid 31 and name HN)  (resid 159 and name O) 1.80  0.00  0.50
 assign (resid 31 and name N )  (resid 159 and name O) 2.80  0.00  0.50
 assign (resid 32 and name HN)  (resid 42 and name O)  1.80  0.00  0.50 
 assign (resid 32 and name N )  (resid 42 and name O)  2.80  0.00  0.50 
 assign (resid 33 and name HN)  (resid 157 and name O) 1.80  0.00  0.50 
 assign (resid 33 and name N )  (resid 157 and name O) 2.80  0.00  0.50 
 assign (resid 34 and name HN)  (resid 40 and name O)  1.80  0.00  0.50
 assign (resid 34 and name N )  (resid 40 and name O)  2.80  0.00  0.50
 assign (resid 36 and name HN)  (resid 39 and name O)  1.80  0.00  0.50
 assign (resid 36 and name N )  (resid 39 and name O)  2.80  0.00  0.50
 assign (resid 39 and name HN)  (resid 36 and name O)  1.80  0.00  0.50
 assign (resid 39 and name N )  (resid 36 and name O)  2.80  0.00  0.50
 assign (resid 41 and name HN)  (resid 64 and name O)  1.80  0.00  0.50
 assign (resid 41 and name N )  (resid 64 and name O)  2.80  0.00  0.50
 assign (resid 42 and name HN)  (resid 32 and name O)  1.80  0.00  0.50 
 assign (resid 42 and name N )  (resid 32 and name O)  2.80  0.00  0.50 
 assign (resid 43 and name HN)  (resid 62 and name O)  1.80  0.00  0.50
 assign (resid 43 and name N )  (resid 62 and name O)  2.80  0.00  0.50
 assign (resid 44 and name HN)  (resid 30 and name O)  1.80  0.00  0.50 
 assign (resid 44 and name N )  (resid 30 and name O)  2.80  0.00  0.50  
 assign (resid 45 and name HN)  (resid 30 and name O)  1.80  0.00  0.50 
 assign (resid 45 and name N )  (resid 30 and name O)  2.80  0.00  0.50 
 assign (resid 47 and name HN)  (resid 28 and name O)  1.80  0.00  0.50 
 assign (resid 47 and name N )  (resid 28 and name O)  2.80  0.00  0.50 
 assign (resid 50 and name HN)  (resid 47 and name O)  1.80  0.00  0.50
 assign (resid 50 and name HN)  (resid 47 and name O)  2.80  0.00  0.50
 assign (resid 53 and name HN)  (resid 50 and name O)  1.80  0.00  0.50 
 assign (resid 53 and name HN)  (resid 50 and name O)  2.80  0.00  0.50
 assign (resid 54 and name HN)  (resid 50 and name O)  1.80  0.00  0.50
 assign (resid 54 and name HN)  (resid 50 and name O)  2.80  0.00  0.50
 assign (resid 55 and name HN)  (resid 51 and name O)  1.80  0.00  0.50
 assign (resid 55 and name HN)  (resid 51 and name O)  2.80  0.00  0.50
 assign (resid 56 and name HN)  (resid 52 and name O)  1.80  0.00  0.50
 assign (resid 56 and name HN)  (resid 52 and name O)  2.80  0.00  0.50
 assign (resid 59 and name HN)  (resid 62 and name OD1)  1.80  0.00  0.50 
 assign (resid 59 and name N )  (resid 62 and name OD1)  2.80  0.00  0.50 
 assign (resid 61 and name HN)  (resid 43 and name O)  1.80  0.00  0.50
 assign (resid 61 and name N )  (resid 43 and name O)  2.80  0.00  0.50
 assign (resid 62 and name HN)  (resid 59 and name O)  1.80  0.00  0.50
 assign (resid 62 and name N )  (resid 59 and name O)  2.80  0.00  0.50
 assign (resid 63 and name HN)  (resid 98 and name O)  1.80  0.00  0.50
 assign (resid 63 and name N )  (resid 98 and name O)  2.80  0.00  0.50
 assign (resid 64 and name HN)  (resid 41 and name O)  1.80  0.00  0.50
 assign (resid 64 and name N )  (resid 41 and name O)  2.80  0.00  0.50
 assign (resid 65 and name HN)  (resid 96 and name O)  1.80  0.00  0.50
 assign (resid 65 and name N )  (resid 96 and name O)  2.80  0.00  0.50
 assign (resid 66 and name HN)  (resid 96 and name O)  1.80  0.00  0.50
 assign (resid 66 and name N )  (resid 96 and name O)  2.80  0.00  0.50
 assign (resid 67 and name HN)  (resid 70 and name O)  1.80  0.00  0.50
 assign (resid 67 and name N )  (resid 70 and name O)  2.80  0.00  0.50
 assign (resid 68 and name HN)  (resid 94 and name O)  1.80  0.00  0.50
 assign (resid 68 and name N )  (resid 94 and name O)  2.80  0.00  0.50
 assign (resid 70 and name HN)  (resid 67 and name O)  1.80  0.00  0.50
 assign (resid 70 and name N )  (resid 67 and name O)  2.80  0.00  0.50
 assign (resid 75 and name HN)  (resid 72 and name O)  1.80  0.00  0.50
 assign (resid 75 and name N )  (resid 72 and name O)  2.80  0.00  0.50
 assign (resid 77 and name HN)  (resid 34 and name O)  1.80  0.00  0.50
 assign (resid 77 and name N )  (resid 34 and name O)  2.80  0.00  0.50
 assign (resid 79 and name HN)  (resid 76 and name O)  1.80  0.00  0.50
 assign (resid 79 and name N )  (resid 76 and name O)  2.80  0.00  0.50
 assign (resid 80 and name HN)  (resid 76 and name O)  1.80  0.00  0.50
 assign (resid 80 and name N )  (resid 76 and name O)  2.80  0.00  0.50
 assign (resid 81 and name HN)  (resid 77 and name O)  1.80  0.00  0.50
 assign (resid 81 and name N )  (resid 77 and name O)  2.80  0.00  0.50
 assign (resid 82 and name HN)  (resid 78 and name O)  1.80  0.00  0.50
 assign (resid 82 and name N )  (resid 78 and name O)  2.80  0.00  0.50
 assign (resid 83 and name HN)  (resid 79 and name O)  1.80  0.00  0.50
 assign (resid 83 and name N )  (resid 79 and name O)  2.80  0.00  0.50
 assign (resid 84 and name HN)  (resid 80 and name O)  1.80  0.00  0.50
 assign (resid 84 and name N )  (resid 80 and name O)  2.80  0.00  0.50
 assign (resid 85 and name HN)  (resid 81 and name O)  1.80  0.00  0.50
 assign (resid 85 and name N )  (resid 81 and name O)  2.80  0.00  0.50
 assign (resid 86 and name HN)  (resid 82 and name O)  1.80  0.00  0.50
 assign (resid 86 and name N )  (resid 82 and name O)  2.80  0.00  0.50
 assign (resid 87 and name HN)  (resid 83 and name O)  1.80  0.00  0.50
 assign (resid 87 and name N )  (resid 83 and name O)  2.80  0.00  0.50
 assign (resid 90 and name HN)  (resid 22 and name O)  1.80  0.00  0.50
 assign (resid 90 and name N )  (resid 22 and name O)  2.80  0.00  0.50
 assign (resid 91 and name HN)  (resid 22 and name O)  1.80  0.00  0.50
 assign (resid 91 and name N )  (resid 22 and name O)  2.80  0.00  0.50
 assign (resid 93 and name HN)  (resid 20 and name O)  1.80  0.00  0.50
 assign (resid 93 and name N )  (resid 20 and name O)  2.80  0.00  0.50
 assign (resid 95 and name HN)  (resid 18 and name O)  1.80  0.00  0.50
 assign (resid 95 and name N )  (resid 18 and name O)  2.80  0.00  0.50
 assign (resid 97 and name HN)  (resid 16 and name O)  1.80  0.00  0.50
 assign (resid 97 and name N )  (resid 16 and name O)  2.80  0.00  0.50
 assign (resid 99 and name HN)  (resid 14 and name O)  1.80  0.00  0.50
 assign (resid 99 and name N )  (resid 14 and name O)  2.80  0.00  0.50
! P 2   Phi Psi
assign (resid  1 and name C ) (resid  2 and name N)
       (resid  2 and name CA) (resid  2 and name C) 1.0   -73.44    36.18  2
assign (resid  2 and name N) (resid  2 and name CA)
       (resid  2 and name C) (resid  3 and name  N) 1.0   136.87    32.40  2
! F 3   Phi Psi
assign (resid  2 and name C ) (resid  3 and name N)
       (resid  3 and name CA) (resid  3 and name C) 1.0   -85.57    26.50  2
assign (resid  3 and name N) (resid  3 and name CA)
       (resid  3 and name C) (resid  4 and name  N) 1.0   131.13    23.36  2
! F 4   Phi Psi
assign (resid  3 and name C ) (resid  4 and name N)
       (resid  4 and name CA) (resid  4 and name C) 1.0  -107.62    38.98  2
assign (resid  4 and name N) (resid  4 and name CA)
       (resid  4 and name C) (resid  5 and name  N) 1.0   133.08    27.70  2
! N 7   Phi Psi
assign (resid  6 and name C ) (resid  7 and name N)
       (resid  7 and name CA) (resid  7 and name C) 1.0   -86.08    47.26  2
assign (resid  7 and name N) (resid  7 and name CA)
       (resid  7 and name C) (resid  8 and name  N) 1.0   126.68    25.32  2
! K 14  Phi Psi
assign (resid  13 and name C ) (resid  14 and name N)
       (resid  14 and name CA) (resid  14 and name C) 1.0  -115.98    51.56  2
assign (resid  14 and name N) (resid  14 and name CA)
       (resid  14 and name C) (resid  15 and name  N) 1.0   124.86    33.34  2
! F 15  Phi Psi
assign (resid  14 and name C ) (resid  15 and name N)
       (resid  15 and name CA) (resid  15 and name C) 1.0  -101.01    20.16  2
assign (resid  15 and name N) (resid  15 and name CA)
       (resid  15 and name C) (resid  16 and name  N) 1.0   124.97    13.16  2
! I 16  Phi Psi
assign (resid  15 and name C ) (resid  16 and name N)
       (resid  16 and name CA) (resid  16 and name C) 1.0  -126.38    33.12  2
assign (resid  16 and name N) (resid  16 and name CA)
       (resid  16 and name C) (resid  17 and name  N) 1.0   132.99    18.74  2
! H 17  Phi Psi
assign (resid  16 and name C ) (resid  17 and name N)
       (resid  17 and name CA) (resid  17 and name C) 1.0  -106.01    28.14  2
assign (resid  17 and name N) (resid  17 and name CA)
       (resid  17 and name C) (resid  18 and name  N) 1.0   122.52    21.84  2
! T 18  Phi Psi
assign (resid  17 and name C ) (resid  18 and name N)
       (resid  18 and name CA) (resid  18 and name C) 1.0  -115.37    24.90  2
assign (resid  18 and name N) (resid  18 and name CA)
       (resid  18 and name C) (resid  19 and name  N) 1.0   125.61    25.68  2
! K 19  Phi Psi
assign (resid  18 and name C ) (resid  19 and name N)
       (resid  19 and name CA) (resid  19 and name C) 1.0  -106.86    33.02  2
assign (resid  19 and name N) (resid  19 and name CA)
       (resid  19 and name C) (resid  20 and name  N) 1.0   135.04    19.36  2
! L 20  Phi Psi
assign (resid  19 and name C ) (resid  20 and name N)
       (resid  20 and name CA) (resid  20 and name C) 1.0  -129.43    21.46  2
assign (resid  20 and name N) (resid  20 and name CA)
       (resid  20 and name C) (resid  21 and name  N) 1.0   145.88    28.92  2
! R 21  Phi Psi
assign (resid  20 and name C ) (resid  21 and name N)
       (resid  21 and name CA) (resid  21 and name C) 1.0   -93.29    28.32  2
assign (resid  21 and name N) (resid  21 and name CA)
       (resid  21 and name C) (resid  22 and name  N) 1.0   118.70    27.90  2
! K 22  Phi Psi
assign (resid  21 and name C ) (resid  22 and name N)
       (resid  22 and name CA) (resid  22 and name C) 1.0   -90.80    65.74  2
assign (resid  22 and name N) (resid  22 and name CA)
       (resid  22 and name C) (resid  23 and name  N) 1.0   122.14    31.42  2
! F 29  Phi Psi
assign (resid  28 and name C ) (resid  29 and name N)
       (resid  29 and name CA) (resid  29 and name C) 1.0  -136.13    24.30  2
assign (resid  29 and name N) (resid  29 and name CA)
       (resid  29 and name C) (resid  30 and name  N) 1.0   154.95    11.22  2
! T 30  Phi Psi
assign (resid  29 and name C ) (resid  30 and name N)
       (resid  30 and name CA) (resid  30 and name C) 1.0  -125.53    25.98  2
assign (resid  30 and name N) (resid  30 and name CA)
       (resid  30 and name C) (resid  31 and name  N) 1.0   154.57    17.56  2
! V 31  Phi Psi
assign (resid  30 and name C ) (resid  31 and name N)
       (resid  31 and name CA) (resid  31 and name C) 1.0  -131.33    17.16  2
assign (resid  31 and name N) (resid  31 and name CA)
       (resid  31 and name C) (resid  32 and name  N) 1.0   150.88    32.00  2
! V 32  Phi Psi
assign (resid  31 and name C ) (resid  32 and name N)
       (resid  32 and name CA) (resid  32 and name C) 1.0  -137.57    21.48  2
assign (resid  32 and name N) (resid  32 and name CA)
       (resid  32 and name C) (resid  33 and name  N) 1.0   157.19    22.98  2
! E 36  Phi Psi
assign (resid  35 and name C ) (resid  36 and name N)
       (resid  36 and name CA) (resid  36 and name C) 1.0  -111.91    45.06  2
assign (resid  36 and name N) (resid  36 and name CA)
       (resid  36 and name C) (resid  37 and name  N) 1.0   140.56    57.48  2
! E 39  Phi Psi
assign (resid  38 and name C ) (resid  39 and name N)
       (resid  39 and name CA) (resid  39 and name C) 1.0  -114.58    23.96  2
assign (resid  39 and name N) (resid  39 and name CA)
       (resid  39 and name C) (resid  40 and name  N) 1.0   145.27    24.56  2
! F 40  Phi Psi
assign (resid  39 and name C ) (resid  40 and name N)
       (resid  40 and name CA) (resid  40 and name C) 1.0  -109.31    38.46  2
assign (resid  40 and name N) (resid  40 and name CA)
       (resid  40 and name C) (resid  41 and name  N) 1.0   129.21    32.04  2
! L 41  Phi Psi
assign (resid  40 and name C ) (resid  41 and name N)
       (resid  41 and name CA) (resid  41 and name C) 1.0   -97.76    14.40  2
assign (resid  41 and name N) (resid  41 and name CA)
       (resid  41 and name C) (resid  42 and name  N) 1.0   123.96    19.70  2
! Q 42  Phi Psi
assign (resid  41 and name C ) (resid  42 and name N)
       (resid  42 and name CA) (resid  42 and name C) 1.0  -133.50    27.84  2
assign (resid  42 and name N) (resid  42 and name CA)
       (resid  42 and name C) (resid  43 and name  N) 1.0   161.52    15.96  2
! I 43  Phi Psi
assign (resid  42 and name C ) (resid  43 and name N)
       (resid  43 and name CA) (resid  43 and name C) 1.0   -97.19    33.06  2
assign (resid  43 and name N) (resid  43 and name CA)
       (resid  43 and name C) (resid  44 and name  N) 1.0   117.86    21.82  2
! S 45  Phi Psi
assign (resid  44 and name C ) (resid  45 and name N)
       (resid  45 and name CA) (resid  45 and name C) 1.0  -141.47    45.76  2
assign (resid  45 and name N) (resid  45 and name CA)
       (resid  45 and name C) (resid  46 and name  N) 1.0   157.10    28.76  2
! V 47  Phi Psi
assign (resid  46 and name C ) (resid  47 and name N)
       (resid  47 and name CA) (resid  47 and name C) 1.0   -80.55    37.78  2
assign (resid  47 and name N) (resid  47 and name CA)
       (resid  47 and name C) (resid  48 and name  N) 1.0   127.24    26.76  2
! P 51  Phi Psi
assign (resid  50 and name C ) (resid  51 and name N)
       (resid  51 and name CA) (resid  51 and name C) 1.0   -57.13    14.22  2
assign (resid  51 and name N) (resid  51 and name CA)
       (resid  51 and name C) (resid  52 and name  N) 1.0   -35.40     8.18  2
! A 52  Phi Psi
assign (resid  51 and name C ) (resid  52 and name N)
       (resid  52 and name CA) (resid  52 and name C) 1.0   -66.74     8.18  2
assign (resid  52 and name N) (resid  52 and name CA)
       (resid  52 and name C) (resid  53 and name  N) 1.0   -36.36    16.12  2
! A 53  Phi Psi
assign (resid  52 and name C ) (resid  53 and name N)
       (resid  53 and name CA) (resid  53 and name C) 1.0   -67.09     7.74  2
assign (resid  53 and name N) (resid  53 and name CA)
       (resid  53 and name C) (resid  54 and name  N) 1.0   -39.20    15.92  2
! L 54  Phi Psi
assign (resid  53 and name C ) (resid  54 and name N)
       (resid  54 and name CA) (resid  54 and name C) 1.0   -62.65     8.34  2
assign (resid  54 and name N) (resid  54 and name CA)
       (resid  54 and name C) (resid  55 and name  N) 1.0   -41.57    13.38  2
! D 55  Phi Psi
assign (resid  54 and name C ) (resid  55 and name N)
       (resid  55 and name CA) (resid  55 and name C) 1.0   -69.63    19.56  2
assign (resid  55 and name N) (resid  55 and name CA)
       (resid  55 and name C) (resid  56 and name  N) 1.0   -42.65    26.24  2
! M 58  Phi Psi
assign (resid  57 and name C ) (resid  58 and name N)
       (resid  58 and name CA) (resid  58 and name C) 1.0  -128.39    63.56  2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name  N) 1.0   141.25    30.58  2
! E 59  Phi Psi
assign (resid  58 and name C ) (resid  59 and name N)
       (resid  59 and name CA) (resid  59 and name C) 1.0  -132.33    40.40  2
assign (resid  59 and name N) (resid  59 and name CA)
       (resid  59 and name C) (resid  60 and name  N) 1.0   153.45    12.60  2
! T 60  Phi Psi
assign (resid  59 and name C ) (resid  60 and name N)
       (resid  60 and name CA) (resid  60 and name C) 1.0   -72.63    26.68  2
assign (resid  60 and name N) (resid  60 and name CA)
       (resid  60 and name C) (resid  61 and name  N) 1.0   130.30    15.12  2
! D 62  Phi Psi
assign (resid  61 and name C ) (resid  62 and name N)
       (resid  62 and name CA) (resid  62 and name C) 1.0   -72.23    29.82  2
assign (resid  62 and name N) (resid  62 and name CA)
       (resid  62 and name C) (resid  63 and name  N) 1.0   130.44    30.92  2
! I 64  Phi Psi
assign (resid  63 and name C ) (resid  64 and name N)
       (resid  64 and name CA) (resid  64 and name C) 1.0   -87.38    24.16  2
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name  N) 1.0   119.79    28.78  2
! V 65  Phi Psi
assign (resid  64 and name C ) (resid  65 and name N)
       (resid  65 and name CA) (resid  65 and name C) 1.0   -86.91    22.32  2
assign (resid  65 and name N) (resid  65 and name CA)
       (resid  65 and name C) (resid  66 and name  N) 1.0   -37.93    19.94  2
! S 66  Phi Psi
assign (resid  65 and name C ) (resid  66 and name N)
       (resid  66 and name CA) (resid  66 and name C) 1.0  -156.51    30.44  2
assign (resid  66 and name N) (resid  66 and name CA)
       (resid  66 and name C) (resid  67 and name  N) 1.0   154.86    18.32  2
! T 70  Phi Psi
assign (resid  69 and name C ) (resid  70 and name N)
       (resid  70 and name CA) (resid  70 and name C) 1.0   -99.63    41.82  2
assign (resid  70 and name N) (resid  70 and name CA)
       (resid  70 and name C) (resid  71 and name  N) 1.0   122.22    25.74  2
! L 73  Phi Psi
assign (resid  72 and name C ) (resid  73 and name N)
       (resid  73 and name CA) (resid  73 and name C) 1.0   -60.96    21.90  2
assign (resid  73 and name N) (resid  73 and name CA)
       (resid  73 and name C) (resid  74 and name  N) 1.0   129.18    15.18  2
! T 76  Phi Psi
assign (resid  75 and name C ) (resid  76 and name N)
       (resid  76 and name CA) (resid  76 and name C) 1.0   -94.36    32.54  2
assign (resid  76 and name N) (resid  76 and name CA)
       (resid  76 and name C) (resid  77 and name  N) 1.0   162.59    17.22  2
! H 77  Phi Psi
assign (resid  76 and name C ) (resid  77 and name N)
       (resid  77 and name CA) (resid  77 and name C) 1.0   -59.06     9.76  2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name  N) 1.0   -42.20     8.94  2
! A 78  Phi Psi
assign (resid  77 and name C ) (resid  78 and name N)
       (resid  78 and name CA) (resid  78 and name C) 1.0   -62.39     5.52  2
assign (resid  78 and name N) (resid  78 and name CA)
       (resid  78 and name C) (resid  79 and name  N) 1.0   -37.80     9.06  2
! Q 79  Phi Psi
assign (resid  78 and name C ) (resid  79 and name N)
       (resid  79 and name CA) (resid  79 and name C) 1.0   -66.98    13.38  2
assign (resid  79 and name N) (resid  79 and name CA)
       (resid  79 and name C) (resid  80 and name  N) 1.0   -44.00    12.46  2
! V 80  Phi Psi
assign (resid  79 and name C ) (resid  80 and name N)
       (resid  80 and name CA) (resid  80 and name C) 1.0   -65.97     6.16  2
assign (resid  80 and name N) (resid  80 and name CA)
       (resid  80 and name C) (resid  81 and name  N) 1.0   -42.54     4.76  2
! V 81  Phi Psi
assign (resid  80 and name C ) (resid  81 and name N)
       (resid  81 and name CA) (resid  81 and name C) 1.0   -61.72     9.92  2
assign (resid  81 and name N) (resid  81 and name CA)
       (resid  81 and name C) (resid  82 and name  N) 1.0   -45.54     9.12  2
! K 82  Phi Psi
assign (resid  81 and name C ) (resid  82 and name N)
       (resid  82 and name CA) (resid  82 and name C) 1.0   -60.96    11.70  2
assign (resid  82 and name N) (resid  82 and name CA)
       (resid  82 and name C) (resid  83 and name  N) 1.0   -37.76     9.90  2
! I 83  Phi Psi
assign (resid  82 and name C ) (resid  83 and name N)
       (resid  83 and name CA) (resid  83 and name C) 1.0   -63.00     8.12  2
assign (resid  83 and name N) (resid  83 and name CA)
       (resid  83 and name C) (resid  84 and name  N) 1.0   -44.41     5.76  2
! F 84  Phi Psi
assign (resid  83 and name C ) (resid  84 and name N)
       (resid  84 and name CA) (resid  84 and name C) 1.0   -63.45    10.24  2
assign (resid  84 and name N) (resid  84 and name CA)
       (resid  84 and name C) (resid  85 and name  N) 1.0   -45.66    16.70  2
! Q 85  Phi Psi
assign (resid  84 and name C ) (resid  85 and name N)
       (resid  85 and name CA) (resid  85 and name C) 1.0   -69.19    16.20  2
assign (resid  85 and name N) (resid  85 and name CA)
       (resid  85 and name C) (resid  86 and name  N) 1.0   -35.59    24.72  2
! I 87  Phi Psi
assign (resid  86 and name C ) (resid  87 and name N)
       (resid  87 and name CA) (resid  87 and name C) 1.0   -85.32    45.32  2
assign (resid  87 and name N) (resid  87 and name CA)
       (resid  87 and name C) (resid  88 and name  N) 1.0   125.06    33.18  2
! I 89  Phi Psi
assign (resid  88 and name C ) (resid  89 and name N)
       (resid  89 and name CA) (resid  89 and name C) 1.0   -57.13    10.06  2
assign (resid  89 and name N) (resid  89 and name CA)
       (resid  89 and name C) (resid  90 and name  N) 1.0   133.39     9.40  2
! G 90  Phi Psi
assign (resid  89 and name C ) (resid  90 and name N)
       (resid  90 and name CA) (resid  90 and name C) 1.0    90.77    24.94  2
assign (resid  90 and name N) (resid  90 and name CA)
       (resid  90 and name C) (resid  91 and name  N) 1.0   -12.70    22.82  2
! A 91  Phi Psi
assign (resid  90 and name C ) (resid  91 and name N)
       (resid  91 and name CA) (resid  91 and name C) 1.0   -89.60    32.86  2
assign (resid  91 and name N) (resid  91 and name CA)
       (resid  91 and name C) (resid  92 and name  N) 1.0   135.89    53.32  2
! S 92  Phi Psi
assign (resid  91 and name C ) (resid  92 and name N)
       (resid  92 and name CA) (resid  92 and name C) 1.0  -112.99    33.70  2
assign (resid  92 and name N) (resid  92 and name CA)
       (resid  92 and name C) (resid  93 and name  N) 1.0   154.02    15.56  2
! V 93  Phi Psi
assign (resid  92 and name C ) (resid  93 and name N)
       (resid  93 and name CA) (resid  93 and name C) 1.0  -140.41    25.80  2
assign (resid  93 and name N) (resid  93 and name CA)
       (resid  93 and name C) (resid  94 and name  N) 1.0   148.78    19.38  2
! D 94  Phi Psi
assign (resid  93 and name C ) (resid  94 and name N)
       (resid  94 and name CA) (resid  94 and name C) 1.0  -117.33    43.06  2
assign (resid  94 and name N) (resid  94 and name CA)
       (resid  94 and name C) (resid  95 and name  N) 1.0   127.32    18.60  2
! L 95  Phi Psi
assign (resid  94 and name C ) (resid  95 and name N)
       (resid  95 and name CA) (resid  95 and name C) 1.0  -126.51    34.22  2
assign (resid  95 and name N) (resid  95 and name CA)
       (resid  95 and name C) (resid  96 and name  N) 1.0   137.13    22.98  2
! E 96  Phi Psi
assign (resid  95 and name C ) (resid  96 and name N)
       (resid  96 and name CA) (resid  96 and name C) 1.0  -108.93    38.40  2
assign (resid  96 and name N) (resid  96 and name CA)
       (resid  96 and name C) (resid  97 and name  N) 1.0   125.29    20.14  2
! L 97  Phi Psi
assign (resid  96 and name C ) (resid  97 and name N)
       (resid  97 and name CA) (resid  97 and name C) 1.0  -120.53    20.74  2
assign (resid  97 and name N) (resid  97 and name CA)
       (resid  97 and name C) (resid  98 and name  N) 1.0   145.29    21.96  2
! C 98  Phi Psi
assign (resid  97 and name C ) (resid  98 and name N)
       (resid  98 and name CA) (resid  98 and name C) 1.0  -120.03    36.64  2
assign (resid  98 and name N) (resid  98 and name CA)
       (resid  98 and name C) (resid  99 and name  N) 1.0   127.12    38.94  2
! R 99  Phi Psi
assign (resid  98 and name C ) (resid  99 and name N)
       (resid  99 and name CA) (resid  99 and name C) 1.0  -113.45    32.94  2
assign (resid  99 and name N) (resid  99 and name CA)
       (resid  99 and name C) (resid  100 and name  N) 1.0   129.60    28.46  2
! Y 101 Phi Psi
assign (resid  100 and name C ) (resid  101 and name N)
       (resid  101 and name CA) (resid  101 and name C) 1.0   -84.50    29.94  2
assign (resid  101 and name N) (resid  101 and name CA)
       (resid  101 and name C) (resid  102 and name  N) 1.0   126.77    34.26  2
! L 103 Phi Psi
assign (resid  102 and name C ) (resid  103 and name N)
       (resid  103 and name CA) (resid  103 and name C) 1.0   -86.09    45.98  2
assign (resid  103 and name N) (resid  103 and name CA)
       (resid  103 and name C) (resid  104 and name  N) 1.0   134.87    63.36  2
! F 105 Phi Psi
assign (resid  104 and name C ) (resid  105 and name N)
       (resid  105 and name CA) (resid  105 and name C) 1.0  -128.78    43.88  2
assign (resid  105 and name N) (resid  105 and name CA)
       (resid  105 and name C) (resid  106 and name  N) 1.0   152.93    31.12  2
! D 106 Phi Psi
assign (resid  105 and name C ) (resid  106 and name N)
       (resid  106 and name CA) (resid  106 and name C) 1.0  -106.12    26.48  2
assign (resid  106 and name N) (resid  106 and name CA)
       (resid  106 and name C) (resid  107 and name  N) 1.0   116.60    43.80  2
! D 109 Phi Psi
assign (resid  108 and name C ) (resid  109 and name N)
       (resid  109 and name CA) (resid  109 and name C) 1.0   -81.45    46.10  2
assign (resid  109 and name N) (resid  109 and name CA)
       (resid  109 and name C) (resid  110 and name  N) 1.0   133.86    24.42  2
! S 113 Phi Psi
assign (resid  112 and name C ) (resid  113 and name N)
       (resid  113 and name CA) (resid  113 and name C) 1.0  -104.24    48.02  2
assign (resid  113 and name N) (resid  113 and name CA)
       (resid  113 and name C) (resid  114 and name  N) 1.0   124.19    21.76  2
! L 114 Phi Psi
assign (resid  113 and name C ) (resid  114 and name N)
       (resid  114 and name CA) (resid  114 and name C) 1.0   -99.47    23.54  2
assign (resid  114 and name N) (resid  114 and name CA)
       (resid  114 and name C) (resid  115 and name  N) 1.0   121.67    14.90  2
! V 115 Phi Psi
assign (resid  114 and name C ) (resid  115 and name N)
       (resid  115 and name CA) (resid  115 and name C) 1.0  -108.19    15.16  2
assign (resid  115 and name N) (resid  115 and name CA)
       (resid  115 and name C) (resid  116 and name  N) 1.0   115.09    15.98  2
! T 116 Phi Psi
assign (resid  115 and name C ) (resid  116 and name N)
       (resid  116 and name CA) (resid  116 and name C) 1.0  -111.07    39.82  2
assign (resid  116 and name N) (resid  116 and name CA)
       (resid  116 and name C) (resid  117 and name  N) 1.0   125.89    24.94  2
! S 117 Phi Psi
assign (resid  116 and name C ) (resid  117 and name N)
       (resid  117 and name CA) (resid  117 and name C) 1.0  -127.97    55.40  2
assign (resid  117 and name N) (resid  117 and name CA)
       (resid  117 and name C) (resid  118 and name  N) 1.0   140.76    49.90  2
! V 118 Phi Psi
assign (resid  117 and name C ) (resid  118 and name N)
       (resid  118 and name CA) (resid  118 and name C) 1.0  -113.65    19.78  2
assign (resid  118 and name N) (resid  118 and name CA)
       (resid  118 and name C) (resid  119 and name  N) 1.0   130.11    28.34  2
! A 119 Phi Psi
assign (resid  118 and name C ) (resid  119 and name N)
       (resid  119 and name CA) (resid  119 and name C) 1.0  -115.15    47.90  2
assign (resid  119 and name N) (resid  119 and name CA)
       (resid  119 and name C) (resid  120 and name  N) 1.0   120.07    45.04  2
! E 124 Phi Psi
assign (resid  123 and name C ) (resid  124 and name N)
       (resid  124 and name CA) (resid  124 and name C) 1.0   -76.25    21.04  2
assign (resid  124 and name N) (resid  124 and name CA)
       (resid  124 and name C) (resid  125 and name  N) 1.0   135.45    38.58  2
-1    6.3521136e-10   1.8576764e-10   4.1825208e-11
0    8.0800423e-10   2.2792419e-10   3.7321745e-11
1    1.4255249e-09   2.3804707e-10   2.2482174e-11
3    3.1533532e-09   2.5427018e-10   6.0145063e-12
4    3.4442003e-09   2.5012674e-10   4.6536919e-12
6    3.7466185e-09   2.4534216e-10   3.7419002e-12
7    3.8679210e-09   2.4809218e-10   4.1177143e-12
9    3.5539779e-09   2.7706428e-10   3.9899666e-12
10    3.6911345e-09   2.5899389e-10   3.4338803e-12
11    3.8422251e-09   2.4016049e-10   3.5401591e-12
12    3.3176180e-09   2.4541162e-10   4.5979094e-12
13    1.6480527e-09   1.4133761e-10   1.0472673e-11
14    3.0410781e-09   2.1553467e-10   5.3804150e-12
15    3.4413845e-09   2.3212214e-10   4.3878116e-12
16    3.5516330e-09   2.3894726e-10   4.1613125e-12
17    3.6781054e-09   2.4488155e-10   5.5694046e-12
18    3.6883638e-09   2.5473471e-10   3.6862456e-12
19    3.5441009e-09   2.4590494e-10   4.2991252e-12
20    2.8423413e-09   2.5957358e-10   8.1243497e-12
21    3.3388192e-09   2.4343552e-10   3.6875303e-12
22    3.8232434e-09   2.5628204e-10   4.3329147e-12
23    4.2321507e-09   2.5495554e-10   3.1890014e-12
25    3.7953264e-09   2.8089464e-10   5.9144004e-12
26    4.1585750e-09   2.4709798e-10   4.4465440e-12
28    3.7258278e-09   2.6539647e-10   4.3488709e-12
29    3.9987323e-09   2.7638860e-10   3.2021872e-12
30    4.5913876e-09   2.6056039e-10   3.7480265e-12
31    4.6509121e-09   2.7479352e-10   3.4952500e-12
32    5.3268910e-09   2.5677386e-10   4.1471849e-12
33    4.0695804e-09   2.7686585e-10   5.2903195e-12
34    3.6912017e-09   2.3078090e-10   5.5425967e-12
35    3.6650004e-09   2.8171389e-10   5.6068185e-12
36    3.0685430e-09   2.4995579e-10   6.3326830e-12
38    3.3855126e-09   2.3609718e-10   5.9113253e-12
39    3.6637916e-09   2.4375228e-10   4.9285041e-12
40    3.3368005e-09   2.4799600e-10   6.7715903e-12
41    3.7319628e-09   2.5861603e-10   3.6695851e-12
42    3.5903046e-09   2.5328316e-10   3.6104276e-12
43    3.6594320e-09   2.4699516e-10   3.8067559e-12
44    4.5122028e-09   2.5092938e-10   3.8121398e-12
45    5.2041956e-09   2.5528542e-10   5.2636392e-12
46    3.6673783e-09   2.4467928e-10   3.8177297e-12
47    3.6035588e-09   2.5300720e-10   3.8864737e-12
48    3.8181030e-09   2.4563258e-10   4.1948553e-12
49    4.5420635e-09   2.3007203e-10   4.0233932e-12
50    3.8427680e-09   2.5007242e-10   4.4619050e-12
52    3.6708250e-09   2.6184833e-10   3.3446038e-12
53    3.8662723e-09   2.7409442e-10   3.3882347e-12
54    3.4081040e-09   2.5466865e-10   5.3898504e-12
55    3.7440203e-09   2.7022793e-10   3.8565467e-12
56    3.7746202e-09   2.5524634e-10   4.3172333e-12
57    3.4731068e-09   2.4162041e-10   3.8758619e-12
58    3.5868708e-09   2.3750904e-10   5.1949296e-12
59    3.7082139e-09   2.5030400e-10   3.6661416e-12
60    3.6942024e-09   2.4605220e-10   3.6815511e-12
61    4.1620747e-09   2.5349275e-10   3.8543625e-12
62    4.1537832e-09   2.7382486e-10   3.7138186e-12
63    3.6740097e-09   2.7435005e-10   4.1118738e-12
64    4.0962888e-09   2.5460465e-10   3.6574901e-12
65    3.9665730e-09   2.5434706e-10   3.1183291e-12
66    3.6776418e-09   2.5791356e-10   3.1291310e-12
67    3.7354484e-09   2.5376488e-10   4.1145247e-12
68    4.9327441e-09   2.5798774e-10   4.5471124e-12
69    8.5512678e-09   2.3296863e-10   5.8118912e-12
70    3.5987151e-09   2.4346317e-10   4.5343237e-12
71    3.8085735e-09   2.6970071e-10   4.2075190e-12
72    3.7215982e-09   2.6748647e-10   3.7251161e-12
73    3.9383805e-09   2.6268478e-10   3.8266254e-12
74    4.5795029e-09   2.6329381e-10   5.3088030e-12
75    4.0492667e-09   2.7200487e-10   4.0043107e-12
76    3.7196887e-09   2.5519007e-10   3.5896285e-12
77    4.0094111e-09   2.5318754e-10   2.6486358e-12
78    4.0781489e-09   2.4556104e-10   3.3931848e-12
79    4.1382611e-09   2.4377020e-10   4.2446041e-12
80    4.1445723e-09   2.4387258e-10   3.6944888e-12
81    4.9171313e-09   2.4263554e-10   4.2627884e-12
82    4.2951038e-09   2.3762359e-10   3.5446638e-12
83    4.2512259e-09   2.3652443e-10   3.7727117e-12
84    4.1455625e-09   2.3244190e-10   3.3231554e-12
85    5.7243569e-09   2.2932910e-10   3.3168493e-12
86    4.9819225e-09   2.5089708e-10   3.7602414e-12
87    4.2585956e-09   2.4602128e-10   3.7903254e-12
89    3.4873211e-09   2.3605577e-10   3.8335519e-12
90    4.1189157e-09   2.4807605e-10   3.5137859e-12
91    3.8300011e-09   2.6077082e-10   3.5470463e-12
92    3.4317277e-09   2.2562406e-10   3.8200935e-12
93    3.4323738e-09   2.6081075e-10   4.4646339e-12
94    3.5917040e-09   2.5148454e-10   4.6641311e-12
95    4.2062233e-09   2.3987265e-10   3.9638361e-12
96    1.8760698e-09   2.4397172e-10   1.0262141e-11
97    3.9411762e-09   2.5043889e-10   3.2958081e-12
98    3.6316288e-09   2.4473828e-10   3.5561904e-12
99    4.3607564e-09   2.5376771e-10   3.9498808e-12
100    3.6972962e-09   2.5197260e-10   4.2254295e-12
101    3.8715810e-09   2.4710512e-10   3.7039443e-12
103    3.4646015e-09   2.4084343e-10   5.0797645e-12
105    1.0627611e-08   2.7983671e-10   4.2152718e-12
106    6.4456778e-09   2.6825826e-10   7.3196127e-12
108    3.2653269e-09   2.4222771e-10   9.2268707e-12
109    3.0433661e-09   2.4594188e-10   8.7676558e-12
111    3.4028358e-09   2.6614068e-10   8.7107890e-12
112    6.2085928e-09   2.7030964e-10   1.1417135e-11
113    6.4073977e-09   2.8654373e-10   1.3047302e-11
114    3.8708367e-09   2.6075040e-10   1.0392577e-11
115    4.1139359e-09   2.4944909e-10   5.2257717e-12
116    7.3527748e-09   2.7249504e-10   1.0489867e-11
117    3.1590489e-09   2.7533031e-10   7.9811191e-12
118    3.2085287e-09   2.4740398e-10   8.8595889e-12
119    1.1051424e-08   2.7726217e-10   8.3078763e-12
120    3.0239648e-09   2.3289776e-10   9.0316030e-12
121    3.0070487e-09   2.0399892e-10   2.7172957e-11
122    2.6800545e-09   2.5951375e-10   1.1011611e-11
123    9.6985618e-10   2.4905357e-10   2.2566294e-11
124    5.3540321e-10   2.2329508e-10   3.2671564e-11
assign  ((resid   68 and name HN   )) ((resid   95 and name HA   ))   4.94  3.14  0.00 ! #SUP  5.17
assign  ((resid   31 and name HB   )) ((resid   42 and name HN   ))   4.76  2.96  0.00 ! #SUP  2.69
assign  ((resid   65 and name HG2* )) ((resid   97 and name HN   ))   5.33  3.53  0.00 ! #SUP  1.32
assign  ((resid   41 and name HN   )) ((resid   41 and name HD2* ))   5.11  3.31  0.00 ! #SUP  6.72
assign  ((resid   40 and name HB1  )) ((resid   41 and name HN   ))   5.09  3.29  0.00 ! #SUP  6.46
assign  ((resid   32 and name HN   )) ((resid   41 and name HA   ))   4.64  2.84  0.00 ! #SUP  2.31
assign  ((resid   22 and name HE*  )) ((resid   93 and name HN   ))   4.11  2.31  0.00 ! #SUP  2.46
assign  ((resid   70 and name HB   )) ((resid   71 and name HN   ))   4.09  2.29  0.00 ! #SUP  4.69
assign  ((resid   65 and name HG2* )) ((resid   98 and name HN   ))   4.62  2.82  0.00 ! #SUP  4.56
assign  ((resid   98 and name HN   )) ((resid   99 and name HN   ))   4.78  2.98  0.00 ! #SUP  3.37
assign  ((resid   15 and name HN   )) ((resid   15 and name HD*  ))   4.08  2.28  0.00 ! #SUP  6.70
assign  ((resid   15 and name HD*  )) ((resid   16 and name HN   ))   5.24  3.44  0.00 ! #SUP  6.13
assign  ((resid   35 and name HN   )) ((resid   35 and name HB2  ))   3.90  2.10  0.00 ! #SUP  5.27
assign  ((resid   68 and name HN   )) ((resid   69 and name HN   ))   4.87  3.07  0.00 ! #SUP  5.12
assign  ((resid   48 and name HN   )) ((resid   48 and name HD2* ))   4.68  2.88  0.00 ! #SUP  7.41
assign  ((resid   22 and name HN   )) ((resid   87 and name HD1* ))   4.59  2.79  0.00 ! #SUP  1.38
assign  ((resid   22 and name HN   )) ((resid   51 and name HG1  ))   4.92  3.12  0.00 ! #SUP  1.25
assign  ((resid   21 and name HN   )) ((resid   51 and name HB2  ))   5.03  3.23  0.00 ! #SUP  1.66
assign  ((resid   20 and name HA   )) ((resid   21 and name HN   ))   3.21  1.41  0.00 ! #SUP  8.11
assign  ((resid   16 and name HG2* )) ((resid   17 and name HN   ))   3.87  2.07  0.00 ! #SUP  6.48
assign  ((resid   72 and name HN   )) ((resid   73 and name HN   ))   3.76  1.96  0.00 ! #SUP  6.68
assign  ((resid   46 and name HN   )) ((resid   46 and name HG   ))   4.20  2.40  0.00 ! #SUP  6.17
assign  ((resid   46 and name HN   )) ((resid   47 and name HG2* ))   5.28  3.48  0.00 ! #SUP  6.47
assign  ((resid   76 and name HN   )) ((resid   76 and name HB   ))   4.12  2.32  0.00 ! #SUP  3.94
assign  ((resid   75 and name HB2  )) ((resid   76 and name HN   ))   4.32  2.52  0.00 ! #SUP  5.20
assign  ((resid   76 and name HN   )) ((resid   76 and name HG2* ))   3.88  2.08  0.00 ! #SUP  5.37
assign  ((resid  111 and name HN   )) ((resid  111 and name HB2  ))   4.09  2.29  0.00 ! #SUP  6.23
assign  ((resid  111 and name HN   )) ((resid  111 and name HB1  ))   3.93  2.13  0.00 ! #SUP  6.23
assign  ((resid   46 and name HD2* )) ((resid   60 and name HN   ))   4.19  2.39  0.00 ! #SUP  5.07
assign  ((resid   46 and name HD1* )) ((resid   60 and name HN   ))   4.54  2.74  0.00 ! #SUP  6.29
assign  ((resid   79 and name HB2  )) ((resid   81 and name HN   ))   4.90  3.10  0.00 ! #SUP  3.20
assign  ((resid   56 and name HN   )) ((resid   58 and name HN   ))   4.68  2.88  0.00 ! #SUP  3.43
assign  ((resid   92 and name HN   )) ((resid   92 and name HB*  ))   4.10  2.30  0.00 ! #SUP  4.85
assign  ((resid   11 and name HB1  )) ((resid   12 and name HN   ))   3.94  2.14  0.00 ! #SUP  7.28
assign  ((resid   11 and name HD1* )) ((resid   12 and name HN   ))   4.73  2.93  0.00 ! #SUP  7.63
assign  ((resid   12 and name HN   )) ((resid   12 and name HE*  ))   4.80  3.00  0.00 ! #SUP  6.37
assign  ((resid   66 and name HA   )) ((resid   67 and name HN   ))   3.39  1.59  0.00 ! #SUP  4.43
assign  ((resid   80 and name HN   )) ((resid   83 and name HD1* ))   5.42  3.62  0.00 ! #SUP  3.44
assign  ((resid   34 and name HN   )) ((resid   35 and name HB2  ))   4.36  2.56  0.00 ! #SUP  3.89
assign  ((resid   -1 and name HA   )) ((resid    1 and name HN   ))   3.43  1.63  0.00 ! #SUP  1.39
assign  ((resid  120 and name HN   )) ((resid  121 and name HB*  ))   3.95  2.15  0.00 ! #SUP  4.03
assign  ((resid   66 and name HB*  )) ((resid   96 and name HN   ))   5.26  3.46  0.00 ! #SUP  4.03
assign  ((resid   95 and name HD2* )) ((resid   96 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.18
assign  ((resid   68 and name HD21 )) ((resid   69 and name HN   ))   5.43  3.63  0.00 ! #SUP  6.50
assign  ((resid   19 and name HN   )) ((resid   20 and name HN   ))   5.12  3.32  0.00 ! #SUP  6.54
assign  ((resid  121 and name HD*  )) ((resid  123 and name HN   ))   5.15  3.35  0.00 ! #SUP  2.58
assign  ((resid   68 and name HD21 )) ((resid   94 and name HN   ))   4.99  3.19  0.00 ! #SUP  5.91
assign  ((resid    6 and name HN   )) ((resid    7 and name HD21 ))   4.91  3.11  0.00 ! #SUP  5.54
assign  ((resid   64 and name HD1* )) ((resid   66 and name HN   ))   4.96  3.16  0.00 ! #SUP  3.30
assign  ((resid   42 and name HE21 )) ((resid  103 and name HD1* ))   4.58  2.78  0.00 ! #SUP  0.33
assign  ((resid   65 and name HN   )) ((resid   66 and name HN   ))   3.79  1.99  0.00 ! #SUP  6.69
assign  ((resid   65 and name HG2* )) ((resid   66 and name HN   ))   4.59  2.79  0.00 ! #SUP  6.46
assign  ((resid   29 and name HN   )) ((resid   29 and name HD*  ))   3.98  2.18  0.00 ! #SUP  5.70
assign  ((resid   73 and name HN   )) ((resid   73 and name HG   ))   4.54  2.74  0.00 ! #SUP  6.76
assign  ((resid   55 and name HN   )) ((resid   55 and name HB1  ))   3.96  2.16  0.00 ! #SUP  5.55
assign  ((resid   54 and name HA   )) ((resid   55 and name HN   ))   3.59  1.79  0.00 ! #SUP  7.66
assign  ((resid   49 and name HB1  )) ((resid   50 and name HN   ))   4.15  2.35  0.00 ! #SUP  3.49
assign  ((resid   28 and name HA2  )) ((resid   47 and name HN   ))   4.91  3.11  0.00 ! #SUP  2.97
assign  ((resid   46 and name HN   )) ((resid   47 and name HN   ))   4.25  2.45  0.00 ! #SUP  9.00
assign  ((resid   47 and name HN   )) ((resid   47 and name HB   ))   3.83  2.03  0.00 ! #SUP  5.66
assign  ((resid   46 and name HD2* )) ((resid   47 and name HN   ))   5.22  3.42  0.00 ! #SUP  7.27
assign  ((resid   71 and name HN   )) ((resid   75 and name HE1  ))   4.31  2.51  0.00 ! #SUP  1.49
assign  ((resid   72 and name HA   )) ((resid   75 and name HE1  ))   4.69  2.89  0.00 ! #SUP  2.76
assign  ((resid   70 and name HG2* )) ((resid   75 and name HE1  ))   4.28  2.48  0.00 ! #SUP  0.75
assign  ((resid   72 and name HG*  )) ((resid   75 and name HE1  ))   5.28  3.48  0.00 ! #SUP  4.59
assign  ((resid   27 and name HE*  )) ((resid   84 and name HA   ))   3.70  1.90  0.00 ! #SUP  2.22
assign  ((resid   26 and name HA2  )) ((resid   27 and name HE*  ))   4.08  2.28  0.00 ! #SUP  2.30
assign  ((resid   80 and name HG*  )) ((resid   82 and name HN   ))   4.33  2.53  0.00 ! #SUP  4.44
assign  ((resid   82 and name HN   )) ((resid   83 and name HN   ))   3.27  1.47  0.00 ! #SUP  7.73
assign  ((resid   27 and name HE*  )) ((resid   93 and name HB   ))   4.74  2.94  0.00 ! #SUP  3.68
assign  ((resid   27 and name HE*  )) ((resid   87 and name HG2* ))   4.53  2.73  0.00 ! #SUP  1.71
assign  ((resid   20 and name HD2* )) ((resid   27 and name HE*  ))   4.82  3.02  0.00 ! #SUP  2.63
assign  ((resid   27 and name HE*  )) ((resid   93 and name HG2* ))   4.32  2.52  0.00 ! #SUP  4.51
assign  ((resid   22 and name HG1  )) ((resid   27 and name HE*  ))   5.15  3.35  0.00 ! #SUP  2.03
assign  ((resid   27 and name HE*  )) ((resid  161 and name HG*  ))   5.50  3.70  0.00 ! #SUP  1.64
assign  ((resid   27 and name HE*  )) ((resid   84 and name HZ   ))   4.50  2.70  0.00 ! #SUP  0.36
assign  ((resid   35 and name HB2  )) ((resid   36 and name HN   ))   3.88  2.08  0.00 ! #SUP  6.85
assign  ((resid   34 and name HA2  )) ((resid   36 and name HN   ))   5.10  3.30  0.00 ! #SUP  4.39
assign  ((resid   36 and name HN   )) ((resid   39 and name HB1  ))   4.88  3.08  0.00 ! #SUP  2.00
assign  ((resid   87 and name HN   )) ((resid   88 and name HD2  ))   5.22  3.42  0.00 ! #SUP  6.55
assign  ((resid   22 and name HG2  )) ((resid   23 and name HN   ))   5.41  3.61  0.00 ! #SUP  5.39
assign  ((resid   23 and name HN   )) ((resid   51 and name HG1  ))   4.83  3.03  0.00 ! #SUP  5.41
assign  ((resid   81 and name HG*  )) ((resid   85 and name HE21 ))   3.95  2.15  0.00 ! #SUP  1.33
assign  ((resid    3 and name HE*  )) ((resid   11 and name HD2* ))   4.23  2.43  0.00 ! #SUP  6.11
assign  ((resid    8 and name HD2  )) ((resid   15 and name HZ   ))   4.84  3.04  0.00 ! #SUP  1.34
assign  ((resid   27 and name HZ   )) ((resid   87 and name HG2* ))   3.96  2.16  0.00 ! #SUP  1.98
assign  ((resid   22 and name HD1  )) ((resid   27 and name HZ   ))   4.58  2.78  0.00 ! #SUP  1.72
assign  ((resid   27 and name HZ   )) ((resid   93 and name HG2* ))   5.01  3.21  0.00 ! #SUP  2.00
assign  ((resid   83 and name HN   )) ((resid   84 and name HB1  ))   5.50  3.70  0.00 ! #SUP  7.18
assign  ((resid   15 and name HA   )) ((resid   15 and name HD*  ))   4.52  2.72  0.00 ! #SUP  5.44
assign  ((resid   15 and name HD*  )) ((resid   98 and name HA   ))   4.97  3.17  0.00 ! #SUP  2.02
assign  ((resid   15 and name HD*  )) ((resid   65 and name HG2* ))   4.87  3.07  0.00 ! #SUP  3.01
assign  ((resid    8 and name HB1  )) ((resid   15 and name HD*  ))   3.87  2.07  0.00 ! #SUP  2.69
assign  ((resid   40 and name HD*  )) ((resid   41 and name HN   ))   4.33  2.53  0.00 ! #SUP  7.20
assign  ((resid   40 and name HN   )) ((resid   40 and name HD*  ))   4.53  2.73  0.00 ! #SUP  6.07
assign  ((resid   40 and name HA   )) ((resid   40 and name HD*  ))   3.52  1.72  0.00 ! #SUP  5.83
assign  ((resid    9 and name HA   )) ((resid   15 and name HD*  ))   3.97  2.17  0.00 ! #SUP  1.81
assign  ((resid   40 and name HD*  )) ((resid   73 and name HD1* ))   4.13  2.33  0.00 ! #SUP  2.00
assign  ((resid   15 and name HD*  )) ((resid   16 and name HD1* ))   4.54  2.74  0.00 ! #SUP  6.50
assign  ((resid   40 and name HD*  )) ((resid   63 and name HG2* ))   4.32  2.52  0.00 ! #SUP  4.75
assign  ((resid    2 and name HA   )) ((resid    3 and name HD*  ))   4.01  2.21  0.00 ! #SUP  4.80
assign  ((resid    3 and name HA   )) ((resid    3 and name HD*  ))   3.63  1.83  0.00 ! #SUP  4.85
assign  ((resid   15 and name HE*  )) ((resid   65 and name HG1* ))   4.12  2.32  0.00 ! #SUP  2.35
assign  ((resid   17 and name HN   )) ((resid   17 and name HD2  ))   5.44  3.64  0.00 ! #SUP  4.87
assign  ((resid   17 and name HD2  )) ((resid   18 and name HN   ))   5.04  3.24  0.00 ! #SUP  5.28
assign  ((resid   17 and name HA   )) ((resid   17 and name HD2  ))   4.96  3.16  0.00 ! #SUP  4.02
assign  ((resid   17 and name HD2  )) ((resid   18 and name HA   ))   5.33  3.53  0.00 ! #SUP  3.16
assign  ((resid   84 and name HA   )) ((resid   84 and name HD*  ))   3.60  1.80  0.00 ! #SUP  5.52
assign  ((resid   80 and name HG*  )) ((resid   84 and name HD*  ))   4.00  2.20  0.00 ! #SUP  3.10
assign  ((resid   67 and name HG2* )) ((resid   84 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.77
assign  ((resid   83 and name HD1* )) ((resid   84 and name HD*  ))   4.39  2.59  0.00 ! #SUP  6.74
assign  ((resid   83 and name HG2* )) ((resid   84 and name HD*  ))   4.37  2.57  0.00 ! #SUP  6.84
assign  ((resid   27 and name HD*  )) ((resid   29 and name HZ   ))   5.27  3.47  0.00 ! #SUP  2.96
assign  ((resid   20 and name HD2* )) ((resid   27 and name HD*  ))   4.06  2.26  0.00 ! #SUP  6.46
assign  ((resid   84 and name HD*  )) ((resid  161 and name HG*  ))   4.27  2.47  0.00 ! #SUP  3.82
assign  ((resid   27 and name HA   )) ((resid   27 and name HD*  ))   3.52  1.72  0.00 ! #SUP  3.12
assign  ((resid   20 and name HB2  )) ((resid   27 and name HD*  ))   4.20  2.40  0.00 ! #SUP  2.72
assign  ((resid   21 and name HN   )) ((resid   27 and name HD*  ))   5.50  3.70  0.00 ! #SUP  5.48
assign  ((resid   27 and name HD*  )) ((resid   29 and name HD*  ))   5.14  3.34  0.00 ! #SUP  4.00
assign  ((resid   22 and name HA   )) ((resid   27 and name HD*  ))   4.28  2.48  0.00 ! #SUP  3.90
assign  ((resid   27 and name HD*  )) ((resid   51 and name HB2  ))   4.99  3.19  0.00 ! #SUP  0.49
assign  ((resid   20 and name HB1  )) ((resid   27 and name HD*  ))   4.21  2.41  0.00 ! #SUP  4.42
assign  ((resid  101 and name HN   )) ((resid  101 and name HD*  ))   4.30  2.50  0.00 ! #SUP  5.01
assign  ((resid   63 and name HG1* )) ((resid  101 and name HD*  ))   4.28  2.48  0.00 ! #SUP  2.25
assign  ((resid    4 and name HE*  )) ((resid    6 and name HA   ))   5.13  3.33  0.00 ! #SUP  3.24
assign  ((resid    4 and name HE*  )) ((resid    5 and name HB   ))   4.90  3.10  0.00 ! #SUP  3.17
assign  ((resid    4 and name HE*  )) ((resid   38 and name HA   ))   5.02  3.22  0.00 ! #SUP  1.50
assign  ((resid    4 and name HE*  )) ((resid    6 and name HD*  ))   5.27  3.47  0.00 ! #SUP  2.49
assign  ((resid   29 and name HZ   )) ((resid   84 and name HE*  ))   3.95  2.15  0.00 ! #SUP  1.36
assign  ((resid   84 and name HA   )) ((resid   84 and name HE*  ))   5.20  3.40  0.00 ! #SUP  3.41
assign  ((resid   80 and name HG*  )) ((resid   84 and name HE*  ))   3.62  1.82  0.00 ! #SUP  1.87
assign  ((resid   84 and name HE*  )) ((resid   95 and name HD1* ))   3.47  1.67  0.00 ! #SUP  1.03
assign  ((resid   68 and name HD22 )) ((resid   93 and name HG1* ))   3.42  1.62  0.00 ! #SUP  7.33
assign  ((resid   64 and name HG2* )) ((resid   84 and name HE*  ))   4.14  2.34  0.00 ! #SUP  1.09
assign  ((resid   67 and name HG1* )) ((resid   84 and name HE*  ))   3.51  1.71  0.00 ! #SUP  1.79
assign  ((resid   67 and name HG2* )) ((resid   84 and name HE*  ))   4.14  2.34  0.00 ! #SUP  2.00
assign  ((resid   84 and name HE*  )) ((resid  161 and name HG*  ))   5.17  3.37  0.00 ! #SUP  0.94
assign  ((resid   11 and name HD2* )) ((resid   40 and name HE*  ))   4.14  2.34  0.00 ! #SUP  0.64
assign  ((resid    5 and name HN   )) ((resid   40 and name HE*  ))   4.07  2.27  0.00 ! #SUP  2.00
assign  ((resid   40 and name HA   )) ((resid   40 and name HE*  ))   4.90  3.10  0.00 ! #SUP  3.82
assign  ((resid    4 and name HA   )) ((resid   40 and name HE*  ))   4.38  2.58  0.00 ! #SUP  2.00
assign  ((resid   40 and name HE*  )) ((resid   73 and name HD1* ))   4.29  2.49  0.00 ! #SUP  2.96
assign  ((resid    5 and name HN   )) ((resid   40 and name HZ   ))   4.66  2.86  0.00 ! #SUP  2.53
assign  ((resid    4 and name HA   )) ((resid   40 and name HZ   ))   4.82  3.02  0.00 ! #SUP  3.65
assign  ((resid   40 and name HD*  )) ((resid   40 and name HZ   ))   3.85  2.05  0.00 ! #SUP  3.13
assign  ((resid    5 and name HG2* )) ((resid   40 and name HZ   ))   4.64  2.84  0.00 ! #SUP  1.21
assign  ((resid   11 and name HD2* )) ((resid  101 and name HE*  ))   3.76  1.96  0.00 ! #SUP  3.25
assign  ((resid   12 and name HN   )) ((resid  101 and name HE*  ))   4.41  2.61  0.00 ! #SUP  2.71
assign  ((resid   11 and name HA   )) ((resid  101 and name HE*  ))   4.80  3.00  0.00 ! #SUP  2.89
assign  ((resid   63 and name HG1* )) ((resid  101 and name HE*  ))   5.24  3.44  0.00 ! #SUP  1.86
assign  ((resid   27 and name HA   )) ((resid   29 and name HD*  ))   5.05  3.25  0.00 ! #SUP  2.96
assign  ((resid   29 and name HD*  )) ((resid   52 and name HB*  ))   3.73  1.93  0.00 ! #SUP  4.07
assign  ((resid   29 and name HD*  )) ((resid   58 and name HE*  ))   4.37  2.57  0.00 ! #SUP  0.75
assign  ((resid   29 and name HD*  )) ((resid   43 and name HG2* ))   4.05  2.25  0.00 ! #SUP  6.14
assign  ((resid   29 and name HD*  )) ((resid   95 and name HD2* ))   5.50  3.70  0.00 ! #SUP  1.50
assign  ((resid   29 and name HD*  )) ((resid  161 and name HG*  ))   4.74  2.94  0.00 ! #SUP  2.49
assign  ((resid   16 and name HG2* )) ((resid   99 and name HH2* ))   5.26  3.46  0.00 ! #SUP  0.99
assign  ((resid   32 and name HG2* )) ((resid   42 and name HE22 ))   3.98  2.18  0.00 ! #SUP  0.59
assign  ((resid   75 and name HD2  )) ((resid   80 and name HN   ))   5.02  3.22  0.00 ! #SUP  8.52
assign  ((resid   75 and name HA   )) ((resid   75 and name HD2  ))   5.26  3.46  0.00 ! #SUP  4.90
assign  ((resid   72 and name HA   )) ((resid   75 and name HD2  ))   5.35  3.55  0.00 ! #SUP  3.84
assign  ((resid   75 and name HD2  )) ((resid   80 and name HA   ))   4.89  3.09  0.00 ! #SUP  6.38
assign  ((resid   75 and name HD2  )) ((resid   79 and name HB2  ))   4.72  2.92  0.00 ! #SUP  8.90
assign  ((resid   75 and name HD2  )) ((resid   79 and name HB1  ))   4.32  2.52  0.00 ! #SUP  7.88
assign  ((resid   72 and name HG*  )) ((resid   75 and name HD2  ))   5.10  3.30  0.00 ! #SUP  5.60
assign  ((resid   27 and name HD*  )) ((resid   29 and name HE*  ))   4.51  2.71  0.00 ! #SUP  4.97
assign  ((resid   27 and name HA   )) ((resid   29 and name HE*  ))   5.07  3.27  0.00 ! #SUP  3.87
assign  ((resid   27 and name HB1  )) ((resid   29 and name HE*  ))   3.97  2.17  0.00 ! #SUP  3.57
assign  ((resid   29 and name HE*  )) ((resid   52 and name HB*  ))   5.01  3.21  0.00 ! #SUP  1.58
assign  ((resid   29 and name HE*  )) ((resid   58 and name HE*  ))   4.31  2.51  0.00 ! #SUP  0.75
assign  ((resid   29 and name HE*  )) ((resid   43 and name HG2* ))   5.23  3.43  0.00 ! #SUP  3.41
assign  ((resid   29 and name HE*  )) ((resid   64 and name HG11 ))   4.37  2.57  0.00 ! #SUP  3.46
assign  ((resid   29 and name HE*  )) ((resid  161 and name HG*  ))   4.37  2.57  0.00 ! #SUP  2.15
assign  ((resid    4 and name HA   )) ((resid    4 and name HD*  ))   4.06  2.26  0.00 ! #SUP  7.62
assign  ((resid    4 and name HD*  )) ((resid   40 and name HD*  ))   4.44  2.64  0.00 ! #SUP  0.99
assign  ((resid    4 and name HD*  )) ((resid    5 and name HN   ))   4.85  3.05  0.00 ! #SUP  4.61
assign  ((resid    4 and name HD*  )) ((resid   39 and name HA   ))   4.70  2.90  0.00 ! #SUP  1.27
assign  ((resid    4 and name HD*  )) ((resid    5 and name HA   ))   5.10  3.30  0.00 ! #SUP  4.88
assign  ((resid   19 and name HA   )) ((resid   94 and name HN   ))   4.47  2.67  0.00 ! #SUP  4.59
assign  ((resid   34 and name HA1  )) ((resid   40 and name HA   ))   4.18  2.38  0.00 ! #SUP  1.24
assign  ((resid  106 and name HA   )) ((resid  107 and name HA   ))   4.45  2.65  0.00 ! #SUP  5.39
assign  ((resid   19 and name HG*  )) ((resid   93 and name HA   ))   4.05  2.25  0.00 ! #SUP  1.41
assign  ((resid   76 and name HB   )) ((resid   79 and name HG1  ))   3.43  1.63  0.00 ! #SUP  5.24
assign  ((resid   21 and name HA   )) ((resid   21 and name HB*  ))   2.85  1.05  0.00 ! #SUP  5.90
assign  ((resid   19 and name HD*  )) ((resid   21 and name HA   ))   2.99  1.19  0.00 ! #SUP  1.65
assign  ((resid   43 and name HG2* )) ((resid   45 and name HA   ))   3.96  2.16  0.00 ! #SUP  1.49
assign  ((resid   45 and name HA   )) ((resid   60 and name HG2* ))   4.15  2.35  0.00 ! #SUP  1.75
assign  ((resid  117 and name HA   )) ((resid  118 and name HG*  ))   3.40  1.60  0.00 ! #SUP  3.08
assign  ((resid  111 and name HA   )) ((resid  111 and name HD21 ))   2.61  0.81  0.00 ! #SUP  5.26
assign  ((resid   44 and name HA   )) ((resid   44 and name HB1  ))   2.40  0.60  0.00 ! #SUP  3.29
assign  ((resid  111 and name HA   )) ((resid  111 and name HB1  ))   2.40  0.60  0.00 ! #SUP  5.36
assign  ((resid   66 and name HB*  )) ((resid   67 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.47
assign  ((resid   82 and name HA   )) ((resid   85 and name HG2  ))   5.21  3.41  0.00 ! #SUP  1.50
assign  ((resid   53 and name HA   )) ((resid   54 and name HD1* ))   4.61  2.81  1.00 ! #SUP  4.61 
assign  ((resid    0 and name HA*  )) ((resid    1 and name HA   ))   4.08  2.28  0.00 ! #SUP  5.40
assign  ((resid   79 and name HA   )) ((resid   82 and name HB*  ))   4.57  2.77  0.00 ! #SUP  1.11
assign  ((resid   46 and name HN   )) ((resid   60 and name HB   ))   4.14  2.34  0.00 ! #SUP  2.92
assign  ((resid   65 and name HA   )) ((resid   73 and name HN   ))   5.16  3.36  0.00 ! #SUP  3.94
assign  ((resid   27 and name HA   )) ((resid   51 and name HD2  ))   4.78  2.98  0.00 ! #SUP  1.96
assign  ((resid  107 and name HD1  )) ((resid  108 and name HB2  ))   4.83  3.03  0.00 ! #SUP  3.53
assign  ((resid   50 and name HN   )) ((resid   51 and name HD2  ))   5.34  3.54  0.00 ! #SUP  4.22
assign  ((resid    5 and name HA   )) ((resid    7 and name HN   ))   4.27  2.47  0.00 ! #SUP  4.02
assign  ((resid   46 and name HN   )) ((resid   60 and name HA   ))   4.38  2.58  0.00 ! #SUP  3.43
assign  ((resid   37 and name HD1  )) ((resid   38 and name HB1  ))   4.68  2.88  0.00 ! #SUP  3.35
assign  ((resid   72 and name HN   )) ((resid   75 and name HB2  ))   4.95  3.15  0.00 ! #SUP  2.25
assign  ((resid   75 and name HB2  )) ((resid   80 and name HA   ))   4.74  2.94  0.00 ! #SUP  4.00
assign  ((resid   43 and name HB   )) ((resid   61 and name HA2  ))   4.85  3.05  0.00 ! #SUP  4.20
assign  ((resid   27 and name HB1  )) ((resid   51 and name HD1  ))   3.19  1.39  0.00 ! #SUP  0.75
assign  ((resid    3 and name HE*  )) ((resid    4 and name HA   ))   5.50  3.70  0.00 ! #SUP  3.63
assign  ((resid    4 and name HA   )) ((resid    4 and name HE*  ))   5.34  3.54  0.00 ! #SUP  4.67
assign  ((resid   29 and name HB*  )) ((resid   52 and name HB*  ))   4.07  2.27  0.00 ! #SUP  2.44
assign  ((resid   68 and name HB2  )) ((resid   94 and name HN   ))   4.98  3.18  0.00 ! #SUP  4.51
assign  ((resid   15 and name HE*  )) ((resid   17 and name HB*  ))   4.23  2.43  0.00 ! #SUP  1.84
assign  ((resid   75 and name HB1  )) ((resid   80 and name HA   ))   4.43  2.63  0.00 ! #SUP  5.98
assign  ((resid   16 and name HG2* )) ((resid   17 and name HB*  ))   5.22  3.42  0.00 ! #SUP  6.16
assign  ((resid   80 and name HG*  )) ((resid   84 and name HB1  ))   4.22  2.42  0.00 ! #SUP  3.38
assign  ((resid   84 and name HB1  )) ((resid  161 and name HG*  ))   4.24  2.44  0.00 ! #SUP  2.14
assign  ((resid   22 and name HA   )) ((resid   27 and name HE*  ))   4.57  2.77  0.00 ! #SUP  4.52
assign  ((resid   -1 and name HN   )) ((resid    1 and name HE*  ))   4.57  2.77  0.00 ! #SUP  0.75
assign  ((resid   -1 and name HA   )) ((resid    1 and name HE*  ))   3.96  2.16  0.00 ! #SUP  1.75
assign  ((resid  121 and name HN   )) ((resid  123 and name HE*  ))   4.38  2.58  0.00 ! #SUP  1.14
assign  ((resid   79 and name HB1  )) ((resid   82 and name HE*  ))   4.12  2.32  0.00 ! #SUP  0.16
assign  ((resid   14 and name HA   )) ((resid   15 and name HB1  ))   4.22  2.42  0.00 ! #SUP  4.11
assign  ((resid   15 and name HB1  )) ((resid   16 and name HN   ))   4.25  2.45  0.00 ! #SUP  5.12
assign  ((resid   12 and name HG2  )) ((resid   12 and name HE*  ))   4.15  2.35  0.00 ! #SUP  4.14
assign  ((resid   48 and name HA   )) ((resid   49 and name HB2  ))   4.68  2.88  0.00 ! #SUP  4.79
assign  ((resid    4 and name HD*  )) ((resid   38 and name HA   ))   5.39  3.59  0.00 ! #SUP  2.13
assign  ((resid    4 and name HZ   )) ((resid   38 and name HA   ))   5.03  3.23  0.00 ! #SUP  1.50
assign  ((resid   34 and name HA2  )) ((resid   35 and name HB2  ))   5.02  3.22  0.00 ! #SUP  4.26
assign  ((resid   22 and name HE*  )) ((resid   92 and name HB*  ))   4.77  2.97  0.00 ! #SUP  1.37
assign  ((resid   68 and name HA   )) ((resid   94 and name HB1  ))   4.53  2.73  0.00 ! #SUP  2.96
assign  ((resid    4 and name HB2  )) ((resid   40 and name HZ   ))   4.86  3.06  0.00 ! #SUP  1.17
assign  ((resid   62 and name HB2  )) ((resid   97 and name HD*  ))   4.44  2.64  0.00 ! #SUP  3.95
assign  ((resid   76 and name HB   )) ((resid   79 and name HB2  ))   4.01  2.21  0.00 ! #SUP  5.75
assign  ((resid   27 and name HB2  )) ((resid   29 and name HD*  ))   4.38  2.58  0.00 ! #SUP  4.01
assign  ((resid   27 and name HB2  )) ((resid   29 and name HE*  ))   4.09  2.29  0.00 ! #SUP  4.26
assign  ((resid   26 and name HA2  )) ((resid   27 and name HB2  ))   4.68  2.88  0.00 ! #SUP  2.86
assign  ((resid    3 and name HE*  )) ((resid   10 and name HB2  ))   3.81  2.01  0.00 ! #SUP  2.60
assign  ((resid    3 and name HB2  )) ((resid   10 and name HB2  ))   3.67  1.87  0.00 ! #SUP  0.75
assign  ((resid   27 and name HB2  )) ((resid   87 and name HD1* ))   4.39  2.59  0.00 ! #SUP  0.58
assign  ((resid   75 and name HD2  )) ((resid   79 and name HG1  ))   5.50  3.70  0.00 ! #SUP  6.66
assign  ((resid   39 and name HA   )) ((resid   39 and name HG2  ))   3.75  1.95  0.00 ! #SUP  4.90
assign  ((resid   33 and name HA1  )) ((resid   39 and name HG2  ))   5.05  3.25  0.00 ! #SUP  0.75
assign  ((resid   42 and name HG2  )) ((resid   63 and name HA   ))   4.02  2.22  0.00 ! #SUP  5.20
assign  ((resid    8 and name HA   )) ((resid   10 and name HG*  ))   4.25  2.45  0.00 ! #SUP  4.26
assign  ((resid   42 and name HN   )) ((resid   42 and name HG2  ))   4.38  2.58  0.00 ! #SUP  5.85
assign  ((resid   42 and name HG2  )) ((resid   64 and name HN   ))   5.21  3.41  0.00 ! #SUP  4.06
assign  ((resid   36 and name HG2  )) ((resid   38 and name HN   ))   4.79  2.99  0.00 ! #SUP  2.63
assign  ((resid    4 and name HA   )) ((resid   10 and name HG*  ))   4.05  2.25  0.00 ! #SUP  2.13
assign  ((resid   35 and name HB1  )) ((resid   36 and name HG2  ))   4.02  2.22  0.00 ! #SUP  5.06
assign  ((resid    4 and name HB1  )) ((resid    5 and name HN   ))   4.10  2.30  0.00 ! #SUP  3.16
assign  ((resid   84 and name HD*  )) ((resid  161 and name HB   ))   4.69  2.89  0.00 ! #SUP  1.85
assign  ((resid   59 and name HG*  )) ((resid   60 and name HN   ))   4.05  2.25  0.00 ! #SUP  4.80
assign  ((resid   85 and name HN   )) ((resid   85 and name HB*  ))   3.73  1.93  0.00 ! #SUP  6.20
assign  ((resid   43 and name HB   )) ((resid   44 and name HN   ))   4.22  2.42  0.00 ! #SUP  5.50
assign  ((resid    8 and name HB1  )) ((resid   15 and name HE*  ))   3.40  1.60  0.00 ! #SUP  2.93
assign  ((resid   36 and name HB2  )) ((resid   38 and name HN   ))   4.84  3.04  0.00 ! #SUP  4.02
assign  ((resid   75 and name HB2  )) ((resid   80 and name HB   ))   4.45  2.65  0.00 ! #SUP  5.44
assign  ((resid   73 and name HN   )) ((resid   73 and name HB2  ))   3.90  2.10  0.00 ! #SUP  7.01
assign  ((resid   76 and name HB   )) ((resid   79 and name HB1  ))   5.01  3.21  0.00 ! #SUP  4.69
assign  ((resid    2 and name HB1  )) ((resid    3 and name HN   ))   3.69  1.89  0.00 ! #SUP  5.75
assign  ((resid   41 and name HG   )) ((resid   42 and name HN   ))   4.80  3.00  0.00 ! #SUP  5.88
assign  ((resid  124 and name HB1  )) ((resid  125 and name HD1  ))   4.81  3.01  0.00 ! #SUP  3.42
assign  ((resid   34 and name HA2  )) ((resid   41 and name HG   ))   4.27  2.47  0.00 ! #SUP  4.00
assign  ((resid   35 and name HN   )) ((resid   41 and name HG   ))   5.02  3.22  0.00 ! #SUP  1.50
assign  ((resid   68 and name HB1  )) ((resid   93 and name HB   ))   3.86  2.06  0.00 ! #SUP  0.75
assign  ((resid   11 and name HB1  )) ((resid  101 and name HE*  ))   4.59  2.79  0.00 ! #SUP  2.71
assign  ((resid   64 and name HA   )) ((resid   65 and name HB   ))   4.83  3.03  0.00 ! #SUP  6.23
assign  ((resid   54 and name HB2  )) ((resid   55 and name HN   ))   4.06  2.26  0.00 ! #SUP  6.17
assign  ((resid   28 and name HA1  )) ((resid   47 and name HB   ))   3.80  2.00  0.00 ! #SUP  2.00
assign  ((resid   21 and name HB*  )) ((resid   21 and name HD*  ))   3.71  1.91  0.00 ! #SUP  5.12
assign  ((resid   54 and name HN   )) ((resid   54 and name HB2  ))   3.34  1.54  0.00 ! #SUP  7.66
assign  ((resid   46 and name HN   )) ((resid   46 and name HB2  ))   3.84  2.04  0.00 ! #SUP  6.85
assign  ((resid  121 and name HN   )) ((resid  123 and name HD*  ))   4.45  2.65  0.00 ! #SUP  0.75
assign  ((resid   13 and name HA1  )) ((resid   14 and name HD*  ))   4.20  2.40  0.00 ! #SUP  5.20
assign  ((resid   52 and name HB*  )) ((resid   55 and name HB1  ))   5.21  3.41  0.00 ! #SUP  2.00
assign  ((resid    6 and name HB1  )) ((resid    6 and name HD*  ))   3.77  1.97  0.00 ! #SUP  6.96
assign  ((resid    6 and name HB1  )) ((resid    7 and name HN   ))   4.03  2.23  0.00 ! #SUP  8.20
assign  ((resid   89 and name HN   )) ((resid   89 and name HG12 ))   3.58  1.78  0.00 ! #SUP  4.88
assign  ((resid   78 and name HB*  )) ((resid   79 and name HA   ))   4.22  2.42  0.00 ! #SUP  5.35
assign  ((resid   95 and name HB*  )) ((resid   95 and name HD1* ))   3.34  1.54  0.00 ! #SUP  5.61
assign  ((resid   95 and name HB*  )) ((resid   96 and name HN   ))   4.38  2.58  0.00 ! #SUP  6.88
assign  ((resid   14 and name HA   )) ((resid   14 and name HG2  ))   3.95  2.15  0.00 ! #SUP  6.53
assign  ((resid   58 and name HA   )) ((resid   97 and name HG   ))   4.99  3.19  0.00 ! #SUP  0.75
assign  ((resid   14 and name HG2  )) ((resid   14 and name HE*  ))   4.00  2.20  0.00 ! #SUP  4.59
assign  ((resid   97 and name HG   )) ((resid   99 and name HD1  ))   5.41  3.61  0.00 ! #SUP  0.75
assign  ((resid   -2 and name HB*  )) ((resid   -1 and name HA   ))   4.90  3.10  0.00 ! #SUP  1.87
assign  ((resid   11 and name HA   )) ((resid   12 and name HG2  ))   5.00  3.20  0.00 ! #SUP  4.75
assign  ((resid   34 and name HN   )) ((resid   41 and name HB1  ))   4.20  2.40  0.00 ! #SUP  1.22
assign  ((resid   19 and name HG*  )) ((resid   94 and name HA   ))   4.48  2.68  0.00 ! #SUP  2.96
assign  ((resid   21 and name HG2  )) ((resid   90 and name HA*  ))   4.25  2.45  0.00 ! #SUP  2.88
assign  ((resid   29 and name HB*  )) ((resid   46 and name HB1  ))   4.92  3.12  0.00 ! #SUP  1.87
assign  ((resid   97 and name HB*  )) ((resid   98 and name HN   ))   5.04  3.24  0.00 ! #SUP  4.36
assign  ((resid   64 and name HA   )) ((resid   97 and name HB*  ))   5.12  3.32  0.00 ! #SUP  2.57
assign  ((resid   16 and name HG1* )) ((resid   18 and name HN   ))   4.21  2.41  0.00 ! #SUP  3.49
assign  ((resid   14 and name HA   )) ((resid   14 and name HG1  ))   4.19  2.39  0.00 ! #SUP  6.45
assign  ((resid   21 and name HG1  )) ((resid   92 and name HB*  ))   3.96  2.16  0.00 ! #SUP  5.49
assign  ((resid   12 and name HG1  )) ((resid   13 and name HA1  ))   4.10  2.30  0.00 ! #SUP  3.65
assign  ((resid   76 and name HG2* )) ((resid   77 and name HA   ))   4.47  2.67  0.00 ! #SUP  4.86
assign  ((resid   87 and name HG2* )) ((resid   92 and name HN   ))   5.00  3.20  0.00 ! #SUP  1.96
assign  ((resid   22 and name HD1  )) ((resid   87 and name HG2* ))   3.65  1.85  0.00 ! #SUP  0.83
assign  ((resid   11 and name HD2* )) ((resid   12 and name HG1  ))   4.89  3.09  0.00 ! #SUP  5.55
assign  ((resid   87 and name HG2* )) ((resid   91 and name HN   ))   4.94  3.14  0.00 ! #SUP  0.02
assign  ((resid   19 and name HG*  )) ((resid   92 and name HB*  ))   4.60  2.80  0.00 ! #SUP  5.30
assign  ((resid   16 and name HG1* )) ((resid   18 and name HN   ))   5.38  3.58  0.00 ! #SUP  3.29
assign  ((resid   16 and name HG1* )) ((resid   97 and name HN   ))   4.62  2.82  0.00 ! #SUP  3.93
assign  ((resid  115 and name HA   )) ((resid  116 and name HG2* ))   3.86  2.06  0.00 ! #SUP  3.32
assign  ((resid   32 and name HG1* )) ((resid   43 and name HA   ))   5.34  3.54  0.00 ! #SUP  3.03
assign  ((resid   22 and name HB1  )) ((resid   23 and name HN   ))   4.22  2.42  0.00 ! #SUP  5.69
assign  ((resid   22 and name HB1  )) ((resid   89 and name HA   ))   4.43  2.63  0.00 ! #SUP  1.50
assign  ((resid   24 and name HA   )) ((resid   89 and name HG11 ))   4.41  2.61  0.00 ! #SUP  3.61
assign  ((resid   29 and name HN   )) ((resid   30 and name HG2* ))   5.26  3.46  0.00 ! #SUP  2.86
assign  ((resid   26 and name HA2  )) ((resid   87 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   76 and name HN   )) ((resid   80 and name HG*  ))   4.58  2.78  0.00 ! #SUP  9.43
assign  ((resid   83 and name HN   )) ((resid   83 and name HG11 ))   3.90  2.10  0.00 ! #SUP  7.61
assign  ((resid   79 and name HB2  )) ((resid   80 and name HG*  ))   4.72  2.92  0.00 ! #SUP  6.26
assign  ((resid   77 and name HA   )) ((resid   80 and name HG*  ))   3.47  1.67  0.00 ! #SUP  4.36
assign  ((resid   15 and name HZ   )) ((resid   65 and name HG1* ))   4.27  2.47  0.00 ! #SUP  2.32
assign  ((resid   11 and name HB2  )) ((resid   11 and name HD1* ))   3.35  1.55  0.00 ! #SUP  5.98
assign  ((resid    5 and name HG2* )) ((resid    7 and name HN   ))   4.27  2.47  0.00 ! #SUP  5.65
assign  ((resid   46 and name HD1* )) ((resid   48 and name HD2* ))   3.10  1.30  0.00 ! #SUP  0.99
assign  ((resid   32 and name HA   )) ((resid   32 and name HG2* ))   3.77  1.97  0.00 ! #SUP  4.94
assign  ((resid   31 and name HG2* )) ((resid   43 and name HA   ))   4.05  2.25  0.00 ! #SUP  5.65
assign  ((resid   31 and name HG2* )) ((resid   43 and name HD1* ))   4.39  2.59  0.00 ! #SUP  3.10
assign  ((resid   47 and name HG2* )) ((resid   48 and name HN   ))   4.41  2.61  0.00 ! #SUP  6.32
assign  ((resid   29 and name HN   )) ((resid   47 and name HG2* ))   4.62  2.82  0.00 ! #SUP  4.59
assign  ((resid   41 and name HA   )) ((resid   41 and name HD2* ))   4.34  2.54  0.00 ! #SUP  5.64
assign  ((resid   29 and name HB*  )) ((resid   47 and name HG2* ))   4.92  3.12  0.00 ! #SUP  5.61
assign  ((resid   80 and name HA   )) ((resid   83 and name HD1* ))   3.47  1.67  0.00 ! #SUP  4.23
assign  ((resid   54 and name HA   )) ((resid   54 and name HD2* ))   4.04  2.24  0.00 ! #SUP  5.73
assign  ((resid   11 and name HB2  )) ((resid   11 and name HD2* ))   3.90  2.10  0.00 ! #SUP  6.28
assign  ((resid   24 and name HA   )) ((resid   89 and name HG2* ))   3.64  1.84  0.00 ! #SUP  6.00
assign  ((resid   64 and name HA   )) ((resid   65 and name HG2* ))   4.83  3.03  0.00 ! #SUP  6.43
assign  ((resid   15 and name HE*  )) ((resid   65 and name HG2* ))   4.54  2.74  0.00 ! #SUP  3.22
assign  ((resid   65 and name HG2* )) ((resid   97 and name HA   ))   4.75  2.95  0.00 ! #SUP  5.56
assign  ((resid   63 and name HG2* )) ((resid   65 and name HG2* ))   3.66  1.86  0.00 ! #SUP  2.90
assign  ((resid   15 and name HZ   )) ((resid   65 and name HG2* ))   5.39  3.59  0.00 ! #SUP  3.25
assign  ((resid   73 and name HA   )) ((resid   73 and name HD2* ))   5.22  3.42  0.00 ! #SUP  5.44
assign  ((resid   40 and name HE*  )) ((resid   73 and name HD2* ))   5.50  3.70  0.00 ! #SUP  2.21
assign  ((resid    7 and name HA   )) ((resid   73 and name HD2* ))   5.00  3.20  0.00 ! #SUP  2.60
assign  ((resid   62 and name HB1  )) ((resid   97 and name HD*  ))   4.14  2.34  0.00 ! #SUP  3.95
assign  ((resid   63 and name HA   )) ((resid   63 and name HG1* ))   3.94  2.14  0.00 ! #SUP  4.80
assign  ((resid   29 and name HB*  )) ((resid   43 and name HG2* ))   4.14  2.34  0.00 ! #SUP  3.22
assign  ((resid   18 and name HG2* )) ((resid   97 and name HD*  ))   4.04  2.24  0.00 ! #SUP  1.46
assign  ((resid   92 and name HA   )) ((resid   93 and name HG2* ))   4.52  2.72  0.00 ! #SUP  5.76
assign  ((resid   18 and name HN   )) ((resid   95 and name HD2* ))   5.39  3.59  0.00 ! #SUP  3.25
assign  ((resid   65 and name HA   )) ((resid   72 and name HG*  ))   5.26  3.46  0.00 ! #SUP  4.46
assign  ((resid   40 and name HE*  )) ((resid   63 and name HG2* ))   5.50  3.70  0.00 ! #SUP  2.15
assign  ((resid   42 and name HG2  )) ((resid   63 and name HG2* ))   5.50  3.70  0.00 ! #SUP  4.56
assign  ((resid   29 and name HB*  )) ((resid   43 and name HD1* ))   5.50  3.70  0.00 ! #SUP  2.44
assign  ((resid   29 and name HD*  )) ((resid   43 and name HD1* ))   4.24  2.44  0.00 ! #SUP  4.00
assign  ((resid   29 and name HE*  )) ((resid   43 and name HD1* ))   4.64  2.84  0.00 ! #SUP  2.32
assign  ((resid   29 and name HZ   )) ((resid  161 and name HG*  ))   5.05  3.25  0.00 ! #SUP  2.15
assign  ((resid   27 and name HB1  )) ((resid  161 and name HG*  ))   4.83  3.03  0.00 ! #SUP  3.07
assign  ((resid   27 and name HB2  )) ((resid  161 and name HG*  ))   5.21  3.41  0.00 ! #SUP  3.25
assign  ((resid   31 and name HG2* )) ((resid   44 and name HN   ))   5.31  3.51  0.00 ! #SUP  4.90
assign  ((resid   71 and name HN   )) ((resid   72 and name HN   ))   5.12  3.32  0.00 ! #SUP  4.34
assign  ((resid   70 and name HN   )) ((resid   71 and name HN   ))   4.81  3.01  0.00 ! #SUP  4.22
assign  ((resid   71 and name HN   )) ((resid   71 and name HB1  ))   3.81  2.01  0.00 ! #SUP  5.18
assign  ((resid   65 and name HN   )) ((resid   98 and name HN   ))   5.24  3.44  0.00 ! #SUP  4.43
assign  ((resid   65 and name HN   )) ((resid   96 and name HN   ))   5.06  3.26  0.00 ! #SUP  2.06
assign  ((resid   68 and name HN   )) ((resid   68 and name HD21 ))   5.50  3.70  0.00 ! #SUP  7.72
assign  ((resid   68 and name HN   )) ((resid   94 and name HB1  ))   3.91  2.11  0.00 ! #SUP  4.35
assign  ((resid   22 and name HN   )) ((resid   91 and name HN   ))   5.13  3.33  0.00 ! #SUP  3.67
assign  ((resid   22 and name HN   )) ((resid   27 and name HE*  ))   5.21  3.41  0.00 ! #SUP  3.80
assign  ((resid   22 and name HN   )) ((resid   92 and name HA   ))   4.28  2.48  0.00 ! #SUP  6.29
assign  ((resid   22 and name HN   )) ((resid   93 and name HN   ))   5.10  3.30  0.00 ! #SUP  3.80
assign  ((resid   22 and name HN   )) ((resid   23 and name HN   ))   5.16  3.36  0.00 ! #SUP  5.70
assign  ((resid   22 and name HN   )) ((resid   22 and name HD1  ))   4.61  2.81  0.00 ! #SUP  6.11
assign  ((resid   16 and name HN   )) ((resid   97 and name HN   ))   4.41  2.61  0.00 ! #SUP  5.15
assign  ((resid   17 and name HN   )) ((resid   97 and name HN   ))   5.19  3.39  0.00 ! #SUP  6.27
assign  ((resid   18 and name HN   )) ((resid   97 and name HN   ))   4.95  3.15  0.00 ! #SUP  4.31
assign  ((resid   96 and name HN   )) ((resid   97 and name HN   ))   4.89  3.09  0.00 ! #SUP  5.53
assign  ((resid   97 and name HN   )) ((resid   97 and name HG   ))   4.30  2.50  0.00 ! #SUP  5.30
assign  ((resid   16 and name HG1* )) ((resid   97 and name HN   ))   4.66  2.86  0.00 ! #SUP  5.87
assign  ((resid  114 and name HN   )) ((resid  114 and name HG   ))   3.48  1.68  0.00 ! #SUP  4.92
assign  ((resid   19 and name HN   )) ((resid   95 and name HN   ))   5.20  3.40  0.00 ! #SUP  3.90
assign  ((resid   19 and name HN   )) ((resid   19 and name HB*  ))   3.35  1.55  0.00 ! #SUP  6.97
assign  ((resid   19 and name HN   )) ((resid   19 and name HG*  ))   5.27  3.47  0.00 ! #SUP  7.67
assign  ((resid   64 and name HN   )) ((resid   64 and name HG12 ))   4.48  2.68  0.00 ! #SUP  6.43
assign  ((resid   64 and name HN   )) ((resid   64 and name HD1* ))   4.71  2.91  0.00 ! #SUP  5.97
assign  ((resid   42 and name HA   )) ((resid   64 and name HN   ))   4.49  2.69  0.00 ! #SUP  6.71
assign  ((resid   23 and name HN   )) ((resid   23 and name HB*  ))   4.20  2.40  0.00 ! #SUP  3.78
assign  ((resid   22 and name HG1  )) ((resid   23 and name HN   ))   4.83  3.03  0.00 ! #SUP  7.18
assign  ((resid   86 and name HB*  )) ((resid   87 and name HN   ))   4.84  3.04  0.00 ! #SUP  4.24
assign  ((resid   87 and name HN   )) ((resid   87 and name HG12 ))   3.72  1.92  0.00 ! #SUP  6.63
assign  ((resid   87 and name HN   )) ((resid   87 and name HG11 ))   4.32  2.52  0.00 ! #SUP  6.85
assign  ((resid   23 and name HN   )) ((resid   51 and name HB2  ))   5.21  3.41  0.00 ! #SUP  3.33
assign  ((resid   68 and name HN   )) ((resid   94 and name HN   ))   4.40  2.60  0.00 ! #SUP  8.66
assign  ((resid   94 and name HN   )) ((resid   95 and name HN   ))   4.18  2.38  0.00 ! #SUP  9.14
assign  ((resid   68 and name HD22 )) ((resid   94 and name HN   ))   5.00  3.20  0.00 ! #SUP  6.86
assign  ((resid   68 and name HA   )) ((resid   94 and name HN   ))   4.32  2.52  0.00 ! #SUP  4.88
assign  ((resid   94 and name HN   )) ((resid   94 and name HB1  ))   3.49  1.69  0.00 ! #SUP  5.88
assign  ((resid   94 and name HN   )) ((resid   95 and name HD1* ))   4.98  3.18  0.00 ! #SUP  4.73
assign  ((resid   61 and name HN   )) ((resid   62 and name HN   ))   3.70  1.90  0.00 ! #SUP  5.34
assign  ((resid   62 and name HN   )) ((resid   63 and name HN   ))   5.10  3.30  0.00 ! #SUP  3.83
assign  ((resid   60 and name HA   )) ((resid   62 and name HN   ))   4.16  2.36  0.00 ! #SUP  2.72
assign  ((resid   62 and name HN   )) ((resid   62 and name HB1  ))   4.00  2.20  0.00 ! #SUP  3.84
assign  ((resid   43 and name HB   )) ((resid   62 and name HN   ))   4.02  2.22  0.00 ! #SUP  4.97
assign  ((resid   60 and name HG2* )) ((resid   62 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.37
assign  ((resid   43 and name HG2* )) ((resid   62 and name HN   ))   4.49  2.69  0.00 ! #SUP  4.92
assign  ((resid   53 and name HN   )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  4.61
assign  ((resid   46 and name HD1* )) ((resid   53 and name HN   ))   5.23  3.43  0.00 ! #SUP  1.50
assign  ((resid   14 and name HN   )) ((resid   15 and name HN   ))   4.61  2.81  0.00 ! #SUP  6.82
assign  ((resid   14 and name HG1  )) ((resid   15 and name HN   ))   4.74  2.94  0.00 ! #SUP  8.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HB1  ))   3.30  1.50  0.00 ! #SUP  6.22
assign  ((resid   43 and name HN   )) ((resid   62 and name HN   ))   4.72  2.92  0.00 ! #SUP  3.81
assign  ((resid   62 and name HN   )) ((resid  103 and name HD2* ))   5.50  3.70  0.00 ! #SUP  1.50
assign  ((resid   14 and name HG2  )) ((resid   15 and name HN   ))   4.57  2.77  0.00 ! #SUP  6.84
assign  ((resid  115 and name HN   )) ((resid  155 and name HA   ))   4.71  2.91  0.00 ! #SUP  1.52
assign  ((resid  114 and name HD2* )) ((resid  115 and name HN   ))   3.87  2.07  0.00 ! #SUP  4.49
assign  ((resid   17 and name HN   )) ((resid   17 and name HB*  ))   3.39  1.59  0.00 ! #SUP  5.70
assign  ((resid   16 and name HN   )) ((resid   17 and name HN   ))   5.23  3.43  0.00 ! #SUP  6.51
assign  ((resid  123 and name HN   )) ((resid  124 and name HN   ))   4.20  2.40  0.00 ! #SUP  6.24
assign  ((resid  124 and name HN   )) ((resid  124 and name HB1  ))   3.84  2.04  0.00 ! #SUP  5.39
assign  ((resid   89 and name HA   )) ((resid   91 and name HN   ))   3.99  2.19  0.00 ! #SUP  4.26
assign  ((resid    3 and name HN   )) ((resid    4 and name HN   ))   4.34  2.54  0.00 ! #SUP  5.66
assign  ((resid   18 and name HN   )) ((resid   95 and name HN   ))   3.87  2.07  0.00 ! #SUP  5.14
assign  ((resid   93 and name HG2* )) ((resid   95 and name HN   ))   4.72  2.92  0.00 ! #SUP  5.81
assign  ((resid   16 and name HN   )) ((resid   99 and name HN   ))   5.24  3.44  0.00 ! #SUP  3.19
assign  ((resid   16 and name HN   )) ((resid   98 and name HA   ))   4.34  2.54  0.00 ! #SUP  3.09
assign  ((resid   16 and name HN   )) ((resid   16 and name HD1* ))   4.41  2.61  0.00 ! #SUP  7.40
assign  ((resid    4 and name HN   )) ((resid    4 and name HD*  ))   5.08  3.28  0.00 ! #SUP  6.57
assign  ((resid    3 and name HB2  )) ((resid    4 and name HN   ))   4.56  2.76  0.00 ! #SUP  5.81
assign  ((resid    3 and name HB1  )) ((resid    4 and name HN   ))   4.79  2.99  0.00 ! #SUP  5.74
assign  ((resid    4 and name HN   )) ((resid    4 and name HB1  ))   4.02  2.22  0.00 ! #SUP  4.93
assign  ((resid   99 and name HA   )) ((resid  101 and name HN   ))   4.58  2.78  0.00 ! #SUP  2.00
assign  ((resid   93 and name HA   )) ((resid   95 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.33
assign  ((resid   95 and name HN   )) ((resid   95 and name HB*  ))   3.75  1.95  0.00 ! #SUP  7.05
assign  ((resid   20 and name HD1* )) ((resid   95 and name HN   ))   4.85  3.05  0.00 ! #SUP  1.48
assign  ((resid   12 and name HD*  )) ((resid  101 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.02
assign  ((resid   40 and name HB2  )) ((resid   41 and name HN   ))   4.65  2.85  0.00 ! #SUP  6.85
assign  ((resid   41 and name HN   )) ((resid   63 and name HG2* ))   5.32  3.52  0.00 ! #SUP  4.83
assign  ((resid   73 and name HN   )) ((resid   74 and name HN   ))   5.13  3.33  0.00 ! #SUP  4.72
assign  ((resid   40 and name HN   )) ((resid   41 and name HN   ))   4.96  3.16  0.00 ! #SUP  6.21
assign  ((resid   20 and name HN   )) ((resid   21 and name HN   ))   5.29  3.49  0.00 ! #SUP  7.53
assign  ((resid   21 and name HN   )) ((resid   92 and name HA   ))   5.05  3.25  0.00 ! #SUP  4.02
assign  ((resid   19 and name HD*  )) ((resid   21 and name HN   ))   3.57  1.77  0.00 ! #SUP  4.20
assign  ((resid   20 and name HB1  )) ((resid   21 and name HN   ))   3.85  2.05  0.00 ! #SUP  7.10
assign  ((resid   29 and name HA   )) ((resid   47 and name HN   ))   4.65  2.85  0.00 ! #SUP  3.51
assign  ((resid   46 and name HB1  )) ((resid   47 and name HN   ))   4.69  2.89  0.00 ! #SUP  7.42
assign  ((resid   46 and name HD1* )) ((resid   47 and name HN   ))   3.96  2.16  0.00 ! #SUP  8.37
assign  ((resid   74 and name HN   )) ((resid   75 and name HN   ))   3.79  1.99  0.00 ! #SUP  3.83
assign  ((resid   75 and name HN   )) ((resid   76 and name HN   ))   4.95  3.15  0.00 ! #SUP  5.73
assign  ((resid   75 and name HN   )) ((resid   75 and name HB2  ))   3.99  2.19  0.00 ! #SUP  5.85
assign  ((resid   75 and name HN   )) ((resid   75 and name HB1  ))   4.14  2.34  0.00 ! #SUP  5.43
assign  ((resid  122 and name HN   )) ((resid  123 and name HN   ))   4.18  2.38  0.00 ! #SUP  5.22
assign  ((resid   20 and name HN   )) ((resid   93 and name HN   ))   3.66  1.86  0.00 ! #SUP  8.08
assign  ((resid   19 and name HD*  )) ((resid   20 and name HN   ))   4.11  2.31  0.00 ! #SUP  8.88
assign  ((resid   75 and name HN   )) ((resid   80 and name HB   ))   4.55  2.75  0.00 ! #SUP  2.27
assign  ((resid  121 and name HA   )) ((resid  122 and name HN   ))   3.19  1.39  0.00 ! #SUP  3.53
assign  ((resid  121 and name HB*  )) ((resid  122 and name HN   ))   3.60  1.80  0.00 ! #SUP  3.58
assign  ((resid  118 and name HN   )) ((resid  118 and name HG*  ))   3.85  2.05  0.00 ! #SUP  3.72
assign  ((resid    3 and name HN   )) ((resid    3 and name HD*  ))   4.50  2.70  0.00 ! #SUP  6.49
assign  ((resid    3 and name HN   )) ((resid    3 and name HB1  ))   3.67  1.87  0.00 ! #SUP  6.89
assign  ((resid    1 and name HN   )) ((resid    1 and name HB2  ))   3.74  1.94  0.00 ! #SUP  6.30
assign  ((resid    1 and name HN   )) ((resid    1 and name HD*  ))   3.52  1.72  0.00 ! #SUP  5.18
assign  ((resid    1 and name HN   )) ((resid    1 and name HG*  ))   4.10  2.30  0.00 ! #SUP  6.42
assign  ((resid  108 and name HN   )) ((resid  109 and name HN   ))   3.25  1.45  0.00 ! #SUP  6.79
assign  ((resid  109 and name HN   )) ((resid  110 and name HD*  ))   4.27  2.47  0.00 ! #SUP  4.34
assign  ((resid  109 and name HN   )) ((resid  109 and name HB1  ))   3.34  1.54  0.00 ! #SUP  4.85
assign  ((resid  108 and name HB1  )) ((resid  109 and name HN   ))   4.00  2.20  0.00 ! #SUP  4.70
assign  ((resid  117 and name HA   )) ((resid  118 and name HN   ))   2.93  1.13  0.00 ! #SUP  2.61
assign  ((resid    4 and name HD*  )) ((resid   40 and name HN   ))   4.90  3.10  0.00 ! #SUP  1.50
assign  ((resid   12 and name HN   )) ((resid   12 and name HB2  ))   3.93  2.13  0.00 ! #SUP  8.35
assign  ((resid    0 and name HA*  )) ((resid    1 and name HN   ))   3.00  1.20  0.00 ! #SUP  5.53
assign  ((resid    1 and name HN   )) ((resid    2 and name HD1  ))   5.07  3.27  0.00 ! #SUP  6.67
assign  ((resid  107 and name HA   )) ((resid  109 and name HN   ))   4.87  3.07  0.00 ! #SUP  3.32
assign  ((resid   63 and name HN   )) ((resid   98 and name HN   ))   4.52  2.72  0.00 ! #SUP  4.73
assign  ((resid    3 and name HE*  )) ((resid   12 and name HN   ))   4.98  3.18  0.00 ! #SUP  5.14
assign  ((resid   11 and name HN   )) ((resid   12 and name HN   ))   4.36  2.56  0.00 ! #SUP  7.96
assign  ((resid   11 and name HB2  )) ((resid   12 and name HN   ))   4.49  2.69  0.00 ! #SUP  7.28
assign  ((resid   95 and name HN   )) ((resid   96 and name HN   ))   4.79  2.99  0.00 ! #SUP  6.57
assign  ((resid  106 and name HN   )) ((resid  109 and name HB1  ))   4.91  3.11  0.00 ! #SUP  0.75
assign  ((resid  103 and name HN   )) ((resid  104 and name HD1  ))   5.19  3.39  0.00 ! #SUP  5.64
assign  ((resid   45 and name HA   )) ((resid   46 and name HN   ))   3.15  1.35  0.00 ! #SUP  3.79
assign  ((resid   46 and name HN   )) ((resid   46 and name HB1  ))   4.06  2.26  0.00 ! #SUP  6.72
assign  ((resid  112 and name HN   )) ((resid  113 and name HN   ))   5.01  3.21  0.00 ! #SUP  4.03
assign  ((resid   31 and name HG2* )) ((resid   42 and name HN   ))   4.17  2.37  0.00 ! #SUP  5.90
assign  ((resid   32 and name HN   )) ((resid   42 and name HN   ))   4.05  2.25  0.00 ! #SUP  5.82
assign  ((resid   42 and name HN   )) ((resid   43 and name HN   ))   5.28  3.48  0.00 ! #SUP  5.04
assign  ((resid   34 and name HN   )) ((resid   35 and name HN   ))   4.20  2.40  0.00 ! #SUP  4.72
assign  ((resid  103 and name HN   )) ((resid  103 and name HB2  ))   3.30  1.50  0.00 ! #SUP  4.46
assign  ((resid  103 and name HN   )) ((resid  103 and name HB1  ))   4.11  2.31  0.00 ! #SUP  5.65
assign  ((resid  103 and name HN   )) ((resid  103 and name HD2* ))   4.28  2.48  0.00 ! #SUP  5.73
assign  ((resid    6 and name HG1  )) ((resid    7 and name HN   ))   3.99  2.19  0.00 ! #SUP  8.07
assign  ((resid    6 and name HN   )) ((resid    7 and name HN   ))   3.48  1.68  0.00 ! #SUP  8.77
assign  ((resid    7 and name HN   )) ((resid    8 and name HD1  ))   4.84  3.04  0.00 ! #SUP  5.33
assign  ((resid   80 and name HN   )) ((resid   81 and name HN   ))   3.86  2.06  0.00 ! #SUP  6.67
assign  ((resid   81 and name HN   )) ((resid   82 and name HN   ))   3.79  1.99  0.00 ! #SUP  7.83
assign  ((resid   81 and name HN   )) ((resid   81 and name HB   ))   3.62  1.82  0.00 ! #SUP  5.04
assign  ((resid   81 and name HN   )) ((resid   81 and name HG*  ))   3.52  1.72  0.00 ! #SUP  5.39
assign  ((resid   67 and name HN   )) ((resid   68 and name HN   ))   4.98  3.18  0.00 ! #SUP  5.55
assign  ((resid   67 and name HN   )) ((resid   70 and name HN   ))   4.68  2.88  0.00 ! #SUP  0.75
assign  ((resid   67 and name HN   )) ((resid   72 and name HG*  ))   4.65  2.85  0.00 ! #SUP  4.97
assign  ((resid   34 and name HN   )) ((resid   42 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.61
assign  ((resid   67 and name HN   )) ((resid   67 and name HB   ))   3.85  2.05  0.00 ! #SUP  6.18
assign  ((resid   67 and name HN   )) ((resid   72 and name HN   ))   4.65  2.85  0.00 ! #SUP  4.95
assign  ((resid  121 and name HN   )) ((resid  121 and name HB*  ))   3.21  1.41  0.00 ! #SUP  4.41
assign  ((resid  118 and name HG*  )) ((resid  121 and name HN   ))   4.45  2.65  0.00 ! #SUP  1.22
assign  ((resid  120 and name HG2* )) ((resid  121 and name HN   ))   4.75  2.95  0.00 ! #SUP  4.82
assign  ((resid   59 and name HN   )) ((resid   99 and name HE   ))   4.85  3.05  0.00 ! #SUP  4.40
assign  ((resid   59 and name HN   )) ((resid   99 and name HH2* ))   4.31  2.51  0.00 ! #SUP  2.96
assign  ((resid   59 and name HN   )) ((resid   59 and name HB2  ))   3.81  2.01  0.00 ! #SUP  2.29
assign  ((resid   59 and name HN   )) ((resid   97 and name HD*  ))   4.63  2.83  0.00 ! #SUP  2.92
assign  ((resid   25 and name HG*  )) ((resid   89 and name HN   ))   3.16  1.36  0.00 ! #SUP  0.98
assign  ((resid   14 and name HN   )) ((resid   99 and name HN   ))   3.98  2.18  0.00 ! #SUP  2.60
assign  ((resid   14 and name HN   )) ((resid   14 and name HD*  ))   3.31  1.51  0.00 ! #SUP  7.91
assign  ((resid   14 and name HN   )) ((resid  100 and name HA1  ))   4.49  2.69  0.00 ! #SUP  2.54
assign  ((resid   77 and name HN   )) ((resid   78 and name HN   ))   4.48  2.68  0.00 ! #SUP  4.98
assign  ((resid   35 and name HA   )) ((resid   77 and name HN   ))   3.86  2.06  0.00 ! #SUP  2.22
assign  ((resid  119 and name HN   )) ((resid  120 and name HN   ))   4.95  3.15  0.00 ! #SUP  6.27
assign  ((resid   85 and name HN   )) ((resid  159 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.07
assign  ((resid   84 and name HN   )) ((resid   85 and name HN   ))   3.71  1.91  0.00 ! #SUP  5.46
assign  ((resid   83 and name HN   )) ((resid   85 and name HN   ))   5.33  3.53  0.00 ! #SUP  4.55
assign  ((resid   52 and name HN   )) ((resid   53 and name HN   ))   4.14  2.34  0.00 ! #SUP  3.03
assign  ((resid   51 and name HB1  )) ((resid   52 and name HN   ))   4.54  2.74  0.00 ! #SUP  6.33
assign  ((resid   20 and name HD1* )) ((resid   52 and name HN   ))   4.26  2.46  0.00 ! #SUP  7.09
assign  ((resid   19 and name HA   )) ((resid   93 and name HN   ))   4.93  3.13  0.00 ! #SUP  8.09
assign  ((resid   93 and name HN   )) ((resid   94 and name HN   ))   4.50  2.70  0.00 ! #SUP  5.57
assign  ((resid   21 and name HA   )) ((resid   93 and name HN   ))   4.01  2.21  0.00 ! #SUP  4.94
assign  ((resid   92 and name HB*  )) ((resid   93 and name HN   ))   3.88  2.08  0.00 ! #SUP  4.87
assign  ((resid   19 and name HB*  )) ((resid   93 and name HN   ))   4.94  3.14  0.00 ! #SUP  4.99
assign  ((resid   31 and name HN   )) ((resid  161 and name HG*  ))   5.50  3.70  0.00 ! #SUP  3.00
assign  ((resid   76 and name HN   )) ((resid   80 and name HN   ))   5.00  3.20  0.00 ! #SUP  8.68
assign  ((resid   79 and name HN   )) ((resid   80 and name HN   ))   3.85  2.05  0.00 ! #SUP  7.07
assign  ((resid   75 and name HB1  )) ((resid   80 and name HN   ))   5.38  3.58  0.00 ! #SUP  7.72
assign  ((resid   79 and name HG2  )) ((resid   80 and name HN   ))   4.26  2.46  0.00 ! #SUP  7.87
assign  ((resid   79 and name HB1  )) ((resid   80 and name HN   ))   3.40  1.60  0.00 ! #SUP  6.33
assign  ((resid   51 and name HB2  )) ((resid   52 and name HN   ))   4.21  2.41  0.00 ! #SUP  6.43
assign  ((resid    7 and name HB2  )) ((resid   10 and name HN   ))   4.96  3.16  0.00 ! #SUP  3.30
assign  ((resid   10 and name HN   )) ((resid   10 and name HB1  ))   3.42  1.62  0.00 ! #SUP  4.96
assign  ((resid    5 and name HG2* )) ((resid   10 and name HN   ))   4.56  2.76  0.00 ! #SUP  1.50
assign  ((resid    6 and name HN   )) ((resid    6 and name HB1  ))   3.76  1.96  0.00 ! #SUP  6.52
assign  ((resid   10 and name HN   )) ((resid   11 and name HN   ))   3.42  1.62  0.00 ! #SUP  7.69
assign  ((resid   11 and name HN   )) ((resid   11 and name HB2  ))   3.84  2.04  0.00 ! #SUP  6.93
assign  ((resid   27 and name HE*  )) ((resid   93 and name HN   ))   5.27  3.47  0.00 ! #SUP  2.90
assign  ((resid   83 and name HN   )) ((resid   84 and name HN   ))   3.65  1.85  0.00 ! #SUP  7.92
assign  ((resid   83 and name HN   )) ((resid   83 and name HG12 ))   3.63  1.83  0.00 ! #SUP  7.01
assign  ((resid   83 and name HN   )) ((resid   83 and name HB   ))   3.77  1.97  0.00 ! #SUP  7.81
assign  ((resid   11 and name HN   )) ((resid   11 and name HG   ))   3.75  1.95  0.00 ! #SUP  6.12
assign  ((resid   42 and name HB2  )) ((resid   43 and name HN   ))   3.85  2.05  0.00 ! #SUP  4.49
assign  ((resid   57 and name HB1  )) ((resid   58 and name HN   ))   3.94  2.14  0.00 ! #SUP  4.13
assign  ((resid   81 and name HN   )) ((resid   83 and name HN   ))   5.35  3.55  0.00 ! #SUP  6.01
assign  ((resid   64 and name HA   )) ((resid   98 and name HN   ))   5.04  3.24  0.00 ! #SUP  8.06
assign  ((resid   63 and name HG1* )) ((resid   98 and name HN   ))   4.02  2.22  0.00 ! #SUP  5.15
assign  ((resid   25 and name HN   )) ((resid   89 and name HG12 ))   3.94  2.14  0.00 ! #SUP  3.57
assign  ((resid   25 and name HN   )) ((resid   89 and name HG2* ))   5.50  3.70  0.00 ! #SUP  2.84
assign  ((resid   53 and name HN   )) ((resid   54 and name HN   ))   4.05  2.25  0.00 ! #SUP  4.97
assign  ((resid   54 and name HN   )) ((resid   55 and name HN   ))   3.85  2.05  0.00 ! #SUP  7.64
assign  ((resid   54 and name HN   )) ((resid   56 and name HN   ))   5.02  3.22  0.00 ! #SUP  7.79
assign  ((resid   54 and name HN   )) ((resid   55 and name HB2  ))   4.93  3.13  0.00 ! #SUP  6.87
assign  ((resid   54 and name HN   )) ((resid   54 and name HG   ))   3.33  1.53  0.00 ! #SUP  7.48
assign  ((resid   29 and name HN   )) ((resid  161 and name HG*  ))   4.55  2.75  0.00 ! #SUP  2.17
assign  ((resid   28 and name HN   )) ((resid   29 and name HN   ))   3.51  1.71  0.00 ! #SUP  3.86
assign  ((resid   27 and name HB1  )) ((resid   29 and name HN   ))   4.54  2.74  0.00 ! #SUP  2.26
assign  ((resid  116 and name HA   )) ((resid  117 and name HN   ))   3.61  1.81  0.00 ! #SUP  2.75
assign  ((resid   55 and name HN   )) ((resid   56 and name HA*  ))   4.79  2.99  0.00 ! #SUP  4.15
assign  ((resid   55 and name HN   )) ((resid   55 and name HB2  ))   3.67  1.87  0.00 ! #SUP  6.60
assign  ((resid   54 and name HB1  )) ((resid   55 and name HN   ))   3.94  2.14  0.00 ! #SUP  7.75
assign  ((resid   54 and name HD1* )) ((resid   55 and name HN   ))   4.48  2.68  0.00 ! #SUP  7.04
assign  ((resid   49 and name HN   )) ((resid   54 and name HA   ))   5.10  3.30  0.00 ! #SUP  2.03
assign  ((resid   57 and name HN   )) ((resid   58 and name HN   ))   4.23  2.43  0.00 ! #SUP  5.04
assign  ((resid   56 and name HN   )) ((resid   57 and name HN   ))   4.77  2.97  0.00 ! #SUP  3.28
assign  ((resid   57 and name HN   )) ((resid   57 and name HB1  ))   3.95  2.15  0.00 ! #SUP  4.26
assign  ((resid   81 and name HG*  )) ((resid   82 and name HN   ))   4.22  2.42  0.00 ! #SUP  5.54
assign  ((resid   69 and name HN   )) ((resid   70 and name HN   ))   4.08  2.28  0.00 ! #SUP  4.60
assign  ((resid   80 and name HN   )) ((resid   82 and name HN   ))   4.72  2.92  0.00 ! #SUP  5.15
assign  ((resid   78 and name HN   )) ((resid   81 and name HG*  ))   5.47  3.67  0.00 ! #SUP  2.13
assign  ((resid   18 and name HN   )) ((resid   19 and name HN   ))   4.67  2.87  0.00 ! #SUP  4.91
assign  ((resid   18 and name HN   )) ((resid   96 and name HA   ))   4.71  2.91  0.00 ! #SUP  4.06
assign  ((resid   17 and name HB*  )) ((resid   18 and name HN   ))   3.78  1.98  0.00 ! #SUP  6.13
assign  ((resid   18 and name HN   )) ((resid   95 and name HB*  ))   4.55  2.75  0.00 ! #SUP  5.02
assign  ((resid   35 and name HN   )) ((resid   36 and name HN   ))   3.44  1.64  0.00 ! #SUP  7.84
assign  ((resid   34 and name HN   )) ((resid   36 and name HN   ))   4.63  2.83  0.00 ! #SUP  3.64
assign  ((resid   35 and name HB1  )) ((resid   36 and name HN   ))   3.85  2.05  0.00 ! #SUP  6.98
assign  ((resid   36 and name HN   )) ((resid   36 and name HG1  ))   3.73  1.93  0.00 ! #SUP  7.31
assign  ((resid   36 and name HN   )) ((resid   36 and name HB1  ))   3.78  1.98  0.00 ! #SUP  7.21
assign  ((resid   77 and name HB2  )) ((resid   78 and name HN   ))   4.19  2.39  0.00 ! #SUP  4.45
assign  ((resid   77 and name HB1  )) ((resid   78 and name HN   ))   4.00  2.20  0.00 ! #SUP  5.04
assign  ((resid   35 and name HA   )) ((resid   78 and name HN   ))   4.89  3.09  0.00 ! #SUP  2.22
assign  ((resid   18 and name HN   )) ((resid   97 and name HD*  ))   4.98  3.18  0.00 ! #SUP  3.40
assign  ((resid   32 and name HN   )) ((resid   44 and name HN   ))   5.11  3.31  0.00 ! #SUP  4.70
assign  ((resid   31 and name HN   )) ((resid   32 and name HN   ))   5.41  3.61  0.00 ! #SUP  4.32
assign  ((resid   36 and name HG1  )) ((resid   38 and name HN   ))   4.03  2.23  0.00 ! #SUP  4.69
assign  ((resid   38 and name HN   )) ((resid   38 and name HB1  ))   3.99  2.19  0.00 ! #SUP  4.95
assign  ((resid   43 and name HN   )) ((resid   61 and name HN   ))   4.33  2.53  0.00 ! #SUP  2.96
assign  ((resid   61 and name HN   )) ((resid  103 and name HD2* ))   4.63  2.83  0.00 ! #SUP  3.64
assign  ((resid   31 and name HG2* )) ((resid   32 and name HN   ))   3.79  1.99  0.00 ! #SUP  5.26
assign  ((resid   90 and name HN   )) ((resid   91 and name HN   ))   4.03  2.23  0.00 ! #SUP  4.81
assign  ((resid  111 and name HN   )) ((resid  111 and name HD22 ))   4.92  3.12  0.00 ! #SUP  5.99
assign  ((resid   46 and name HB1  )) ((resid   60 and name HN   ))   3.78  1.98  0.00 ! #SUP  4.97
assign  ((resid   78 and name HN   )) ((resid   79 and name HN   ))   3.77  1.97  0.00 ! #SUP  5.74
assign  ((resid   79 and name HN   )) ((resid   79 and name HG2  ))   3.66  1.86  0.00 ! #SUP  8.35
assign  ((resid   79 and name HN   )) ((resid   79 and name HB1  ))   3.87  2.07  0.00 ! #SUP  6.93
assign  ((resid   75 and name HD2  )) ((resid   79 and name HN   ))   5.29  3.49  0.00 ! #SUP  9.18
assign  ((resid   83 and name HD1* )) ((resid   84 and name HN   ))   4.76  2.96  0.00 ! #SUP  7.30
assign  ((resid  111 and name HN   )) ((resid  111 and name HD21 ))   4.21  2.41  0.00 ! #SUP  6.36
assign  ((resid  111 and name HN   )) ((resid  112 and name HN   ))   3.41  1.61  0.00 ! #SUP  5.41
assign  ((resid  110 and name HB1  )) ((resid  111 and name HN   ))   4.00  2.20  0.00 ! #SUP  6.81
assign  ((resid   99 and name HH11 )) ((resid  100 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.37
assign  ((resid   40 and name HE*  )) ((resid   74 and name HN   ))   5.10  3.30  0.00 ! #SUP  0.99
assign  ((resid   74 and name HN   )) ((resid   75 and name HB2  ))   5.46  3.66  0.00 ! #SUP  2.75
assign  ((resid   73 and name HG   )) ((resid   74 and name HN   ))   4.84  3.04  0.00 ! #SUP  4.28
assign  ((resid  100 and name HN   )) ((resid  101 and name HN   ))   3.71  1.91  0.00 ! #SUP  5.26
assign  ((resid   99 and name HD1  )) ((resid  100 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.08
assign  ((resid   99 and name HB*  )) ((resid  100 and name HN   ))   4.14  2.34  0.00 ! #SUP  5.84
assign  ((resid   99 and name HG*  )) ((resid  100 and name HN   ))   4.42  2.62  0.00 ! #SUP  5.74
assign  ((resid  111 and name HB1  )) ((resid  111 and name HD21 ))   3.66  1.86  0.00 ! #SUP  4.63
assign  ((resid  110 and name HB1  )) ((resid  111 and name HD21 ))   5.34  3.54  0.00 ! #SUP  5.65
assign  ((resid  110 and name HD*  )) ((resid  111 and name HD22 ))   5.50  3.70  0.00 ! #SUP  3.82
assign  ((resid  111 and name HB1  )) ((resid  111 and name HD22 ))   4.01  2.21  0.00 ! #SUP  4.38
assign  ((resid  110 and name HB1  )) ((resid  111 and name HD22 ))   5.08  3.28  0.00 ! #SUP  5.51
assign  ((resid   58 and name HG2  )) ((resid   99 and name HE   ))   5.50  3.70  0.00 ! #SUP  1.80
assign  ((resid   59 and name HB2  )) ((resid   99 and name HE   ))   4.05  2.25  0.00 ! #SUP  1.97
assign  ((resid   97 and name HD*  )) ((resid   99 and name HE   ))   5.29  3.49  0.00 ! #SUP  2.31
assign  ((resid   38 and name HN   )) ((resid   39 and name HN   ))   3.54  1.74  0.00 ! #SUP  6.02
assign  ((resid   38 and name HA   )) ((resid   39 and name HN   ))   3.54  1.74  0.00 ! #SUP  6.24
assign  ((resid   36 and name HG1  )) ((resid   39 and name HN   ))   4.14  2.34  0.00 ! #SUP  1.38
assign  ((resid   38 and name HB1  )) ((resid   39 and name HN   ))   3.80  2.00  0.00 ! #SUP  5.52
assign  ((resid   39 and name HN   )) ((resid   39 and name HB1  ))   3.94  2.14  0.00 ! #SUP  5.86
assign  ((resid   99 and name HA   )) ((resid   99 and name HE   ))   5.14  3.34  0.00 ! #SUP  5.97
assign  ((resid   44 and name HN   )) ((resid   45 and name HN   ))   3.97  2.17  0.00 ! #SUP  4.24
assign  ((resid   44 and name HB1  )) ((resid   45 and name HN   ))   5.32  3.52  0.00 ! #SUP  3.59
assign  ((resid   43 and name HA   )) ((resid   45 and name HN   ))   5.20  3.40  0.00 ! #SUP  2.80
assign  ((resid    7 and name HN   )) ((resid    7 and name HD21 ))   5.12  3.32  0.00 ! #SUP  7.07
assign  ((resid    7 and name HD21 )) ((resid    9 and name HB*  ))   5.08  3.28  0.00 ! #SUP  0.86
assign  ((resid    7 and name HN   )) ((resid    7 and name HD22 ))   5.47  3.67  0.00 ! #SUP  5.69
assign  ((resid   92 and name HN   )) ((resid   93 and name HN   ))   4.39  2.59  0.00 ! #SUP  5.72
assign  ((resid   91 and name HN   )) ((resid   92 and name HN   ))   4.89  3.09  0.00 ! #SUP  3.69
assign  ((resid   91 and name HA   )) ((resid   92 and name HN   ))   3.03  1.23  0.00 ! #SUP  3.69
assign  ((resid   68 and name HD21 )) ((resid   93 and name HA   ))   5.33  3.53  0.00 ! #SUP  2.96
assign  ((resid   68 and name HA   )) ((resid   68 and name HD21 ))   5.15  3.35  0.00 ! #SUP  5.28
assign  ((resid   30 and name HN   )) ((resid   45 and name HN   ))   4.58  2.78  0.00 ! #SUP  1.50
assign  ((resid   29 and name HB*  )) ((resid   30 and name HN   ))   4.24  2.44  0.00 ! #SUP  3.63
assign  ((resid   30 and name HN   )) ((resid   43 and name HG2* ))   5.50  3.70  0.00 ! #SUP  2.79
assign  ((resid   68 and name HD22 )) ((resid   93 and name HG2* ))   5.50  3.70  0.00 ! #SUP  3.55
assign  ((resid   42 and name HE22 )) ((resid  103 and name HD2* ))   5.32  3.52  0.00 ! #SUP  2.23
assign  ((resid    9 and name HN   )) ((resid   10 and name HN   ))   3.44  1.64  0.00 ! #SUP  5.60
assign  ((resid    7 and name HB2  )) ((resid    9 and name HN   ))   4.86  3.06  0.00 ! #SUP  5.70
assign  ((resid    9 and name HN   )) ((resid   15 and name HE*  ))   4.48  2.68  0.00 ! #SUP  2.04
assign  ((resid    7 and name HB1  )) ((resid    9 and name HN   ))   4.94  3.14  0.00 ! #SUP  7.41
assign  ((resid    8 and name HG*  )) ((resid    9 and name HN   ))   3.80  2.00  0.00 ! #SUP  8.57
assign  ((resid    8 and name HB1  )) ((resid    9 and name HN   ))   3.98  2.18  0.00 ! #SUP  7.79
assign  ((resid   81 and name HG*  )) ((resid   85 and name HE22 ))   5.50  3.70  0.00 ! #SUP  1.33
assign  ((resid   66 and name HN   )) ((resid   96 and name HN   ))   4.45  2.65  0.00 ! #SUP  4.53
assign  ((resid   66 and name HN   )) ((resid   97 and name HA   ))   5.02  3.22  0.00 ! #SUP  3.04
assign  ((resid   64 and name HA   )) ((resid   66 and name HN   ))   4.01  2.21  0.00 ! #SUP  4.93
assign  ((resid   65 and name HB   )) ((resid   66 and name HN   ))   3.89  2.09  0.00 ! #SUP  6.96
assign  ((resid   86 and name HN   )) ((resid   87 and name HN   ))   4.09  2.29  0.00 ! #SUP  4.48
assign  ((resid   85 and name HE22 )) ((resid  159 and name HG2* ))   5.39  3.59  0.00 ! #SUP  1.35
assign  ((resid   85 and name HN   )) ((resid   86 and name HN   ))   4.00  2.20  0.00 ! #SUP  4.50
assign  ((resid   76 and name HN   )) ((resid   79 and name HB2  ))   4.00  2.20  0.00 ! #SUP 10.00
assign  ((resid   76 and name HN   )) ((resid   79 and name HB1  ))   4.22  2.42  0.00 ! #SUP  9.16
assign  ((resid   76 and name HN   )) ((resid   79 and name HN   ))   4.49  2.69  0.00 ! #SUP 10.00
assign  ((resid   31 and name HG2* )) ((resid   33 and name HN   ))   5.50  3.70  0.00 ! #SUP  2.39
assign  ((resid   25 and name HG*  )) ((resid   26 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.60
assign  ((resid   25 and name HB2  )) ((resid   26 and name HN   ))   5.47  3.67  0.00 ! #SUP  4.67
assign  ((resid   99 and name HN   )) ((resid   99 and name HB*  ))   3.70  1.90  0.00 ! #SUP  4.12
assign  ((resid   27 and name HB1  )) ((resid   28 and name HN   ))   4.50  2.70  0.00 ! #SUP  4.48
assign  ((resid   28 and name HN   )) ((resid   47 and name HG2* ))   5.20  3.40  0.00 ! #SUP  3.17
assign  ((resid   12 and name HN   )) ((resid   13 and name HN   ))   4.61  2.81  0.00 ! #SUP  6.88
assign  ((resid   13 and name HN   )) ((resid   14 and name HN   ))   4.36  2.56  0.00 ! #SUP  4.01
assign  ((resid   12 and name HD*  )) ((resid   13 and name HN   ))   3.78  1.98  0.00 ! #SUP  6.26
assign  ((resid   50 and name HN   )) ((resid   53 and name HN   ))   5.41  3.61  0.00 ! #SUP  1.45
assign  ((resid   49 and name HN   )) ((resid   50 and name HN   ))   3.82  2.02  0.00 ! #SUP  4.46
assign  ((resid   50 and name HN   )) ((resid   54 and name HD1* ))   4.42  2.62  0.00 ! #SUP  4.68
assign  ((resid   46 and name HD1* )) ((resid   50 and name HN   ))   5.06  3.26  0.00 ! #SUP  0.90
assign  ((resid   34 and name HN   )) ((resid   39 and name HB1  ))   4.98  3.18  0.00 ! #SUP  1.42
assign  ((resid   55 and name HN   )) ((resid   56 and name HN   ))   3.64  1.84  0.00 ! #SUP  7.50
assign  ((resid   54 and name HA   )) ((resid   56 and name HN   ))   3.94  2.14  0.00 ! #SUP  6.36
assign  ((resid   55 and name HB2  )) ((resid   56 and name HN   ))   4.22  2.42  0.00 ! #SUP  5.73
assign  ((resid   55 and name HB1  )) ((resid   56 and name HN   ))   4.33  2.53  0.00 ! #SUP  4.99
assign  ((resid   53 and name HB*  )) ((resid   56 and name HN   ))   4.93  3.13  0.00 ! #SUP  5.70
assign  ((resid   54 and name HD1* )) ((resid   56 and name HN   ))   5.44  3.64  0.00 ! #SUP  6.98
assign  ((resid   47 and name HN   )) ((resid   48 and name HN   ))   4.77  2.97  0.00 ! #SUP  5.81
assign  ((resid   76 and name HB   )) ((resid   79 and name HN   ))   2.72  0.92  0.00 ! #SUP  5.76
assign  ((resid   30 and name HB   )) ((resid   31 and name HN   ))   4.24  2.44  0.00 ! #SUP  4.04
assign  ((resid   30 and name HB   )) ((resid  160 and name HA   ))   4.64  2.84  0.00 ! #SUP  2.95
assign  ((resid   30 and name HB   )) ((resid  160 and name HB*  ))   4.42  2.62  0.00 ! #SUP  2.00
assign  ((resid   70 and name HN   )) ((resid   70 and name HB   ))   3.32  1.52  0.00 ! #SUP  4.68
assign  ((resid   70 and name HB   )) ((resid   72 and name HG*  ))   4.76  2.96  0.00 ! #SUP  1.53
assign  ((resid  111 and name HA   )) ((resid  112 and name HB   ))   4.97  3.17  0.00 ! #SUP  3.96
assign  ((resid  116 and name HN   )) ((resid  116 and name HB   ))   3.38  1.58  0.00 ! #SUP  3.25
assign  ((resid  112 and name HB   )) ((resid  113 and name HN   ))   3.97  2.17  0.00 ! #SUP  4.03
assign  ((resid  112 and name HN   )) ((resid  112 and name HB   ))   3.59  1.79  0.00 ! #SUP  4.85
assign  ((resid   44 and name HA   )) ((resid   60 and name HB   ))   5.38  3.58  0.00 ! #SUP  2.96
assign  ((resid   60 and name HB   )) ((resid   61 and name HN   ))   4.12  2.32  0.00 ! #SUP  3.87
assign  ((resid   60 and name HN   )) ((resid   60 and name HB   ))   3.25  1.45  0.00 ! #SUP  3.27
assign  ((resid   60 and name HB   )) ((resid  103 and name HD2* ))   4.98  3.18  0.00 ! #SUP  2.39
assign  ((resid   43 and name HG2* )) ((resid   60 and name HB   ))   4.92  3.12  0.00 ! #SUP  3.23
assign  ((resid   18 and name HB   )) ((resid   19 and name HN   ))   4.42  2.62  0.00 ! #SUP  4.91
assign  ((resid   81 and name HA   )) ((resid   83 and name HN   ))   4.59  2.79  0.00 ! #SUP  5.21
assign  ((resid   81 and name HA   )) ((resid   84 and name HB1  ))   4.55  2.75  0.00 ! #SUP  2.04
assign  ((resid   81 and name HA   )) ((resid   81 and name HG*  ))   3.18  1.38  0.00 ! #SUP  3.62
assign  ((resid   81 and name HA   )) ((resid   82 and name HB*  ))   4.97  3.17  0.00 ! #SUP  5.35
assign  ((resid   23 and name HB*  )) ((resid   51 and name HG1  ))   4.74  2.94  0.00 ! #SUP  1.68
assign  ((resid   23 and name HB*  )) ((resid   51 and name HB2  ))   4.44  2.64  0.00 ! #SUP  2.51
assign  ((resid   23 and name HB*  )) ((resid   51 and name HG1  ))   4.40  2.60  0.00 ! #SUP  3.89
assign  ((resid   21 and name HA   )) ((resid   92 and name HB*  ))   4.38  2.58  0.00 ! #SUP  2.97
assign  ((resid   19 and name HG*  )) ((resid   92 and name HB*  ))   4.54  2.74  0.00 ! #SUP  4.29
assign  ((resid   92 and name HB*  )) ((resid   93 and name HG2* ))   5.06  3.26  0.00 ! #SUP  5.18
assign  ((resid   92 and name HB*  )) ((resid   93 and name HN   ))   3.48  1.68  0.00 ! #SUP  5.30
assign  ((resid   92 and name HN   )) ((resid   92 and name HB*  ))   3.52  1.72  0.00 ! #SUP  5.52
assign  ((resid   19 and name HD*  )) ((resid   92 and name HB*  ))   3.87  2.07  0.00 ! #SUP  4.00
assign  ((resid   22 and name HN   )) ((resid   92 and name HB*  ))   4.93  3.13  0.00 ! #SUP  5.33
assign  ((resid   21 and name HA   )) ((resid   92 and name HB*  ))   4.36  2.56  0.00 ! #SUP  5.97
assign  ((resid   19 and name HD*  )) ((resid   92 and name HB*  ))   4.16  2.36  0.00 ! #SUP  4.97
assign  ((resid   51 and name HA   )) ((resid   54 and name HN   ))   4.02  2.22  0.00 ! #SUP  3.30
assign  ((resid   51 and name HA   )) ((resid   54 and name HB2  ))   3.65  1.85  0.00 ! #SUP  4.12
assign  ((resid   51 and name HA   )) ((resid   54 and name HB1  ))   3.78  1.98  0.00 ! #SUP  3.05
assign  ((resid   20 and name HD1* )) ((resid   51 and name HA   ))   4.58  2.78  0.00 ! #SUP  4.71
assign  ((resid   51 and name HA   )) ((resid   54 and name HD2* ))   4.88  3.08  0.00 ! #SUP  3.77
assign  ((resid   65 and name HG1* )) ((resid   66 and name HB*  ))   4.50  2.70  0.00 ! #SUP  3.93
assign  ((resid   66 and name HB*  )) ((resid   72 and name HG*  ))   4.66  2.86  0.00 ! #SUP  4.86
assign  ((resid   66 and name HB*  )) ((resid   67 and name HN   ))   3.79  1.99  0.00 ! #SUP  4.78
assign  ((resid   66 and name HN   )) ((resid   66 and name HB*  ))   4.16  2.36  0.00 ! #SUP  5.61
assign  ((resid   66 and name HB*  )) ((resid   71 and name HA   ))   4.51  2.71  0.00 ! #SUP  2.96
assign  ((resid   66 and name HB*  )) ((resid   96 and name HB*  ))   4.14  2.34  0.00 ! #SUP  1.50
assign  ((resid   66 and name HB*  )) ((resid   72 and name HN   ))   4.70  2.90  0.00 ! #SUP  4.00
assign  ((resid   66 and name HB*  )) ((resid   67 and name HN   ))   3.74  1.94  0.00 ! #SUP  3.90
assign  ((resid   66 and name HB*  )) ((resid   71 and name HA   ))   4.22  2.42  0.00 ! #SUP  4.00
assign  ((resid   66 and name HB*  )) ((resid   96 and name HB*  ))   4.10  2.30  0.00 ! #SUP  4.12
assign  ((resid   66 and name HB*  )) ((resid   96 and name HB*  ))   4.90  3.10  0.00 ! #SUP  3.07
assign  ((resid   65 and name HG1* )) ((resid   66 and name HB*  ))   4.51  2.71  0.00 ! #SUP  3.88
assign  ((resid   66 and name HB*  )) ((resid   72 and name HG*  ))   4.87  3.07  0.00 ! #SUP  6.16
assign  ((resid   80 and name HA   )) ((resid   83 and name HN   ))   3.94  2.14  0.00 ! #SUP  5.95
assign  ((resid   80 and name HA   )) ((resid   83 and name HB   ))   3.67  1.87  0.00 ! #SUP  2.25
assign  ((resid   83 and name HA   )) ((resid   83 and name HG12 ))   3.49  1.69  0.00 ! #SUP  5.39
assign  ((resid   83 and name HA   )) ((resid   83 and name HG11 ))   3.50  1.70  0.00 ! #SUP  5.63
assign  ((resid   30 and name HN   )) ((resid   45 and name HB2  ))   4.33  2.53  0.00 ! #SUP  1.50
assign  ((resid   30 and name HN   )) ((resid   45 and name HB1  ))   4.96  3.16  0.00 ! #SUP  1.50
assign  ((resid    8 and name HA   )) ((resid   11 and name HN   ))   4.05  2.25  0.00 ! #SUP  6.76
assign  ((resid    8 and name HA   )) ((resid   11 and name HG   ))   4.14  2.34  0.00 ! #SUP  3.30
assign  ((resid    8 and name HA   )) ((resid   11 and name HD1* ))   3.54  1.74  0.00 ! #SUP  5.00
assign  ((resid    8 and name HA   )) ((resid   65 and name HG2* ))   3.81  2.01  0.00 ! #SUP  3.99
assign  ((resid    8 and name HA   )) ((resid   10 and name HN   ))   4.40  2.60  0.00 ! #SUP  6.75
assign  ((resid   45 and name HB1  )) ((resid   46 and name HN   ))   3.60  1.80  0.00 ! #SUP  5.02
assign  ((resid  117 and name HB*  )) ((resid  118 and name HA   ))   4.97  3.17  0.00 ! #SUP  1.06
assign  ((resid   44 and name HN   )) ((resid   60 and name HA   ))   4.85  3.05  0.00 ! #SUP  3.65
assign  ((resid   60 and name HA   )) ((resid   61 and name HN   ))   3.29  1.49  0.00 ! #SUP  4.89
assign  ((resid   44 and name HA   )) ((resid   60 and name HA   ))   4.61  2.81  0.00 ! #SUP  5.46
assign  ((resid   59 and name HA   )) ((resid   60 and name HA   ))   4.53  2.73  0.00 ! #SUP  2.20
assign  ((resid   43 and name HB   )) ((resid   60 and name HA   ))   4.11  2.31  0.00 ! #SUP  4.48
assign  ((resid   60 and name HA   )) ((resid  103 and name HD2* ))   4.40  2.60  0.00 ! #SUP  2.38
assign  ((resid   43 and name HG2* )) ((resid   60 and name HA   ))   3.85  2.05  0.00 ! #SUP  6.24
assign  ((resid   43 and name HD1* )) ((resid   60 and name HA   ))   5.25  3.45  0.00 ! #SUP  2.49
assign  ((resid   89 and name HA   )) ((resid   90 and name HA*  ))   4.19  2.39  0.00 ! #SUP  5.93
assign  ((resid   89 and name HA   )) ((resid   90 and name HA*  ))   4.56  2.76  0.00 ! #SUP  6.40
assign  ((resid   89 and name HA   )) ((resid   89 and name HG11 ))   4.25  2.45  0.00 ! #SUP  5.44
assign  ((resid   22 and name HG1  )) ((resid   89 and name HA   ))   4.92  3.12  0.00 ! #SUP  1.50
assign  ((resid   89 and name HA   )) ((resid   90 and name HN   ))   3.62  1.82  0.00 ! #SUP  5.93
assign  ((resid   65 and name HA   )) ((resid   73 and name HA   ))   4.52  2.72  0.00 ! #SUP  2.58
assign  ((resid   22 and name HB2  )) ((resid   89 and name HA   ))   4.45  2.65  0.00 ! #SUP  1.50
assign  ((resid  106 and name HB1  )) ((resid  107 and name HA   ))   4.89  3.09  0.00 ! #SUP  6.11
assign  ((resid   65 and name HA   )) ((resid   65 and name HG2* ))   3.66  1.86  0.00 ! #SUP  4.00
assign  ((resid  110 and name HA   )) ((resid  111 and name HN   ))   3.50  1.70  0.00 ! #SUP  4.68
assign  ((resid   86 and name HN   )) ((resid   86 and name HB*  ))   3.56  1.76  0.00 ! #SUP  3.13
assign  ((resid  113 and name HN   )) ((resid  113 and name HB2  ))   3.37  1.57  0.00 ! #SUP  3.61
assign  ((resid  113 and name HA   )) ((resid  113 and name HB2  ))   2.97  1.17  0.00 ! #SUP  3.34
assign  ((resid  113 and name HB2  )) ((resid  115 and name HG*  ))   4.73  2.93  0.00 ! #SUP  0.93
assign  ((resid  112 and name HG2* )) ((resid  113 and name HB1  ))   4.95  3.15  0.00 ! #SUP  3.09
assign  ((resid  113 and name HN   )) ((resid  113 and name HB1  ))   3.41  1.61  0.00 ! #SUP  4.44
assign  ((resid   36 and name HA   )) ((resid   37 and name HA   ))   4.63  2.83  0.00 ! #SUP  8.00
assign  ((resid   37 and name HA   )) ((resid   38 and name HN   ))   3.39  1.59  0.00 ! #SUP  8.09
assign  ((resid   37 and name HA   )) ((resid   39 and name HN   ))   4.10  2.30  0.00 ! #SUP  3.34
assign  ((resid   37 and name HA   )) ((resid   38 and name HA   ))   4.61  2.81  0.00 ! #SUP  5.19
assign  ((resid    2 and name HA   )) ((resid    3 and name HN   ))   2.82  1.02  0.00 ! #SUP  6.57
assign  ((resid   88 and name HA   )) ((resid   89 and name HN   ))   2.80  1.00  0.00 ! #SUP  6.97
assign  ((resid  112 and name HA   )) ((resid  113 and name HN   ))   3.02  1.22  0.00 ! #SUP  3.76
assign  ((resid    9 and name HB*  )) ((resid   10 and name HN   ))   3.86  2.06  0.00 ! #SUP  5.65
assign  ((resid    9 and name HN   )) ((resid    9 and name HB*  ))   3.01  1.21  0.00 ! #SUP  5.68
assign  ((resid    9 and name HB*  )) ((resid   11 and name HN   ))   4.88  3.08  0.00 ! #SUP  4.35
assign  ((resid    9 and name HA   )) ((resid    9 and name HB*  ))   2.78  0.98  0.00 ! #SUP  4.46
assign  ((resid    8 and name HG*  )) ((resid    9 and name HB*  ))   4.22  2.42  0.00 ! #SUP  5.08
assign  ((resid    8 and name HB1  )) ((resid    9 and name HB*  ))   4.78  2.98  0.00 ! #SUP  4.66
assign  ((resid   88 and name HA   )) ((resid   89 and name HD1* ))   4.76  2.96  0.00 ! #SUP  5.18
assign  ((resid   47 and name HA   )) ((resid   48 and name HN   ))   2.96  1.16  0.00 ! #SUP  5.40
assign  ((resid   64 and name HA   )) ((resid   64 and name HG12 ))   3.80  2.00  0.00 ! #SUP  5.70
assign  ((resid   64 and name HA   )) ((resid   64 and name HG2* ))   3.44  1.64  0.00 ! #SUP  6.38
assign  ((resid  118 and name HA   )) ((resid  119 and name HN   ))   3.47  1.67  0.00 ! #SUP  2.44
assign  ((resid  120 and name HA   )) ((resid  120 and name HG11 ))   3.98  2.18  0.00 ! #SUP  5.49
assign  ((resid   24 and name HB2  )) ((resid   89 and name HD1* ))   4.78  2.98  0.00 ! #SUP  3.09
assign  ((resid   24 and name HB2  )) ((resid   89 and name HG2* ))   4.99  3.19  0.00 ! #SUP  2.35
assign  ((resid   84 and name HA   )) ((resid   86 and name HN   ))   4.37  2.57  0.00 ! #SUP  2.61
assign  ((resid   27 and name HD*  )) ((resid   84 and name HA   ))   4.59  2.79  0.00 ! #SUP  0.75
assign  ((resid   84 and name HA   )) ((resid   87 and name HG12 ))   4.50  2.70  0.00 ! #SUP  2.28
assign  ((resid   83 and name HG2* )) ((resid   84 and name HA   ))   4.73  2.93  0.00 ! #SUP  6.43
assign  ((resid   70 and name HA   )) ((resid   71 and name HN   ))   3.08  1.28  0.00 ! #SUP  5.00
assign  ((resid   70 and name HA   )) ((resid   71 and name HB2  ))   4.20  2.40  0.00 ! #SUP  4.05
assign  ((resid  102 and name HA   )) ((resid  103 and name HN   ))   2.94  1.14  0.00 ! #SUP  3.88
assign  ((resid  115 and name HA   )) ((resid  116 and name HN   ))   2.90  1.10  0.00 ! #SUP  3.51
assign  ((resid  114 and name HN   )) ((resid  115 and name HA   ))   5.09  3.29  0.00 ! #SUP  3.13
assign  ((resid   20 and name HB1  )) ((resid   27 and name HA   ))   4.70  2.90  0.00 ! #SUP  0.75
assign  ((resid   27 and name HA   )) ((resid   51 and name HG2  ))   4.32  2.52  0.00 ! #SUP  1.89
assign  ((resid   42 and name HA   )) ((resid   63 and name HA   ))   3.97  2.17  0.00 ! #SUP  5.96
assign  ((resid   42 and name HB2  )) ((resid   63 and name HA   ))   4.31  2.51  0.00 ! #SUP  1.50
assign  ((resid   67 and name HA   )) ((resid   93 and name HG1* ))   4.74  2.94  0.00 ! #SUP  2.35
assign  ((resid   67 and name HA   )) ((resid   68 and name HN   ))   3.17  1.37  0.00 ! #SUP  5.55
assign  ((resid   67 and name HA   )) ((resid   95 and name HA   ))   3.82  2.02  0.00 ! #SUP  2.96
assign  ((resid    8 and name HB1  )) ((resid    9 and name HA   ))   4.41  2.61  0.00 ! #SUP  4.68
assign  ((resid    8 and name HG*  )) ((resid    9 and name HA   ))   4.27  2.47  0.00 ! #SUP  5.08
assign  ((resid   76 and name HA   )) ((resid   77 and name HN   ))   3.42  1.62  0.00 ! #SUP  2.78
assign  ((resid   18 and name HA   )) ((resid   19 and name HN   ))   2.99  1.19  0.00 ! #SUP  4.91
assign  ((resid   18 and name HA   )) ((resid   18 and name HG2* ))   3.85  2.05  0.00 ! #SUP  4.25
assign  ((resid   76 and name HA   )) ((resid   77 and name HA   ))   4.39  2.59  0.00 ! #SUP  3.43
assign  ((resid   77 and name HA   )) ((resid   80 and name HB   ))   4.45  2.65  0.00 ! #SUP  2.22
assign  ((resid   86 and name HA   )) ((resid   86 and name HB*  ))   2.73  0.93  0.00 ! #SUP  2.31
assign  ((resid   85 and name HB*  )) ((resid   86 and name HA   ))   4.28  2.48  0.00 ! #SUP  2.76
assign  ((resid   72 and name HA   )) ((resid   75 and name HN   ))   4.37  2.57  0.00 ! #SUP  4.32
assign  ((resid   72 and name HA   )) ((resid   80 and name HG*  ))   4.51  2.71  0.00 ! #SUP  1.50
assign  ((resid   72 and name HA   )) ((resid   75 and name HB2  ))   4.38  2.58  0.00 ! #SUP  5.31
assign  ((resid   72 and name HA   )) ((resid   72 and name HG*  ))   3.83  2.03  0.00 ! #SUP  4.44
assign  ((resid   71 and name HA   )) ((resid   73 and name HN   ))   3.03  1.23  0.00 ! #SUP  2.76
assign  ((resid   16 and name HA   )) ((resid   17 and name HN   ))   2.89  1.09  0.00 ! #SUP  6.71
assign  ((resid   31 and name HA   )) ((resid   44 and name HN   ))   4.32  2.52  0.00 ! #SUP  3.35
assign  ((resid   31 and name HA   )) ((resid   43 and name HA   ))   4.21  2.41  0.00 ! #SUP  3.35
assign  ((resid   87 and name HA   )) ((resid   88 and name HG*  ))   3.89  2.09  0.00 ! #SUP  6.31
assign  ((resid   87 and name HA   )) ((resid   88 and name HD1  ))   3.45  1.65  0.00 ! #SUP  7.81
assign  ((resid   87 and name HA   )) ((resid   87 and name HG12 ))   3.87  2.07  0.00 ! #SUP  6.73
assign  ((resid    5 and name HA   )) ((resid    6 and name HN   ))   3.16  1.36  0.00 ! #SUP  4.57
assign  ((resid   31 and name HA   )) ((resid   31 and name HG2* ))   3.56  1.76  0.00 ! #SUP  4.75
assign  ((resid   31 and name HA   )) ((resid   32 and name HN   ))   3.10  1.30  0.00 ! #SUP  4.37
assign  ((resid   32 and name HA   )) ((resid   42 and name HB1  ))   5.02  3.22  0.00 ! #SUP  0.02
assign  ((resid   68 and name HD22 )) ((resid   93 and name HA   ))   3.79  1.99  0.00 ! #SUP  4.75
assign  ((resid    3 and name HA   )) ((resid    4 and name HN   ))   3.06  1.26  0.00 ! #SUP  5.62
assign  ((resid   82 and name HA   )) ((resid   82 and name HB*  ))   2.99  1.19  0.00 ! #SUP  5.23
assign  ((resid   79 and name HA   )) ((resid   80 and name HG*  ))   5.23  3.43  0.00 ! #SUP  6.38
assign  ((resid    5 and name HA   )) ((resid    6 and name HB1  ))   4.61  2.81  0.00 ! #SUP  4.96
assign  ((resid    4 and name HA   )) ((resid    5 and name HA   ))   4.83  3.03  0.00 ! #SUP  4.92
assign  ((resid    5 and name HA   )) ((resid    5 and name HG2* ))   4.05  2.25  0.00 ! #SUP  3.58
assign  ((resid   30 and name HA   )) ((resid  160 and name HB*  ))   4.77  2.97  0.00 ! #SUP  3.89
assign  ((resid   93 and name HA   )) ((resid   94 and name HN   ))   2.97  1.17  0.00 ! #SUP  7.24
assign  ((resid   82 and name HA   )) ((resid   85 and name HN   ))   4.17  2.37  0.00 ! #SUP  4.00
assign  ((resid   82 and name HA   )) ((resid   82 and name HG*  ))   3.73  1.93  0.00 ! #SUP  4.51
assign  ((resid   81 and name HG*  )) ((resid   82 and name HA   ))   4.54  2.74  0.00 ! #SUP  3.96
assign  ((resid   78 and name HN   )) ((resid   79 and name HA   ))   5.12  3.32  0.00 ! #SUP  5.53
assign  ((resid   79 and name HA   )) ((resid   82 and name HN   ))   4.38  2.58  0.00 ! #SUP  3.96
assign  ((resid   79 and name HA   )) ((resid   79 and name HG2  ))   3.27  1.47  0.00 ! #SUP  7.67
assign  ((resid   79 and name HA   )) ((resid   83 and name HD1* ))   5.50  3.70  0.00 ! #SUP  2.53
assign  ((resid   22 and name HA   )) ((resid   26 and name HN   ))   4.84  3.04  0.00 ! #SUP  1.32
assign  ((resid   22 and name HA   )) ((resid   23 and name HA   ))   4.61  2.81  0.00 ! #SUP  4.08
assign  ((resid   21 and name HG2  )) ((resid   22 and name HA   ))   4.89  3.09  0.00 ! #SUP  6.94
assign  ((resid   22 and name HA   )) ((resid   27 and name HA   ))   4.24  2.44  0.00 ! #SUP  1.32
assign  ((resid   30 and name HA   )) ((resid  161 and name HN   ))   4.38  2.58  0.00 ! #SUP  3.14
assign  ((resid   30 and name HA   )) ((resid  160 and name HA   ))   3.77  1.97  0.00 ! #SUP  4.88
assign  ((resid   30 and name HA   )) ((resid  160 and name HB*  ))   4.31  2.51  0.00 ! #SUP  3.15
assign  ((resid   30 and name HA   )) ((resid   31 and name HG2* ))   4.69  2.89  0.00 ! #SUP  3.52
assign  ((resid   93 and name HA   )) ((resid   93 and name HG2* ))   3.99  2.19  0.00 ! #SUP  5.48
assign  ((resid   32 and name HN   )) ((resid   43 and name HA   ))   4.12  2.32  0.00 ! #SUP  4.17
assign  ((resid   43 and name HA   )) ((resid   44 and name HN   ))   3.33  1.53  0.00 ! #SUP  5.50
assign  ((resid   22 and name HA   )) ((resid   23 and name HN   ))   3.52  1.72  0.00 ! #SUP  7.36
assign  ((resid   22 and name HA   )) ((resid   22 and name HD1  ))   4.27  2.47  0.00 ! #SUP  6.57
assign  ((resid   15 and name HA   )) ((resid   99 and name HN   ))   4.26  2.46  0.00 ! #SUP  2.96
assign  ((resid   15 and name HA   )) ((resid   16 and name HN   ))   3.04  1.24  0.00 ! #SUP  6.76
assign  ((resid   15 and name HA   )) ((resid   16 and name HD1* ))   4.39  2.59  0.00 ! #SUP  7.05
assign  ((resid   48 and name HA   )) ((resid   49 and name HN   ))   2.87  1.07  0.00 ! #SUP  5.78
assign  ((resid   48 and name HA   )) ((resid   50 and name HN   ))   3.96  2.16  0.00 ! #SUP  3.52
assign  ((resid   48 and name HA   )) ((resid   49 and name HA   ))   4.56  2.76  0.00 ! #SUP  5.45
assign  ((resid   48 and name HA   )) ((resid   48 and name HG   ))   3.12  1.32  0.00 ! #SUP  5.73
assign  ((resid   48 and name HA   )) ((resid   53 and name HB*  ))   3.25  1.45  0.00 ! #SUP  3.29
assign  ((resid    3 and name HA   )) ((resid    4 and name HA   ))   4.83  3.03  0.00 ! #SUP  4.58
assign  ((resid    4 and name HA   )) ((resid    5 and name HG2* ))   4.74  2.94  0.00 ! #SUP  3.75
assign  ((resid    4 and name HA   )) ((resid   11 and name HD2* ))   5.33  3.53  0.00 ! #SUP  1.41
assign  ((resid   92 and name HA   )) ((resid   93 and name HN   ))   3.20  1.40  0.00 ! #SUP  5.82
assign  ((resid   21 and name HA   )) ((resid   92 and name HA   ))   3.48  1.68  0.00 ! #SUP  9.16
assign  ((resid   91 and name HB*  )) ((resid   92 and name HA   ))   4.68  2.88  0.00 ! #SUP  4.43
assign  ((resid   20 and name HN   )) ((resid   92 and name HA   ))   4.47  2.67  0.00 ! #SUP  5.19
assign  ((resid   92 and name HA   )) ((resid   93 and name HG1* ))   5.37  3.57  0.00 ! #SUP  6.34
assign  ((resid   44 and name HA   )) ((resid  103 and name HG   ))   3.46  1.66  0.00 ! #SUP  0.75
assign  ((resid   57 and name HA   )) ((resid   57 and name HG*  ))   3.41  1.61  0.00 ! #SUP  2.23
assign  ((resid   54 and name HA   )) ((resid   54 and name HB2  ))   2.91  1.11  0.00 ! #SUP  6.31
assign  ((resid  113 and name HA   )) ((resid  114 and name HN   ))   2.68  0.88  0.00 ! #SUP  4.85
assign  ((resid   54 and name HA   )) ((resid   54 and name HB1  ))   2.98  1.18  0.00 ! #SUP  6.44
assign  ((resid   66 and name HA   )) ((resid   67 and name HB   ))   4.79  2.99  0.00 ! #SUP  4.04
assign  ((resid   66 and name HA   )) ((resid   73 and name HN   ))   4.12  2.32  0.00 ! #SUP  3.00
assign  ((resid   66 and name HA   )) ((resid   72 and name HN   ))   3.71  1.91  0.00 ! #SUP  5.91
assign  ((resid   66 and name HA   )) ((resid   71 and name HA   ))   4.06  2.26  0.00 ! #SUP  4.44
assign  ((resid   66 and name HA   )) ((resid   72 and name HG*  ))   3.87  2.07  0.00 ! #SUP  8.31
assign  ((resid   98 and name HA   )) ((resid   99 and name HN   ))   3.33  1.53  0.00 ! #SUP  3.73
assign  ((resid   75 and name HA   )) ((resid   76 and name HN   ))   2.97  1.17  0.00 ! #SUP  5.56
assign  ((resid   62 and name HA   )) ((resid   63 and name HN   ))   3.16  1.36  0.00 ! #SUP  3.17
assign  ((resid   62 and name HA   )) ((resid   97 and name HD*  ))   4.19  2.39  0.00 ! #SUP  3.08
assign  ((resid   55 and name HA   )) ((resid   56 and name HA*  ))   4.26  2.46  0.00 ! #SUP  3.39
assign  ((resid   73 and name HA   )) ((resid   74 and name HN   ))   3.53  1.73  0.00 ! #SUP  4.38
assign  ((resid   40 and name HA   )) ((resid   41 and name HN   ))   3.37  1.57  0.00 ! #SUP  6.75
assign  ((resid   29 and name HA   )) ((resid   30 and name HN   ))   3.42  1.62  0.00 ! #SUP  4.62
assign  ((resid   29 and name HA   )) ((resid   46 and name HA   ))   4.01  2.21  0.00 ! #SUP  1.78
assign  ((resid   29 and name HA   )) ((resid   52 and name HB*  ))   4.85  3.05  0.00 ! #SUP  2.44
assign  ((resid   29 and name HA   )) ((resid   43 and name HG2* ))   4.06  2.26  0.00 ! #SUP  0.02
assign  ((resid   29 and name HA   )) ((resid   29 and name HD*  ))   4.70  2.90  0.00 ! #SUP  4.94
assign  ((resid   10 and name HA   )) ((resid   10 and name HB1  ))   2.88  1.08  0.00 ! #SUP  3.68
assign  ((resid    6 and name HA   )) ((resid   73 and name HA   ))   5.31  3.51  0.00 ! #SUP  2.97
assign  ((resid    6 and name HA   )) ((resid    6 and name HG2  ))   3.99  2.19  0.00 ! #SUP  5.46
assign  ((resid    6 and name HA   )) ((resid   73 and name HD2* ))   4.25  2.45  0.00 ! #SUP  4.93
assign  ((resid   58 and name HA   )) ((resid   58 and name HE*  ))   5.07  3.27  0.00 ! #SUP  5.21
assign  ((resid   35 and name HA   )) ((resid   77 and name HA   ))   4.11  2.31  0.00 ! #SUP  2.25
assign  ((resid   35 and name HA   )) ((resid   77 and name HB1  ))   3.69  1.89  0.00 ! #SUP  2.25
assign  ((resid   35 and name HA   )) ((resid   36 and name HG2  ))   3.92  2.12  0.00 ! #SUP  4.49
assign  ((resid   -1 and name HA   )) ((resid    0 and name HN   ))   3.46  1.66  0.00 ! #SUP  2.55
assign  ((resid    9 and name HB*  )) ((resid   10 and name HA   ))   4.32  2.52  0.00 ! #SUP  4.44
assign  ((resid  123 and name HA   )) ((resid  124 and name HN   ))   2.83  1.03  0.00 ! #SUP  5.59
assign  ((resid  123 and name HA   )) ((resid  123 and name HG*  ))   3.92  2.12  0.00 ! #SUP  3.98
assign  ((resid   58 and name HA   )) ((resid   99 and name HE   ))   4.80  3.00  0.00 ! #SUP  4.78
assign  ((resid   58 and name HA   )) ((resid   59 and name HN   ))   3.19  1.39  0.00 ! #SUP  4.79
assign  ((resid   58 and name HA   )) ((resid   99 and name HH2* ))   4.28  2.48  0.00 ! #SUP  3.55
assign  ((resid   58 and name HA   )) ((resid   58 and name HG1  ))   3.87  2.07  0.00 ! #SUP  4.05
assign  ((resid   58 and name HA   )) ((resid   97 and name HD*  ))   3.85  2.05  0.00 ! #SUP  6.46
assign  ((resid  105 and name HA   )) ((resid  106 and name HN   ))   3.32  1.52  0.00 ! #SUP  2.20
assign  ((resid  105 and name HA   )) ((resid  105 and name HB*  ))   3.01  1.21  0.00 ! #SUP  2.00
assign  ((resid   -1 and name HA   )) ((resid   -1 and name HG1  ))   4.13  2.33  0.00 ! #SUP  3.28
assign  ((resid    3 and name HE*  )) ((resid   11 and name HA   ))   4.34  2.54  0.00 ! #SUP  3.38
assign  ((resid   49 and name HA   )) ((resid   54 and name HD1* ))   3.77  1.97  0.00 ! #SUP  5.74
assign  ((resid   52 and name HA   )) ((resid   55 and name HB1  ))   4.24  2.44  0.00 ! #SUP  2.96
assign  ((resid   52 and name HA   )) ((resid   55 and name HN   ))   4.32  2.52  0.00 ! #SUP  3.14
assign  ((resid   52 and name HA   )) ((resid   55 and name HB2  ))   4.37  2.57  0.00 ! #SUP  1.90
assign  ((resid   17 and name HA   )) ((resid   96 and name HA   ))   3.48  1.68  0.00 ! #SUP  2.99
assign  ((resid   96 and name HA   )) ((resid   97 and name HN   ))   3.17  1.37  0.00 ! #SUP  5.53
assign  ((resid   21 and name HN   )) ((resid   21 and name HA   ))   2.82  1.02  0.00 ! #SUP  6.19
assign  ((resid   11 and name HA   )) ((resid   11 and name HD1* ))   4.13  2.33  0.00 ! #SUP  6.35
assign  ((resid   11 and name HA   )) ((resid   12 and name HN   ))   3.31  1.51  0.00 ! #SUP  7.90
assign  ((resid   49 and name HA   )) ((resid   53 and name HB*  ))   4.58  2.78  0.00 ! #SUP  6.94
assign  ((resid   68 and name HA   )) ((resid   69 and name HN   ))   3.28  1.48  0.00 ! #SUP  5.63
assign  ((resid   59 and name HA   )) ((resid   59 and name HG*  ))   3.44  1.64  0.00 ! #SUP  3.45
assign  ((resid   25 and name HA   )) ((resid   89 and name HG12 ))   3.28  1.48  0.00 ! #SUP  3.87
assign  ((resid   78 and name HA   )) ((resid   81 and name HN   ))   3.98  2.18  0.00 ! #SUP  2.31
assign  ((resid   78 and name HA   )) ((resid   82 and name HN   ))   4.45  2.65  0.00 ! #SUP  2.31
assign  ((resid   78 and name HA   )) ((resid   81 and name HG*  ))   3.52  1.72  0.00 ! #SUP  4.00
assign  ((resid   53 and name HA   )) ((resid   56 and name HN   ))   4.68  2.88  0.00 ! #SUP  2.79
assign  ((resid   19 and name HA   )) ((resid   95 and name HN   ))   3.51  1.71  0.00 ! #SUP  8.83
assign  ((resid   19 and name HA   )) ((resid   94 and name HB1  ))   4.96  3.16  0.00 ! #SUP  5.06
assign  ((resid   19 and name HA   )) ((resid   19 and name HG*  ))   4.10  2.30  0.00 ! #SUP  6.92
assign  ((resid   19 and name HA   )) ((resid   19 and name HG*  ))   4.13  2.33  0.00 ! #SUP  6.72
assign  ((resid   19 and name HA   )) ((resid   93 and name HG2* ))   4.97  3.17  0.00 ! #SUP  4.99
assign  ((resid   59 and name HA   )) ((resid   60 and name HN   ))   2.80  1.00  0.00 ! #SUP  4.11
assign  ((resid   19 and name HA   )) ((resid   20 and name HN   ))   2.96  1.16  0.00 ! #SUP  7.55
assign  ((resid   18 and name HG2* )) ((resid   19 and name HA   ))   5.06  3.26  0.00 ! #SUP  5.04
assign  ((resid   14 and name HA   )) ((resid   15 and name HN   ))   2.74  0.94  0.00 ! #SUP  7.17
assign  ((resid   39 and name HA   )) ((resid   40 and name HN   ))   3.21  1.41  0.00 ! #SUP  4.48
assign  ((resid  108 and name HA   )) ((resid  108 and name HB2  ))   3.00  1.20  0.00 ! #SUP  4.00
assign  ((resid    1 and name HA   )) ((resid    1 and name HG*  ))   3.59  1.79  0.00 ! #SUP  7.91
assign  ((resid    1 and name HA   )) ((resid    2 and name HD1  ))   2.89  1.09  0.00 ! #SUP  7.41
assign  ((resid   12 and name HA   )) ((resid   13 and name HN   ))   2.93  1.13  0.00 ! #SUP  6.52
assign  ((resid   12 and name HA   )) ((resid   12 and name HG1  ))   3.43  1.63  0.00 ! #SUP  5.93
assign  ((resid  122 and name HA   )) ((resid  123 and name HN   ))   2.89  1.09  0.00 ! #SUP  5.12
assign  ((resid   17 and name HA   )) ((resid   97 and name HN   ))   3.89  2.09  0.00 ! #SUP  7.18
assign  ((resid   17 and name HA   )) ((resid   18 and name HN   ))   2.89  1.09  0.00 ! #SUP  5.44
assign  ((resid   20 and name HN   )) ((resid   94 and name HA   ))   4.13  2.33  0.00 ! #SUP  7.44
assign  ((resid   41 and name HA   )) ((resid   41 and name HG   ))   4.22  2.42  0.00 ! #SUP  5.71
assign  ((resid   95 and name HA   )) ((resid   96 and name HN   ))   3.28  1.48  0.00 ! #SUP  6.18
assign  ((resid   95 and name HA   )) ((resid   95 and name HD2* ))   3.76  1.96  0.00 ! #SUP  5.00
assign  ((resid   46 and name HA   )) ((resid   46 and name HD2* ))   3.79  1.99  0.00 ! #SUP  5.61
assign  ((resid  121 and name HA   )) ((resid  121 and name HD*  ))   3.47  1.67  0.00 ! #SUP  3.89
assign  ((resid   94 and name HA   )) ((resid   95 and name HN   ))   2.93  1.13  0.00 ! #SUP  6.44
assign  ((resid   19 and name HA   )) ((resid   94 and name HA   ))   3.57  1.77  0.00 ! #SUP  7.57
assign  ((resid   41 and name HA   )) ((resid   42 and name HN   ))   3.26  1.46  0.00 ! #SUP  5.73
assign  ((resid  111 and name HA   )) ((resid  111 and name HB2  ))   2.96  1.16  0.00 ! #SUP  5.12
assign  ((resid  111 and name HN   )) ((resid  111 and name HA   ))   2.77  0.97  0.00 ! #SUP  6.88
assign  ((resid  111 and name HA   )) ((resid  112 and name HN   ))   3.44  1.64  0.00 ! #SUP  5.95
assign  ((resid  103 and name HA   )) ((resid  104 and name HD2  ))   3.90  2.10  0.00 ! #SUP  4.83
assign  ((resid  103 and name HA   )) ((resid  104 and name HD1  ))   3.71  1.91  0.00 ! #SUP  6.87
assign  ((resid  103 and name HA   )) ((resid  103 and name HD2* ))   3.74  1.94  0.00 ! #SUP  5.12
assign  ((resid   42 and name HE21 )) ((resid  103 and name HA   ))   4.52  2.72  0.00 ! #SUP  1.26
assign  ((resid   42 and name HE22 )) ((resid  103 and name HA   ))   4.24  2.44  0.00 ! #SUP  3.84
assign  ((resid   19 and name HB*  )) ((resid   94 and name HA   ))   3.73  1.93  0.00 ! #SUP  4.15
assign  ((resid   41 and name HA   )) ((resid   41 and name HD1* ))   3.65  1.85  0.00 ! #SUP  5.38
assign  ((resid   42 and name HA   )) ((resid   64 and name HA   ))   5.03  3.23  0.00 ! #SUP  3.14
assign  ((resid   42 and name HA   )) ((resid   43 and name HD1* ))   4.71  2.91  0.00 ! #SUP  6.37
assign  ((resid   42 and name HA   )) ((resid   43 and name HN   ))   3.56  1.76  0.00 ! #SUP  6.49
assign  ((resid   36 and name HA   )) ((resid   37 and name HD1  ))   2.90  1.10  0.00 ! #SUP  9.69
assign  ((resid   20 and name HA   )) ((resid   20 and name HD1* ))   3.27  1.47  0.00 ! #SUP  7.27
assign  ((resid   97 and name HA   )) ((resid   98 and name HN   ))   3.46  1.66  0.00 ! #SUP  5.30
assign  ((resid   65 and name HN   )) ((resid   97 and name HA   ))   4.24  2.44  0.00 ! #SUP  4.88
assign  ((resid   64 and name HA   )) ((resid   97 and name HA   ))   4.14  2.34  0.00 ! #SUP  6.52
assign  ((resid   97 and name HA   )) ((resid   98 and name HB*  ))   4.89  3.09  0.00 ! #SUP  3.17
assign  ((resid   20 and name HA   )) ((resid   20 and name HG   ))   3.26  1.46  0.00 ! #SUP  4.65
assign  ((resid   20 and name HA   )) ((resid   21 and name HB*  ))   4.46  2.66  0.00 ! #SUP  6.00
assign  ((resid   87 and name HD1* )) ((resid   88 and name HD2  ))   5.50  3.70  0.00 ! #SUP  6.91
assign  ((resid  118 and name HG*  )) ((resid  119 and name HA   ))   4.53  2.73  0.00 ! #SUP  5.27
assign  ((resid  119 and name HA   )) ((resid  120 and name HN   ))   3.09  1.29  0.00 ! #SUP  6.45
assign  ((resid   87 and name HA   )) ((resid   88 and name HD2  ))   4.03  2.23  0.00 ! #SUP  7.75
assign  ((resid  109 and name HB2  )) ((resid  110 and name HD*  ))   4.72  2.92  0.00 ! #SUP  3.99
assign  ((resid  109 and name HA   )) ((resid  110 and name HD*  ))   3.12  1.32  0.00 ! #SUP  4.82
assign  ((resid  106 and name HB2  )) ((resid  107 and name HD2  ))   4.70  2.90  0.00 ! #SUP  5.45
assign  ((resid  106 and name HA   )) ((resid  107 and name HD2  ))   3.09  1.29  0.00 ! #SUP  5.25
assign  ((resid    8 and name HD2  )) ((resid   73 and name HD2* ))   4.70  2.90  0.00 ! #SUP  2.38
assign  ((resid    8 and name HD2  )) ((resid    9 and name HN   ))   4.63  2.83  0.00 ! #SUP  9.37
assign  ((resid    8 and name HD1  )) ((resid    9 and name HN   ))   4.79  2.99  0.00 ! #SUP  9.24
assign  ((resid    1 and name HA   )) ((resid    2 and name HD2  ))   2.96  1.16  0.00 ! #SUP  7.64
assign  ((resid  107 and name HD2  )) ((resid  108 and name HN   ))   4.29  2.49  0.00 ! #SUP  8.58
assign  ((resid  103 and name HD1* )) ((resid  107 and name HD2  ))   4.89  3.09  0.00 ! #SUP  2.05
assign  ((resid  107 and name HD1  )) ((resid  108 and name HA   ))   4.96  3.16  0.00 ! #SUP  3.51
assign  ((resid  107 and name HD1  )) ((resid  108 and name HN   ))   4.51  2.71  0.00 ! #SUP  9.03
assign  ((resid  106 and name HA   )) ((resid  107 and name HD1  ))   3.38  1.58  0.00 ! #SUP  5.31
assign  ((resid  101 and name HA   )) ((resid  102 and name HD*  ))   3.93  2.13  0.00 ! #SUP  1.29
assign  ((resid  106 and name HB2  )) ((resid  107 and name HD1  ))   4.86  3.06  0.00 ! #SUP  5.81
assign  ((resid  106 and name HB1  )) ((resid  107 and name HD1  ))   4.68  2.88  0.00 ! #SUP  6.02
assign  ((resid  103 and name HD1* )) ((resid  107 and name HD1  ))   4.90  3.10  0.00 ! #SUP  2.25
assign  ((resid    1 and name HB1  )) ((resid    2 and name HD1  ))   3.83  2.03  0.00 ! #SUP  6.58
assign  ((resid    1 and name HG*  )) ((resid    2 and name HD1  ))   4.05  2.25  0.00 ! #SUP  6.98
assign  ((resid  106 and name HA   )) ((resid  107 and name HG*  ))   3.98  2.18  0.00 ! #SUP  4.76
assign  ((resid  124 and name HA   )) ((resid  125 and name HD2  ))   3.10  1.30  0.00 ! #SUP  3.00
assign  ((resid  124 and name HA   )) ((resid  125 and name HD1  ))   3.04  1.24  0.00 ! #SUP  3.71
assign  ((resid   36 and name HN   )) ((resid   37 and name HD2  ))   5.08  3.28  0.00 ! #SUP  5.61
assign  ((resid   36 and name HB1  )) ((resid   37 and name HD1  ))   3.90  2.10  0.00 ! #SUP  6.53
assign  ((resid   36 and name HA   )) ((resid   37 and name HD2  ))   3.22  1.42  0.00 ! #SUP  7.92
assign  ((resid   36 and name HB2  )) ((resid   37 and name HD1  ))   3.51  1.71  0.00 ! #SUP  6.21
assign  ((resid  103 and name HD2* )) ((resid  104 and name HD2  ))   4.53  2.73  0.00 ! #SUP  4.50
assign  ((resid   42 and name HE22 )) ((resid  104 and name HD1  ))   5.12  3.32  0.00 ! #SUP  1.73
assign  ((resid  103 and name HB1  )) ((resid  104 and name HD1  ))   4.70  2.90  0.00 ! #SUP  6.23
assign  ((resid  103 and name HD2* )) ((resid  104 and name HD1  ))   4.30  2.50  0.00 ! #SUP  5.89
assign  ((resid    7 and name HA   )) ((resid    8 and name HG*  ))   4.46  2.66  0.00 ! #SUP  6.32
assign  ((resid    7 and name HA   )) ((resid    8 and name HD2  ))   3.30  1.50  0.00 ! #SUP  7.33
assign  ((resid    7 and name HA   )) ((resid    8 and name HD1  ))   3.33  1.53  0.00 ! #SUP  7.79
assign  ((resid    7 and name HA   )) ((resid    8 and name HG*  ))   3.96  2.16  0.00 ! #SUP  7.38
assign  ((resid    7 and name HA   )) ((resid    7 and name HD21 ))   4.42  2.62  0.00 ! #SUP  6.37
assign  ((resid   20 and name HD1* )) ((resid   51 and name HD2  ))   5.50  3.70  0.00 ! #SUP  3.72
assign  ((resid   51 and name HD2  )) ((resid   52 and name HN   ))   5.02  3.22  0.00 ! #SUP  7.10
assign  ((resid   51 and name HD1  )) ((resid   52 and name HN   ))   4.56  2.76  0.00 ! #SUP  8.03
assign  ((resid   50 and name HN   )) ((resid   51 and name HD1  ))   5.00  3.20  0.00 ! #SUP  4.65
assign  ((resid   51 and name HD1  )) ((resid   52 and name HB*  ))   5.45  3.65  0.00 ! #SUP  4.98
assign  ((resid   20 and name HD1* )) ((resid   51 and name HD1  ))   5.50  3.70  0.00 ! #SUP  4.14
assign  ((resid    7 and name HA   )) ((resid    9 and name HN   ))   4.30  2.50  0.00 ! #SUP  7.68
assign  ((resid   20 and name HB2  )) ((resid   93 and name HG2* ))   4.96  3.16  0.00 ! #SUP  1.73
assign  ((resid   20 and name HB2  )) ((resid   21 and name HN   ))   4.95  3.15  0.00 ! #SUP  7.25
assign  ((resid   20 and name HB1  )) ((resid   20 and name HD2* ))   4.09  2.29  0.00 ! #SUP  6.16
assign  ((resid   56 and name HA*  )) ((resid   57 and name HB1  ))   4.55  2.75  0.00 ! #SUP  3.24
assign  ((resid   56 and name HA*  )) ((resid   58 and name HN   ))   4.62  2.82  0.00 ! #SUP  4.10
assign  ((resid   34 and name HA1  )) ((resid   41 and name HD2* ))   4.41  2.61  0.00 ! #SUP  4.24
assign  ((resid   34 and name HA1  )) ((resid   41 and name HG   ))   4.83  3.03  0.00 ! #SUP  4.21
assign  ((resid   34 and name HA2  )) ((resid   41 and name HD2* ))   4.49  2.69  0.00 ! #SUP  3.62
assign  ((resid   95 and name HB*  )) ((resid   96 and name HA   ))   5.05  3.25  0.00 ! #SUP  4.03
assign  ((resid   94 and name HA   )) ((resid   95 and name HB*  ))   4.80  3.00  0.00 ! #SUP  4.03
assign  ((resid   34 and name HA2  )) ((resid   35 and name HA   ))   4.79  2.99  0.00 ! #SUP  3.89
assign  ((resid   28 and name HA2  )) ((resid   47 and name HG1* ))   5.06  3.26  0.00 ! #SUP  2.25
assign  ((resid   28 and name HA2  )) ((resid   47 and name HB   ))   4.57  2.77  0.00 ! #SUP  3.54
assign  ((resid   95 and name HB*  )) ((resid   96 and name HN   ))   4.58  2.78  0.00 ! #SUP  6.11
assign  ((resid   74 and name HA1  )) ((resid   75 and name HN   ))   3.40  1.60  0.00 ! #SUP  3.24
assign  ((resid   13 and name HA2  )) ((resid  100 and name HA1  ))   4.98  3.18  0.00 ! #SUP  2.96
assign  ((resid   99 and name HG*  )) ((resid  100 and name HA2  ))   4.68  2.88  0.00 ! #SUP  3.20
assign  ((resid   13 and name HA2  )) ((resid  100 and name HA2  ))   4.73  2.93  0.00 ! #SUP  0.75
assign  ((resid    0 and name HA*  )) ((resid    1 and name HG*  ))   4.97  3.17  0.00 ! #SUP  4.58
assign  ((resid    0 and name HA*  )) ((resid    1 and name HD*  ))   4.91  3.11  0.00 ! #SUP  4.55
assign  ((resid   50 and name HA1  )) ((resid   52 and name HN   ))   3.95  2.15  0.00 ! #SUP  4.14
assign  ((resid   50 and name HA1  )) ((resid   54 and name HG   ))   3.95  2.15  0.00 ! #SUP  1.21
assign  ((resid   90 and name HA*  )) ((resid   91 and name HB*  ))   4.72  2.92  0.00 ! #SUP  3.11
assign  ((resid   21 and name HG1  )) ((resid   90 and name HA*  ))   4.69  2.89  0.00 ! #SUP  3.53
assign  ((resid   50 and name HA2  )) ((resid   51 and name HG2  ))   5.01  3.21  0.00 ! #SUP  5.81
assign  ((resid   50 and name HA2  )) ((resid   52 and name HB*  ))   5.23  3.43  0.00 ! #SUP  1.42
assign  ((resid   89 and name HB   )) ((resid   90 and name HA*  ))   4.58  2.78  0.00 ! #SUP  4.46
assign  ((resid   21 and name HG1  )) ((resid   90 and name HA*  ))   4.97  3.17  0.00 ! #SUP  3.04
assign  ((resid   97 and name HB*  )) ((resid   98 and name HN   ))   5.04  3.24  0.00 ! #SUP  4.17
assign  ((resid   62 and name HB1  )) ((resid   97 and name HB*  ))   5.01  3.21  0.00 ! #SUP  0.75
assign  ((resid   97 and name HB*  )) ((resid   97 and name HD*  ))   4.00  2.20  0.00 ! #SUP  5.00
assign  ((resid   13 and name HA1  )) ((resid   14 and name HN   ))   3.33  1.53  0.00 ! #SUP  5.71
assign  ((resid   13 and name HA2  )) ((resid   14 and name HN   ))   3.47  1.67  0.00 ! #SUP  5.18
assign  ((resid   13 and name HA2  )) ((resid   14 and name HD*  ))   4.19  2.39  0.00 ! #SUP  4.99
assign  ((resid   13 and name HA2  )) ((resid   14 and name HG2  ))   5.28  3.48  0.00 ! #SUP  4.85
assign  ((resid   43 and name HG2* )) ((resid   61 and name HA2  ))   5.34  3.54  0.00 ! #SUP  4.86
assign  ((resid   61 and name HA2  )) ((resid  103 and name HN   ))   5.00  3.20  0.00 ! #SUP  1.65
assign  ((resid  121 and name HB*  )) ((resid  121 and name HD*  ))   3.10  1.30  0.00 ! #SUP  4.09
assign  ((resid   13 and name HA1  )) ((resid   14 and name HA   ))   4.44  2.64  0.00 ! #SUP  5.13
assign  ((resid   61 and name HA2  )) ((resid   62 and name HA   ))   5.11  3.31  0.00 ! #SUP  2.46
assign  ((resid   61 and name HA2  )) ((resid  103 and name HB2  ))   4.17  2.37  0.00 ! #SUP  3.04
assign  ((resid   61 and name HA2  )) ((resid  103 and name HD2* ))   4.52  2.72  0.00 ! #SUP  5.58
assign  ((resid   54 and name HB1  )) ((resid   55 and name HB2  ))   5.46  3.66  0.00 ! #SUP  5.73
assign  ((resid  113 and name HA   )) ((resid  114 and name HB*  ))   4.64  2.84  0.00 ! #SUP  4.51
assign  ((resid  114 and name HB*  )) ((resid  115 and name HN   ))   4.51  2.71  0.00 ! #SUP  4.54
assign  ((resid  114 and name HN   )) ((resid  114 and name HB*  ))   3.60  1.80  0.00 ! #SUP  5.92
assign  ((resid  114 and name HB*  )) ((resid  114 and name HG   ))   2.73  0.93  0.00 ! #SUP  4.53
assign  ((resid  114 and name HB*  )) ((resid  114 and name HD2* ))   3.96  2.16  0.00 ! #SUP  5.96
assign  ((resid   32 and name HG2* )) ((resid   33 and name HA2  ))   4.88  3.08  0.00 ! #SUP  3.20
assign  ((resid   33 and name HA2  )) ((resid   41 and name HA   ))   4.66  2.86  0.00 ! #SUP  1.27
assign  ((resid   33 and name HA1  )) ((resid   39 and name HG1  ))   5.08  3.28  0.00 ! #SUP  0.75
assign  ((resid    6 and name HN   )) ((resid    6 and name HD*  ))   4.41  2.61  0.00 ! #SUP  7.04
assign  ((resid    6 and name HA   )) ((resid    6 and name HD*  ))   4.19  2.39  0.00 ! #SUP  6.86
assign  ((resid    6 and name HD*  )) ((resid    7 and name HN   ))   4.80  3.00  0.00 ! #SUP  8.98
assign  ((resid    6 and name HB2  )) ((resid    6 and name HD*  ))   3.32  1.52  0.00 ! #SUP  5.98
assign  ((resid    6 and name HG1  )) ((resid    6 and name HD*  ))   3.03  1.23  0.00 ! #SUP  7.08
assign  ((resid   21 and name HN   )) ((resid   21 and name HD*  ))   4.31  2.51  0.00 ! #SUP  5.74
assign  ((resid   99 and name HD1  )) ((resid   99 and name HH11 ))   5.24  3.44  0.00 ! #SUP  4.22
assign  ((resid   68 and name HN   )) ((resid   94 and name HB2  ))   3.75  1.95  0.00 ! #SUP  4.35
assign  ((resid   94 and name HN   )) ((resid   94 and name HB2  ))   3.35  1.55  0.00 ! #SUP  6.19
assign  ((resid   68 and name HA   )) ((resid   94 and name HB2  ))   3.61  1.81  0.00 ! #SUP  2.96
assign  ((resid   94 and name HB2  )) ((resid   95 and name HN   ))   4.41  2.61  0.00 ! #SUP  5.79
assign  ((resid   99 and name HD2  )) ((resid   99 and name HH2* ))   4.17  2.37  0.00 ! #SUP  3.38
assign  ((resid   99 and name HA   )) ((resid   99 and name HD2  ))   5.07  3.27  0.00 ! #SUP  4.69
assign  ((resid   25 and name HN   )) ((resid   25 and name HD*  ))   4.20  2.40  0.00 ! #SUP  4.64
assign  ((resid   25 and name HA   )) ((resid   25 and name HD*  ))   3.48  1.68  0.00 ! #SUP  5.52
assign  ((resid   25 and name HB2  )) ((resid   25 and name HD*  ))   3.32  1.52  0.00 ! #SUP  4.49
assign  ((resid   25 and name HG*  )) ((resid   25 and name HD*  ))   2.82  1.02  0.00 ! #SUP  3.22
assign  ((resid   99 and name HD1  )) ((resid   99 and name HH2* ))   4.38  2.58  0.00 ! #SUP  4.19
assign  ((resid   97 and name HD*  )) ((resid   99 and name HD1  ))   5.31  3.51  0.00 ! #SUP  4.11
assign  ((resid   99 and name HB*  )) ((resid   99 and name HD1  ))   4.00  2.20  0.00 ! #SUP  5.50
assign  ((resid   46 and name HB2  )) ((resid   47 and name HN   ))   4.88  3.08  0.00 ! #SUP  7.42
assign  ((resid   41 and name HB2  )) ((resid   41 and name HD1* ))   3.92  2.12  0.00 ! #SUP  5.04
assign  ((resid   41 and name HB1  )) ((resid   42 and name HN   ))   4.38  2.58  0.00 ! #SUP  6.05
assign  ((resid   41 and name HN   )) ((resid   41 and name HB1  ))   4.08  2.28  0.00 ! #SUP  6.89
assign  ((resid   41 and name HB1  )) ((resid   41 and name HD1* ))   4.03  2.23  0.00 ! #SUP  5.57
assign  ((resid    3 and name HE*  )) ((resid   11 and name HB2  ))   4.97  3.17  0.00 ! #SUP  3.38
assign  ((resid   11 and name HN   )) ((resid   11 and name HB1  ))   4.10  2.30  0.00 ! #SUP  6.93
assign  ((resid  106 and name HB2  )) ((resid  108 and name HN   ))   4.52  2.72  0.00 ! #SUP  5.17
assign  ((resid  108 and name HN   )) ((resid  109 and name HB1  ))   4.85  3.05  0.00 ! #SUP  3.58
assign  ((resid  109 and name HB1  )) ((resid  110 and name HD*  ))   4.46  2.66  0.00 ! #SUP  4.22
assign  ((resid  106 and name HN   )) ((resid  109 and name HB2  ))   4.98  3.18  0.00 ! #SUP  0.75
assign  ((resid  109 and name HN   )) ((resid  109 and name HB2  ))   3.47  1.67  0.00 ! #SUP  4.71
assign  ((resid    1 and name HA   )) ((resid    1 and name HE*  ))   4.44  2.64  0.00 ! #SUP  5.25
assign  ((resid  108 and name HN   )) ((resid  109 and name HB2  ))   4.85  3.05  0.00 ! #SUP  3.17
assign  ((resid   82 and name HE*  )) ((resid   83 and name HN   ))   4.14  2.34  0.00 ! #SUP  6.37
assign  ((resid   82 and name HD*  )) ((resid   82 and name HE*  ))   2.78  0.98  0.00 ! #SUP  2.65
assign  ((resid   82 and name HB*  )) ((resid   82 and name HE*  ))   4.13  2.33  0.00 ! #SUP  4.24
assign  ((resid   82 and name HG*  )) ((resid   82 and name HE*  ))   3.08  1.28  0.00 ! #SUP  3.26
assign  ((resid   14 and name HD*  )) ((resid   14 and name HE*  ))   2.70  0.90  0.00 ! #SUP  4.85
assign  ((resid   14 and name HG1  )) ((resid   14 and name HE*  ))   3.26  1.46  0.00 ! #SUP  4.38
assign  ((resid    4 and name HN   )) ((resid    4 and name HB2  ))   4.13  2.33  0.00 ! #SUP  4.80
assign  ((resid  106 and name HB1  )) ((resid  107 and name HD2  ))   4.46  2.66  0.00 ! #SUP  5.81
assign  ((resid   16 and name HN   )) ((resid   16 and name HB   ))   3.75  1.95  0.00 ! #SUP  7.20
assign  ((resid   16 and name HB   )) ((resid   16 and name HD1* ))   3.59  1.79  0.00 ! #SUP  5.46
assign  ((resid   16 and name HB   )) ((resid   17 and name HA   ))   4.95  3.15  0.00 ! #SUP  3.98
assign  ((resid  106 and name HN   )) ((resid  106 and name HB2  ))   3.91  2.11  0.00 ! #SUP  3.67
assign  ((resid  106 and name HB1  )) ((resid  109 and name HN   ))   4.30  2.50  0.00 ! #SUP  2.45
assign  ((resid  106 and name HN   )) ((resid  106 and name HB1  ))   3.85  2.05  0.00 ! #SUP  3.64
assign  ((resid   29 and name HB*  )) ((resid   43 and name HG2* ))   4.34  2.54  0.00 ! #SUP  4.97
assign  ((resid   19 and name HE*  )) ((resid   92 and name HB*  ))   3.87  2.07  0.00 ! #SUP  4.00
assign  ((resid   19 and name HD*  )) ((resid   19 and name HE*  ))   2.72  0.92  0.00 ! #SUP  4.40
assign  ((resid   19 and name HG*  )) ((resid   19 and name HE*  ))   3.42  1.62  0.00 ! #SUP  4.48
assign  ((resid   19 and name HG*  )) ((resid   19 and name HE*  ))   3.54  1.74  0.00 ! #SUP  4.21
assign  ((resid   29 and name HB*  )) ((resid   30 and name HN   ))   4.12  2.32  0.00 ! #SUP  3.63
assign  ((resid   54 and name HB2  )) ((resid   54 and name HD2* ))   3.63  1.83  0.00 ! #SUP  5.46
assign  ((resid   48 and name HN   )) ((resid   48 and name HB2  ))   3.10  1.30  0.00 ! #SUP  7.36
assign  ((resid   48 and name HB2  )) ((resid   48 and name HD2* ))   3.35  1.55  0.00 ! #SUP  5.69
assign  ((resid   48 and name HN   )) ((resid   48 and name HB1  ))   3.56  1.76  0.00 ! #SUP  8.11
assign  ((resid   48 and name HB1  )) ((resid   49 and name HB1  ))   5.06  3.26  0.00 ! #SUP  5.56
assign  ((resid   48 and name HB1  )) ((resid   48 and name HD2* ))   3.22  1.42  0.00 ! #SUP  6.41
assign  ((resid   54 and name HB1  )) ((resid   54 and name HD2* ))   3.71  1.91  0.00 ! #SUP  5.37
assign  ((resid  103 and name HB1  )) ((resid  104 and name HD2  ))   5.06  3.26  0.00 ! #SUP  4.96
assign  ((resid   19 and name HE*  )) ((resid   92 and name HN   ))   4.82  3.02  0.00 ! #SUP  0.02
assign  ((resid   19 and name HE*  )) ((resid   92 and name HB*  ))   4.08  2.28  0.00 ! #SUP  4.97
assign  ((resid   54 and name HN   )) ((resid   54 and name HB1  ))   3.79  1.99  0.00 ! #SUP  8.00
assign  ((resid  108 and name HN   )) ((resid  108 and name HB2  ))   3.49  1.69  0.00 ! #SUP  6.72
assign  ((resid  108 and name HB2  )) ((resid  109 and name HN   ))   4.52  2.72  0.00 ! #SUP  4.62
assign  ((resid   35 and name HN   )) ((resid   35 and name HB1  ))   3.92  2.12  0.00 ! #SUP  5.14
assign  ((resid  122 and name HN   )) ((resid  122 and name HB2  ))   3.58  1.78  0.00 ! #SUP  4.39
assign  ((resid  122 and name HB2  )) ((resid  123 and name HN   ))   4.33  2.53  0.00 ! #SUP  5.88
assign  ((resid  108 and name HN   )) ((resid  108 and name HB1  ))   3.46  1.66  0.00 ! #SUP  6.20
assign  ((resid  122 and name HN   )) ((resid  122 and name HB1  ))   3.55  1.75  0.00 ! #SUP  4.28
assign  ((resid  122 and name HB1  )) ((resid  123 and name HN   ))   4.54  2.74  0.00 ! #SUP  6.00
assign  ((resid   27 and name HB2  )) ((resid  161 and name HG*  ))   4.67  2.87  0.00 ! #SUP  2.24
assign  ((resid   20 and name HD2* )) ((resid   27 and name HB1  ))   4.35  2.55  0.00 ! #SUP  1.97
assign  ((resid  121 and name HD*  )) ((resid  122 and name HB2  ))   5.20  3.40  0.00 ! #SUP  4.04
assign  ((resid   62 and name HB2  )) ((resid   97 and name HB*  ))   4.60  2.80  0.00 ! #SUP  2.00
assign  ((resid  121 and name HD*  )) ((resid  122 and name HB1  ))   5.12  3.32  0.00 ! #SUP  4.12
assign  ((resid   40 and name HB2  )) ((resid   63 and name HG1* ))   4.94  3.14  0.00 ! #SUP  3.31
assign  ((resid    6 and name HA   )) ((resid   73 and name HB1  ))   5.10  3.30  0.00 ! #SUP  3.00
assign  ((resid  105 and name HB*  )) ((resid  106 and name HN   ))   3.61  1.81  0.00 ! #SUP  2.20
assign  ((resid   69 and name HN   )) ((resid   69 and name HB2  ))   3.99  2.19  0.00 ! #SUP  5.93
assign  ((resid   69 and name HN   )) ((resid   69 and name HB1  ))   3.98  2.18  0.00 ! #SUP  5.34
assign  ((resid   69 and name HB1  )) ((resid   70 and name HN   ))   4.26  2.46  0.00 ! #SUP  5.31
assign  ((resid    3 and name HN   )) ((resid    3 and name HB2  ))   3.53  1.73  0.00 ! #SUP  6.27
assign  ((resid   69 and name HB2  )) ((resid   70 and name HN   ))   4.60  2.80  0.00 ! #SUP  4.47
assign  ((resid    2 and name HA   )) ((resid    3 and name HB1  ))   4.51  2.71  0.00 ! #SUP  4.81
assign  ((resid   49 and name HB2  )) ((resid   54 and name HD2* ))   5.34  3.54  0.00 ! #SUP  1.77
assign  ((resid    7 and name HN   )) ((resid    7 and name HB2  ))   3.75  1.95  0.00 ! #SUP  6.31
assign  ((resid    7 and name HN   )) ((resid    7 and name HB1  ))   3.57  1.77  0.00 ! #SUP  8.51
assign  ((resid    7 and name HB1  )) ((resid    7 and name HD21 ))   3.96  2.16  0.00 ! #SUP  6.00
assign  ((resid    7 and name HB1  )) ((resid   10 and name HN   ))   4.81  3.01  0.00 ! #SUP  3.69
assign  ((resid    7 and name HB1  )) ((resid    8 and name HD2  ))   4.85  3.05  0.00 ! #SUP  7.66
assign  ((resid    7 and name HB1  )) ((resid    8 and name HD1  ))   4.99  3.19  0.00 ! #SUP  7.82
assign  ((resid    5 and name HG2* )) ((resid    7 and name HB2  ))   4.31  2.51  0.00 ! #SUP  1.74
assign  ((resid   49 and name HN   )) ((resid   49 and name HB1  ))   4.09  2.29  0.00 ! #SUP  4.68
assign  ((resid   48 and name HB2  )) ((resid   49 and name HB1  ))   4.66  2.86  0.00 ! #SUP  4.01
assign  ((resid   49 and name HB1  )) ((resid   54 and name HD2* ))   4.97  3.17  0.00 ! #SUP  2.20
assign  ((resid    5 and name HG2* )) ((resid    7 and name HB1  ))   4.96  3.16  0.00 ! #SUP  2.58
assign  ((resid  119 and name HA   )) ((resid  120 and name HB   ))   4.81  3.01  0.00 ! #SUP  4.68
assign  ((resid  120 and name HN   )) ((resid  120 and name HB   ))   3.60  1.80  0.00 ! #SUP  7.96
assign  ((resid  120 and name HB   )) ((resid  121 and name HN   ))   3.76  1.96  0.00 ! #SUP  4.95
assign  ((resid  118 and name HG*  )) ((resid  120 and name HB   ))   4.29  2.49  0.00 ! #SUP  4.10
assign  ((resid  120 and name HB   )) ((resid  121 and name HA   ))   5.11  3.31  0.00 ! #SUP  4.78
assign  ((resid   48 and name HB1  )) ((resid   49 and name HB2  ))   4.70  2.90  0.00 ! #SUP  4.84
assign  ((resid  111 and name HB2  )) ((resid  111 and name HD21 ))   3.73  1.93  0.00 ! #SUP  4.76
assign  ((resid  111 and name HB2  )) ((resid  112 and name HN   ))   4.40  2.60  0.00 ! #SUP  5.20
assign  ((resid  111 and name HB2  )) ((resid  111 and name HD22 ))   4.09  2.29  0.00 ! #SUP  4.62
assign  ((resid  111 and name HB1  )) ((resid  112 and name HN   ))   4.65  2.85  0.00 ! #SUP  5.49
assign  ((resid   87 and name HN   )) ((resid   87 and name HB   ))   3.77  1.97  0.00 ! #SUP  6.42
assign  ((resid   87 and name HB   )) ((resid   87 and name HD1* ))   4.25  2.45  0.00 ! #SUP  5.61
assign  ((resid   84 and name HB2  )) ((resid   85 and name HN   ))   4.94  3.14  0.00 ! #SUP  5.44
assign  ((resid   84 and name HB1  )) ((resid   85 and name HN   ))   4.89  3.09  0.00 ! #SUP  6.15
assign  ((resid   42 and name HN   )) ((resid   42 and name HG1  ))   5.11  3.31  0.00 ! #SUP  5.87
assign  ((resid   38 and name HB2  )) ((resid   39 and name HN   ))   4.52  2.72  0.00 ! #SUP  5.52
assign  ((resid   83 and name HB   )) ((resid   84 and name HN   ))   3.97  2.17  0.00 ! #SUP  5.69
assign  ((resid   64 and name HB   )) ((resid   65 and name HN   ))   4.85  3.05  0.00 ! #SUP  4.77
assign  ((resid   64 and name HN   )) ((resid   64 and name HB   ))   4.12  2.32  0.00 ! #SUP  7.76
assign  ((resid   41 and name HB2  )) ((resid   64 and name HB   ))   4.72  2.92  0.00 ! #SUP  1.80
assign  ((resid    5 and name HG2* )) ((resid   10 and name HG*  ))   4.84  3.04  0.00 ! #SUP  3.20
assign  ((resid   63 and name HA   )) ((resid   64 and name HB   ))   4.97  3.17  0.00 ! #SUP  4.88
assign  ((resid   43 and name HD1* )) ((resid   64 and name HB   ))   5.25  3.45  0.00 ! #SUP  2.54
assign  ((resid   64 and name HB   )) ((resid   64 and name HD1* ))   3.90  2.10  0.00 ! #SUP  5.36
assign  ((resid   10 and name HN   )) ((resid   10 and name HG*  ))   4.00  2.20  0.00 ! #SUP  4.81
assign  ((resid   10 and name HA   )) ((resid   10 and name HG*  ))   3.73  1.93  0.00 ! #SUP  3.59
assign  ((resid   10 and name HB1  )) ((resid   10 and name HG*  ))   2.99  1.19  0.00 ! #SUP  2.96
assign  ((resid    4 and name HN   )) ((resid   10 and name HG*  ))   5.23  3.43  0.00 ! #SUP  1.08
assign  ((resid    7 and name HB2  )) ((resid   10 and name HG*  ))   5.00  3.20  0.00 ! #SUP  2.53
assign  ((resid   89 and name HN   )) ((resid   89 and name HB   ))   3.26  1.46  0.00 ! #SUP  6.99
assign  ((resid   32 and name HB   )) ((resid   33 and name HN   ))   4.70  2.90  0.00 ! #SUP  4.38
assign  ((resid   39 and name HN   )) ((resid   39 and name HG2  ))   4.65  2.85  0.00 ! #SUP  6.04
assign  ((resid   43 and name HN   )) ((resid   43 and name HB   ))   4.07  2.27  0.00 ! #SUP  6.58
assign  ((resid   43 and name HB   )) ((resid   61 and name HN   ))   4.34  2.54  0.00 ! #SUP  4.97
assign  ((resid   36 and name HN   )) ((resid   39 and name HG2  ))   4.85  3.05  0.00 ! #SUP  0.62
assign  ((resid   39 and name HG2  )) ((resid   40 and name HN   ))   4.86  3.06  0.00 ! #SUP  3.91
assign  ((resid   59 and name HG*  )) ((resid   99 and name HH11 ))   5.29  3.49  0.00 ! #SUP  1.50
assign  ((resid   39 and name HN   )) ((resid   39 and name HG1  ))   4.96  3.16  0.00 ! #SUP  5.64
assign  ((resid   68 and name HB2  )) ((resid   69 and name HN   ))   4.21  2.41  0.00 ! #SUP  6.10
assign  ((resid   68 and name HB2  )) ((resid   68 and name HD21 ))   4.07  2.27  0.00 ! #SUP  5.44
assign  ((resid   67 and name HG2* )) ((resid   68 and name HB1  ))   5.50  3.70  0.00 ! #SUP  5.85
assign  ((resid   68 and name HB1  )) ((resid   69 and name HN   ))   4.49  2.69  0.00 ! #SUP  6.09
assign  ((resid   59 and name HN   )) ((resid   59 and name HG*  ))   3.79  1.99  0.00 ! #SUP  3.81
assign  ((resid  124 and name HB2  )) ((resid  124 and name HG*  ))   2.60  0.80  0.00 ! #SUP  3.00
assign  ((resid  124 and name HN   )) ((resid  124 and name HG*  ))   4.52  2.72  0.00 ! #SUP  5.05
assign  ((resid   59 and name HG*  )) ((resid   99 and name HH2* ))   4.88  3.08  0.00 ! #SUP  4.00
assign  ((resid   46 and name HD2* )) ((resid   59 and name HG*  ))   5.17  3.37  0.00 ! #SUP  1.04
assign  ((resid   59 and name HG*  )) ((resid   99 and name HE   ))   4.95  3.15  0.00 ! #SUP  5.27
assign  ((resid   58 and name HA   )) ((resid   59 and name HG*  ))   4.98  3.18  0.00 ! #SUP  4.68
assign  ((resid   93 and name HB   )) ((resid   94 and name HN   ))   4.04  2.24  0.00 ! #SUP  6.71
assign  ((resid   58 and name HB2  )) ((resid   58 and name HE*  ))   4.10  2.30  0.00 ! #SUP  4.31
assign  ((resid   58 and name HB2  )) ((resid   97 and name HD*  ))   3.84  2.04  0.00 ! #SUP  3.53
assign  ((resid   58 and name HB1  )) ((resid   59 and name HN   ))   4.12  2.32  0.00 ! #SUP  3.69
assign  ((resid   58 and name HB1  )) ((resid   97 and name HD*  ))   3.83  2.03  0.00 ! #SUP  4.06
assign  ((resid   35 and name HB1  )) ((resid   36 and name HG1  ))   5.08  3.28  0.00 ! #SUP  3.35
assign  ((resid   68 and name HD22 )) ((resid   93 and name HB   ))   5.10  3.30  0.00 ! #SUP  4.75
assign  ((resid   58 and name HN   )) ((resid   58 and name HB1  ))   4.10  2.30  0.00 ! #SUP  4.32
assign  ((resid   58 and name HB1  )) ((resid   58 and name HE*  ))   4.05  2.25  0.00 ! #SUP  4.64
assign  ((resid   18 and name HG2* )) ((resid   58 and name HB1  ))   4.68  2.88  0.00 ! #SUP  1.50
assign  ((resid   35 and name HN   )) ((resid   36 and name HG2  ))   5.18  3.38  0.00 ! #SUP  4.61
assign  ((resid   36 and name HN   )) ((resid   36 and name HG2  ))   3.87  2.07  0.00 ! #SUP  8.08
assign  ((resid   36 and name HA   )) ((resid   36 and name HG2  ))   3.59  1.79  0.00 ! #SUP  6.92
assign  ((resid   36 and name HA   )) ((resid   36 and name HG1  ))   3.75  1.95  0.00 ! #SUP  6.77
assign  ((resid   36 and name HG1  )) ((resid   37 and name HD1  ))   4.42  2.62  0.00 ! #SUP  5.96
assign  ((resid   19 and name HB*  )) ((resid   20 and name HN   ))   4.24  2.44  0.00 ! #SUP  7.33
assign  ((resid   19 and name HN   )) ((resid   19 and name HB*  ))   3.63  1.83  0.00 ! #SUP  7.31
assign  ((resid   19 and name HB*  )) ((resid   19 and name HE*  ))   4.12  2.32  0.00 ! #SUP  4.28
assign  ((resid   19 and name HB*  )) ((resid   95 and name HN   ))   4.50  2.70  0.00 ! #SUP  4.48
assign  ((resid   31 and name HB   )) ((resid   32 and name HN   ))   3.87  2.07  0.00 ! #SUP  4.55
assign  ((resid   31 and name HN   )) ((resid   31 and name HB   ))   4.03  2.23  0.00 ! #SUP  5.42
assign  ((resid   31 and name HB   )) ((resid  161 and name HG*  ))   5.47  3.67  0.00 ! #SUP  2.49
assign  ((resid   14 and name HB*  )) ((resid   14 and name HE*  ))   4.23  2.43  0.00 ! #SUP  4.94
assign  ((resid   14 and name HB*  )) ((resid   99 and name HN   ))   4.24  2.44  0.00 ! #SUP  1.91
assign  ((resid   14 and name HB*  )) ((resid   15 and name HN   ))   3.54  1.74  0.00 ! #SUP  7.54
assign  ((resid   14 and name HN   )) ((resid   14 and name HB*  ))   3.32  1.52  0.00 ! #SUP  7.68
assign  ((resid   14 and name HB*  )) ((resid   16 and name HD1* ))   4.24  2.44  0.00 ! #SUP  3.31
assign  ((resid   13 and name HA1  )) ((resid   14 and name HB*  ))   4.53  2.73  0.00 ! #SUP  5.15
assign  ((resid   79 and name HN   )) ((resid   79 and name HG1  ))   4.27  2.47  0.00 ! #SUP  7.64
assign  ((resid   79 and name HA   )) ((resid   79 and name HG1  ))   3.90  2.10  0.00 ! #SUP  6.52
assign  ((resid   76 and name HN   )) ((resid   79 and name HG1  ))   4.74  2.94  0.00 ! #SUP  8.70
assign  ((resid   76 and name HN   )) ((resid   79 and name HG2  ))   4.69  2.89  0.00 ! #SUP  6.92
assign  ((resid   76 and name HG2* )) ((resid   79 and name HG1  ))   5.50  3.70  0.00 ! #SUP  6.66
assign  ((resid   63 and name HB   )) ((resid   64 and name HN   ))   4.59  2.79  0.00 ! #SUP  5.74
assign  ((resid   59 and name HB2  )) ((resid   60 and name HN   ))   3.91  2.11  0.00 ! #SUP  4.08
assign  ((resid  118 and name HN   )) ((resid  118 and name HB   ))   3.52  1.72  0.00 ! #SUP  3.36
assign  ((resid   85 and name HN   )) ((resid   85 and name HG1  ))   4.81  3.01  0.00 ! #SUP  5.46
assign  ((resid   67 and name HB   )) ((resid   68 and name HN   ))   4.91  3.11  0.00 ! #SUP  5.65
assign  ((resid   85 and name HN   )) ((resid   85 and name HG2  ))   4.42  2.62  0.00 ! #SUP  5.58
assign  ((resid   85 and name HG2  )) ((resid  159 and name HG2* ))   5.39  3.59  0.00 ! #SUP  1.76
assign  ((resid  118 and name HB   )) ((resid  119 and name HN   ))   4.47  2.67  0.00 ! #SUP  3.65
assign  ((resid  117 and name HA   )) ((resid  118 and name HB   ))   4.98  3.18  0.00 ! #SUP  2.94
assign  ((resid  123 and name HB2  )) ((resid  124 and name HN   ))   4.80  3.00  0.00 ! #SUP  6.16
assign  ((resid  123 and name HN   )) ((resid  123 and name HB2  ))   3.67  1.87  0.00 ! #SUP  6.25
assign  ((resid  123 and name HB1  )) ((resid  124 and name HN   ))   4.58  2.78  0.00 ! #SUP  6.01
assign  ((resid  123 and name HN   )) ((resid  123 and name HB1  ))   3.68  1.88  0.00 ! #SUP  6.25
assign  ((resid   12 and name HN   )) ((resid   12 and name HB1  ))   4.10  2.30  0.00 ! #SUP  8.37
assign  ((resid   12 and name HB1  )) ((resid   13 and name HN   ))   4.30  2.50  0.00 ! #SUP  7.10
assign  ((resid   99 and name HB*  )) ((resid   99 and name HE   ))   4.53  2.73  0.00 ! #SUP  6.44
assign  ((resid   12 and name HB2  )) ((resid   13 and name HN   ))   4.15  2.35  0.00 ! #SUP  7.10
assign  ((resid  115 and name HN   )) ((resid  115 and name HB   ))   3.87  2.07  0.00 ! #SUP  2.91
assign  ((resid   65 and name HB   )) ((resid   98 and name HN   ))   5.10  3.30  0.00 ! #SUP  2.25
assign  ((resid   65 and name HN   )) ((resid   65 and name HB   ))   4.03  2.23  0.00 ! #SUP  5.29
assign  ((resid   -1 and name HG2  )) ((resid   -1 and name HE*  ))   3.43  1.63  0.00 ! #SUP  1.65
assign  ((resid   -1 and name HG1  )) ((resid   -1 and name HE*  ))   3.39  1.59  0.00 ! #SUP  1.72
assign  ((resid    1 and name HB2  )) ((resid    1 and name HE*  ))   4.63  2.83  0.00 ! #SUP  3.93
assign  ((resid    1 and name HB2  )) ((resid    2 and name HD2  ))   4.19  2.39  0.00 ! #SUP  6.90
assign  ((resid    1 and name HN   )) ((resid    1 and name HB1  ))   3.87  2.07  0.00 ! #SUP  6.26
assign  ((resid    1 and name HB1  )) ((resid    2 and name HD2  ))   4.01  2.21  0.00 ! #SUP  6.20
assign  ((resid    2 and name HB2  )) ((resid    3 and name HN   ))   3.71  1.91  0.00 ! #SUP  6.41
assign  ((resid   88 and name HB2  )) ((resid   89 and name HN   ))   3.95  2.15  0.00 ! #SUP  5.60
assign  ((resid   87 and name HG2* )) ((resid   88 and name HB2  ))   5.30  3.50  0.00 ! #SUP  5.35
assign  ((resid  107 and name HB1  )) ((resid  108 and name HN   ))   4.45  2.65  0.00 ! #SUP  6.84
assign  ((resid   96 and name HB*  )) ((resid   97 and name HN   ))   4.55  2.75  0.00 ! #SUP  5.36
assign  ((resid   88 and name HB1  )) ((resid   89 and name HN   ))   3.75  1.95  0.00 ! #SUP  6.25
assign  ((resid   20 and name HD1* )) ((resid   51 and name HB2  ))   4.88  3.08  0.00 ! #SUP  5.64
assign  ((resid  102 and name HB2  )) ((resid  103 and name HN   ))   3.87  2.07  0.00 ! #SUP  4.24
assign  ((resid  103 and name HD1* )) ((resid  107 and name HB2  ))   4.63  2.83  0.00 ! #SUP  2.05
assign  ((resid   66 and name HN   )) ((resid   96 and name HB*  ))   4.28  2.48  0.00 ! #SUP  4.31
assign  ((resid   96 and name HB*  )) ((resid   97 and name HN   ))   4.84  3.04  0.00 ! #SUP  5.36
assign  ((resid  102 and name HB1  )) ((resid  103 and name HN   ))   3.75  1.95  0.00 ! #SUP  3.88
assign  ((resid    8 and name HB1  )) ((resid   65 and name HG2* ))   4.44  2.64  0.00 ! #SUP  4.65
assign  ((resid  110 and name HB1  )) ((resid  111 and name HA   ))   3.98  2.18  0.00 ! #SUP  4.93
assign  ((resid   66 and name HN   )) ((resid   96 and name HB*  ))   4.74  2.94  0.00 ! #SUP  3.25
assign  ((resid    8 and name HB2  )) ((resid   15 and name HD*  ))   5.04  3.24  0.00 ! #SUP  2.15
assign  ((resid    8 and name HB2  )) ((resid   65 and name HG2* ))   4.31  2.51  0.00 ! #SUP  4.56
assign  ((resid   37 and name HB2  )) ((resid   38 and name HN   ))   4.33  2.53  0.00 ! #SUP  6.57
assign  ((resid   36 and name HA   )) ((resid   37 and name HB2  ))   4.80  3.00  0.00 ! #SUP  7.48
assign  ((resid    8 and name HB1  )) ((resid   65 and name HG1* ))   3.94  2.14  0.00 ! #SUP  4.50
assign  ((resid   81 and name HN   )) ((resid   82 and name HB*  ))   4.77  2.97  0.00 ! #SUP  5.26
assign  ((resid   82 and name HN   )) ((resid   82 and name HB*  ))   3.39  1.59  0.00 ! #SUP  6.15
assign  ((resid   82 and name HB*  )) ((resid   83 and name HN   ))   4.13  2.33  0.00 ! #SUP  7.74
assign  ((resid   37 and name HB1  )) ((resid   38 and name HN   ))   4.18  2.38  0.00 ! #SUP  6.85
assign  ((resid   41 and name HD1* )) ((resid   75 and name HB2  ))   5.13  3.33  0.00 ! #SUP  1.39
assign  ((resid   75 and name HB1  )) ((resid   80 and name HB   ))   4.78  2.98  0.00 ! #SUP  7.55
assign  ((resid   75 and name HB1  )) ((resid   76 and name HN   ))   4.29  2.49  0.00 ! #SUP  5.38
assign  ((resid   75 and name HB1  )) ((resid   79 and name HB2  ))   4.75  2.95  0.00 ! #SUP  7.33
assign  ((resid   75 and name HB1  )) ((resid   79 and name HN   ))   5.11  3.31  0.00 ! #SUP  7.53
assign  ((resid   81 and name HB   )) ((resid   82 and name HN   ))   4.12  2.32  0.00 ! #SUP  4.93
assign  ((resid   80 and name HN   )) ((resid   80 and name HB   ))   3.29  1.49  0.00 ! #SUP  5.08
assign  ((resid   80 and name HB   )) ((resid   81 and name HN   ))   4.00  2.20  0.00 ! #SUP  4.93
assign  ((resid   21 and name HB*  )) ((resid   92 and name HA   ))   4.96  3.16  0.00 ! #SUP  4.46
assign  ((resid   21 and name HN   )) ((resid   21 and name HB*  ))   3.75  1.95  0.00 ! #SUP  6.94
assign  ((resid   20 and name HD1* )) ((resid   21 and name HB*  ))   5.50  3.70  0.00 ! #SUP  4.92
assign  ((resid   21 and name HN   )) ((resid   21 and name HB*  ))   3.76  1.96  0.00 ! #SUP  7.02
assign  ((resid   21 and name HB*  )) ((resid   92 and name HA   ))   4.83  3.03  0.00 ! #SUP  4.46
assign  ((resid   21 and name HB*  )) ((resid   21 and name HD*  ))   3.83  2.03  0.00 ! #SUP  5.14
assign  ((resid   20 and name HD1* )) ((resid   21 and name HB*  ))   5.50  3.70  0.00 ! #SUP  5.44
assign  ((resid   17 and name HB*  )) ((resid   97 and name HN   ))   4.94  3.14  0.00 ! #SUP  4.10
assign  ((resid   15 and name HZ   )) ((resid   17 and name HB*  ))   5.15  3.35  0.00 ! #SUP  1.84
assign  ((resid   16 and name HA   )) ((resid   17 and name HB*  ))   4.14  2.34  0.00 ! #SUP  6.05
assign  ((resid   18 and name HG2* )) ((resid   58 and name HG1  ))   4.31  2.51  0.00 ! #SUP  1.50
assign  ((resid   58 and name HG1  )) ((resid   97 and name HD*  ))   3.47  1.67  0.00 ! #SUP  3.32
assign  ((resid   36 and name HN   )) ((resid   36 and name HB2  ))   4.18  2.38  0.00 ! #SUP  7.29
assign  ((resid   67 and name HN   )) ((resid   72 and name HB   ))   4.72  2.92  0.00 ! #SUP  2.25
assign  ((resid   72 and name HB   )) ((resid   75 and name HB2  ))   4.55  2.75  0.00 ! #SUP  2.24
assign  ((resid   10 and name HN   )) ((resid   10 and name HB2  ))   4.13  2.33  0.00 ! #SUP  4.81
assign  ((resid    7 and name HB1  )) ((resid   10 and name HB2  ))   4.93  3.13  0.00 ! #SUP  0.99
assign  ((resid   19 and name HN   )) ((resid   19 and name HD*  ))   4.58  2.78  0.00 ! #SUP  7.51
assign  ((resid   19 and name HA   )) ((resid   19 and name HD*  ))   4.43  2.63  0.00 ! #SUP  6.81
assign  ((resid   19 and name HD*  )) ((resid   93 and name HN   ))   4.57  2.77  0.00 ! #SUP  7.54
assign  ((resid   25 and name HN   )) ((resid   25 and name HB1  ))   4.18  2.38  0.00 ! #SUP  3.96
assign  ((resid   79 and name HN   )) ((resid   79 and name HB2  ))   4.11  2.31  0.00 ! #SUP  7.89
assign  ((resid   76 and name HG2* )) ((resid   79 and name HB2  ))   5.50  3.70  0.00 ! #SUP  6.48
assign  ((resid   79 and name HB2  )) ((resid   80 and name HN   ))   4.57  2.77  0.00 ! #SUP  7.82
assign  ((resid   75 and name HB1  )) ((resid   79 and name HB1  ))   4.67  2.87  0.00 ! #SUP  6.38
assign  ((resid  124 and name HB1  )) ((resid  124 and name HG*  ))   2.96  1.16  0.00 ! #SUP  3.29
assign  ((resid   14 and name HA   )) ((resid   14 and name HD*  ))   4.06  2.26  0.00 ! #SUP  6.86
assign  ((resid   85 and name HB*  )) ((resid   86 and name HN   ))   4.24  2.44  0.00 ! #SUP  3.94
assign  ((resid   85 and name HB*  )) ((resid  159 and name HG2* ))   4.90  3.10  0.00 ! #SUP  0.02
assign  ((resid   82 and name HA   )) ((resid   85 and name HB*  ))   4.23  2.43  0.00 ! #SUP  4.37
assign  ((resid    1 and name HA   )) ((resid    1 and name HD*  ))   3.68  1.88  0.00 ! #SUP  6.70
assign  ((resid    1 and name HG*  )) ((resid    1 and name HD*  ))   2.40  0.60  0.00 ! #SUP  4.78
assign  ((resid  123 and name HN   )) ((resid  123 and name HD*  ))   4.15  2.35  0.00 ! #SUP  5.85
assign  ((resid   51 and name HG2  )) ((resid   52 and name HN   ))   5.07  3.27  0.00 ! #SUP  6.55
assign  ((resid   23 and name HN   )) ((resid   51 and name HG2  ))   5.25  3.45  0.00 ! #SUP  3.36
assign  ((resid   27 and name HA   )) ((resid   51 and name HG1  ))   5.22  3.42  0.00 ! #SUP  1.89
assign  ((resid   81 and name HG*  )) ((resid   85 and name HB*  ))   4.86  3.06  0.00 ! #SUP  3.01
assign  ((resid   98 and name HB*  )) ((resid   99 and name HN   ))   4.67  2.87  0.00 ! #SUP  3.37
assign  ((resid   98 and name HN   )) ((resid   98 and name HB*  ))   4.12  2.32  0.00 ! #SUP  4.26
assign  ((resid   65 and name HG2* )) ((resid   98 and name HB*  ))   3.94  2.14  0.00 ! #SUP  1.68
assign  ((resid    6 and name HG2  )) ((resid    7 and name HD21 ))   5.06  3.26  0.00 ! #SUP  4.52
assign  ((resid   82 and name HA   )) ((resid   82 and name HD*  ))   3.93  2.13  0.00 ! #SUP  3.72
assign  ((resid   63 and name HN   )) ((resid   98 and name HB*  ))   4.89  3.09  0.00 ! #SUP  2.19
assign  ((resid    6 and name HN   )) ((resid    6 and name HG1  ))   5.01  3.21  0.00 ! #SUP  6.51
assign  ((resid   24 and name HA   )) ((resid   89 and name HG12 ))   5.25  3.45  0.00 ! #SUP  5.48
assign  ((resid   25 and name HD*  )) ((resid   89 and name HG12 ))   5.21  3.41  0.00 ! #SUP  3.38
assign  ((resid   89 and name HN   )) ((resid   89 and name HG11 ))   4.04  2.24  0.00 ! #SUP  6.40
assign  ((resid   25 and name HA   )) ((resid   89 and name HG11 ))   5.24  3.44  0.00 ! #SUP  2.24
assign  ((resid   16 and name HA   )) ((resid   16 and name HG1* ))   4.09  2.29  0.00 ! #SUP  7.06
assign  ((resid   16 and name HG1* )) ((resid   17 and name HN   ))   4.61  2.81  0.00 ! #SUP  6.61
assign  ((resid   15 and name HA   )) ((resid   16 and name HG1* ))   4.90  3.10  0.00 ! #SUP  5.47
assign  ((resid   16 and name HN   )) ((resid   16 and name HG1* ))   4.55  2.75  0.00 ! #SUP  7.50
assign  ((resid   16 and name HG1* )) ((resid   17 and name HN   ))   4.95  3.15  0.00 ! #SUP  6.58
assign  ((resid   11 and name HN   )) ((resid   11 and name HD1* ))   3.87  2.07  0.00 ! #SUP  6.99
assign  ((resid    2 and name HG2  )) ((resid    3 and name HN   ))   4.86  3.06  0.00 ! #SUP  5.57
assign  ((resid    8 and name HG*  )) ((resid   65 and name HG2* ))   4.37  2.57  0.00 ! #SUP  5.88
assign  ((resid   87 and name HG11 )) ((resid   88 and name HD2  ))   5.30  3.50  0.00 ! #SUP  6.38
assign  ((resid   16 and name HN   )) ((resid   16 and name HG1* ))   4.41  2.61  0.00 ! #SUP  8.13
assign  ((resid   21 and name HG1  )) ((resid   91 and name HN   ))   5.04  3.24  0.00 ! #SUP  6.63
assign  ((resid   88 and name HG*  )) ((resid   91 and name HN   ))   4.80  3.00  0.00 ! #SUP  2.48
assign  ((resid    8 and name HG*  )) ((resid    9 and name HN   ))   4.39  2.59  0.00 ! #SUP  8.63
assign  ((resid   36 and name HA   )) ((resid   37 and name HG2  ))   4.41  2.61  0.00 ! #SUP  7.36
assign  ((resid   36 and name HA   )) ((resid   37 and name HG1  ))   4.34  2.54  0.00 ! #SUP  7.07
assign  ((resid   37 and name HG1  )) ((resid   38 and name HN   ))   4.86  3.06  0.00 ! #SUP  6.62
assign  ((resid  120 and name HN   )) ((resid  120 and name HG12 ))   4.36  2.56  0.00 ! #SUP  6.75
assign  ((resid   21 and name HG2  )) ((resid   22 and name HN   ))   4.45  2.65  0.00 ! #SUP  6.15
assign  ((resid   21 and name HG2  )) ((resid   91 and name HN   ))   5.22  3.42  0.00 ! #SUP  4.99
assign  ((resid   21 and name HG2  )) ((resid   92 and name HA   ))   4.81  3.01  0.00 ! #SUP  6.57
assign  ((resid   21 and name HG2  )) ((resid   92 and name HB*  ))   4.82  3.02  0.00 ! #SUP  4.23
assign  ((resid   21 and name HG1  )) ((resid   22 and name HN   ))   4.53  2.73  0.00 ! #SUP  5.04
assign  ((resid   21 and name HG1  )) ((resid   92 and name HA   ))   4.98  3.18  0.00 ! #SUP  8.44
assign  ((resid  120 and name HN   )) ((resid  120 and name HG11 ))   4.89  3.09  0.00 ! #SUP  6.66
assign  ((resid   64 and name HN   )) ((resid   64 and name HG11 ))   4.54  2.74  0.00 ! #SUP  6.65
assign  ((resid   64 and name HG2* )) ((resid   64 and name HG11 ))   4.28  2.48  0.00 ! #SUP  5.77
assign  ((resid   71 and name HB2  )) ((resid   72 and name HN   ))   4.78  2.98  0.00 ! #SUP  4.45
assign  ((resid   71 and name HN   )) ((resid   71 and name HB2  ))   3.75  1.95  0.00 ! #SUP  5.49
assign  ((resid   70 and name HA   )) ((resid   71 and name HB1  ))   4.65  2.85  0.00 ! #SUP  4.23
assign  ((resid   41 and name HN   )) ((resid   41 and name HG   ))   4.25  2.45  0.00 ! #SUP  6.85
assign  ((resid  121 and name HG   )) ((resid  122 and name HN   ))   4.57  2.77  0.00 ! #SUP  3.61
assign  ((resid   43 and name HN   )) ((resid   43 and name HG12 ))   4.14  2.34  0.00 ! #SUP  6.51
assign  ((resid   43 and name HN   )) ((resid   43 and name HG11 ))   4.33  2.53  0.00 ! #SUP  6.07
assign  ((resid   43 and name HG11 )) ((resid   62 and name HN   ))   5.28  3.48  0.00 ! #SUP  4.45
assign  ((resid   43 and name HG11 )) ((resid   62 and name HB2  ))   5.25  3.45  0.00 ! #SUP  1.14
assign  ((resid   42 and name HA   )) ((resid   64 and name HG11 ))   5.17  3.37  0.00 ! #SUP  3.31
assign  ((resid  107 and name HG*  )) ((resid  108 and name HN   ))   4.44  2.64  0.00 ! #SUP  7.43
assign  ((resid  106 and name HB2  )) ((resid  107 and name HG*  ))   5.08  3.28  0.00 ! #SUP  5.37
assign  ((resid  103 and name HD1* )) ((resid  107 and name HG*  ))   4.81  3.01  0.00 ! #SUP  2.98
assign  ((resid   49 and name HA   )) ((resid   54 and name HG   ))   4.58  2.78  0.00 ! #SUP  2.95
assign  ((resid   54 and name HA   )) ((resid   54 and name HG   ))   3.87  2.07  0.00 ! #SUP  5.96
assign  ((resid  121 and name HN   )) ((resid  121 and name HG   ))   4.04  2.24  0.00 ! #SUP  4.24
assign  ((resid   25 and name HN   )) ((resid   25 and name HG*  ))   4.86  3.06  0.00 ! #SUP  4.54
assign  ((resid  121 and name HA   )) ((resid  121 and name HG   ))   4.19  2.39  0.00 ! #SUP  4.84
assign  ((resid   25 and name HA   )) ((resid   25 and name HG*  ))   3.88  2.08  0.00 ! #SUP  5.76
assign  ((resid   25 and name HA   )) ((resid   25 and name HG*  ))   3.87  2.07  0.00 ! #SUP  4.20
assign  ((resid   20 and name HD2* )) ((resid   52 and name HN   ))   5.19  3.39  0.00 ! #SUP  2.42
assign  ((resid   20 and name HD2* )) ((resid   21 and name HN   ))   5.30  3.50  0.00 ! #SUP  7.36
assign  ((resid   20 and name HB2  )) ((resid   20 and name HD2* ))   3.84  2.04  0.00 ! #SUP  6.00
assign  ((resid   48 and name HN   )) ((resid   48 and name HG   ))   3.58  1.78  0.00 ! #SUP  7.51
assign  ((resid   20 and name HA   )) ((resid   20 and name HD2* ))   4.38  2.58  0.00 ! #SUP  6.28
assign  ((resid   20 and name HN   )) ((resid   20 and name HD2* ))   4.60  2.80  0.00 ! #SUP  7.49
assign  ((resid   20 and name HD2* )) ((resid   52 and name HA   ))   4.60  2.80  0.00 ! #SUP  2.59
assign  ((resid   27 and name HD*  )) ((resid   95 and name HD2* ))   5.32  3.52  0.00 ! #SUP  0.67
assign  ((resid   95 and name HN   )) ((resid   95 and name HD2* ))   4.12  2.32  0.00 ! #SUP  6.71
assign  ((resid   20 and name HN   )) ((resid   95 and name HD2* ))   4.87  3.07  0.00 ! #SUP  2.73
assign  ((resid   95 and name HB*  )) ((resid   95 and name HD2* ))   3.29  1.49  0.00 ! #SUP  5.31
assign  ((resid   14 and name HG1  )) ((resid   99 and name HG*  ))   3.50  1.70  0.00 ! #SUP  0.02
assign  ((resid   68 and name HN   )) ((resid   95 and name HD1* ))   4.29  2.49  0.00 ! #SUP  8.76
assign  ((resid   95 and name HN   )) ((resid   95 and name HD1* ))   4.31  2.51  0.00 ! #SUP  7.19
assign  ((resid   20 and name HN   )) ((resid   95 and name HD1* ))   4.69  2.89  0.00 ! #SUP  2.08
assign  ((resid   95 and name HD1* )) ((resid   96 and name HN   ))   4.00  2.20  0.00 ! #SUP  6.11
assign  ((resid   95 and name HA   )) ((resid   95 and name HD1* ))   3.56  1.76  0.00 ! #SUP  5.31
assign  ((resid   67 and name HA   )) ((resid   95 and name HD1* ))   3.89  2.09  0.00 ! #SUP  6.03
assign  ((resid   73 and name HN   )) ((resid   73 and name HD2* ))   4.25  2.45  0.00 ! #SUP  7.30
assign  ((resid   16 and name HD1* )) ((resid   99 and name HG*  ))   4.93  3.13  0.00 ! #SUP  3.85
assign  ((resid   46 and name HN   )) ((resid   46 and name HD1* ))   3.95  2.15  0.00 ! #SUP  6.74
assign  ((resid   46 and name HD1* )) ((resid   59 and name HA   ))   3.80  2.00  0.00 ! #SUP  2.48
assign  ((resid   46 and name HD1* )) ((resid   53 and name HA   ))   3.52  1.72  0.00 ! #SUP  3.83
assign  ((resid    8 and name HD1  )) ((resid   73 and name HD2* ))   4.37  2.57  0.00 ! #SUP  2.40
assign  ((resid   65 and name HG1* )) ((resid   73 and name HD2* ))   3.37  1.57  0.00 ! #SUP  0.02
assign  ((resid   97 and name HN   )) ((resid   97 and name HD*  ))   4.07  2.27  0.00 ! #SUP  6.13
assign  ((resid   67 and name HB   )) ((resid   95 and name HD1* ))   2.71  0.91  0.00 ! #SUP  3.09
assign  ((resid  114 and name HN   )) ((resid  114 and name HD1* ))   4.21  2.41  0.00 ! #SUP  5.04
assign  ((resid  114 and name HB*  )) ((resid  114 and name HD1* ))   3.22  1.42  0.00 ! #SUP  4.71
assign  ((resid   46 and name HA   )) ((resid   46 and name HD1* ))   3.95  2.15  0.00 ! #SUP  6.31
assign  ((resid   46 and name HB1  )) ((resid   46 and name HD1* ))   3.73  1.93  0.00 ! #SUP  5.97
assign  ((resid   97 and name HD*  )) ((resid   98 and name HN   ))   5.02  3.22  0.00 ! #SUP  6.03
assign  ((resid   97 and name HA   )) ((resid   97 and name HD*  ))   3.37  1.57  0.00 ! #SUP  5.42
assign  ((resid   64 and name HA   )) ((resid   97 and name HD*  ))   3.60  1.80  0.00 ! #SUP  4.86
assign  ((resid   97 and name HB*  )) ((resid   97 and name HD*  ))   2.75  0.95  0.00 ! #SUP  4.85
assign  ((resid   82 and name HN   )) ((resid   82 and name HG*  ))   4.05  2.25  0.00 ! #SUP  5.15
assign  ((resid   14 and name HN   )) ((resid   14 and name HG2  ))   4.41  2.61  0.00 ! #SUP  7.65
assign  ((resid   14 and name HG1  )) ((resid   16 and name HD1* ))   4.28  2.48  0.00 ! #SUP  3.46
assign  ((resid   14 and name HN   )) ((resid   14 and name HG1  ))   4.58  2.78  0.00 ! #SUP  7.49
assign  ((resid   40 and name HA   )) ((resid   41 and name HD1* ))   5.17  3.37  0.00 ! #SUP  4.31
assign  ((resid   41 and name HD1* )) ((resid   75 and name HA   ))   4.99  3.19  0.00 ! #SUP  1.39
assign  ((resid   34 and name HA1  )) ((resid   41 and name HD1* ))   5.34  3.54  0.00 ! #SUP  3.68
assign  ((resid   34 and name HA2  )) ((resid   41 and name HD1* ))   5.21  3.41  0.00 ! #SUP  2.92
assign  ((resid   46 and name HD2* )) ((resid   53 and name HA   ))   3.73  1.93  0.00 ! #SUP  2.86
assign  ((resid   46 and name HB2  )) ((resid   46 and name HD2* ))   3.21  1.41  0.00 ! #SUP  5.83
assign  ((resid    1 and name HG*  )) ((resid    2 and name HD2  ))   4.25  2.45  0.00 ! #SUP  6.93
assign  ((resid   19 and name HG*  )) ((resid   93 and name HN   ))   4.73  2.93  0.00 ! #SUP  7.86
assign  ((resid   19 and name HG*  )) ((resid   92 and name HB*  ))   4.85  3.05  0.00 ! #SUP  4.97
assign  ((resid   14 and name HG1  )) ((resid   14 and name HD*  ))   3.04  1.24  0.00 ! #SUP  6.55
assign  ((resid   79 and name HN   )) ((resid   80 and name HG*  ))   4.51  2.71  0.00 ! #SUP  6.68
assign  ((resid   80 and name HA   )) ((resid   80 and name HG*  ))   3.30  1.50  0.00 ! #SUP  3.87
assign  ((resid   75 and name HB2  )) ((resid   80 and name HG*  ))   4.06  2.26  0.00 ! #SUP  4.97
assign  ((resid   75 and name HB1  )) ((resid   80 and name HG*  ))   3.95  2.15  0.00 ! #SUP  8.22
assign  ((resid   78 and name HN   )) ((resid   80 and name HG*  ))   4.03  2.23  0.00 ! #SUP  3.55
assign  ((resid   80 and name HG*  )) ((resid   81 and name HN   ))   4.21  2.41  0.00 ! #SUP  6.66
assign  ((resid   80 and name HN   )) ((resid   80 and name HG*  ))   3.37  1.57  0.00 ! #SUP  6.85
assign  ((resid   75 and name HD2  )) ((resid   80 and name HG*  ))   4.56  2.76  0.00 ! #SUP  9.13
assign  ((resid   48 and name HN   )) ((resid   48 and name HD1* ))   3.62  1.82  0.00 ! #SUP  6.00
assign  ((resid   40 and name HB1  )) ((resid   41 and name HD1* ))   5.22  3.42  0.00 ! #SUP  3.73
assign  ((resid   41 and name HD2* )) ((resid   42 and name HN   ))   5.10  3.30  0.00 ! #SUP  5.43
assign  ((resid   41 and name HD2* )) ((resid   84 and name HE*  ))   5.03  3.23  0.00 ! #SUP  1.12
assign  ((resid   41 and name HD2* )) ((resid   64 and name HB   ))   4.60  2.80  0.00 ! #SUP  1.97
assign  ((resid  114 and name HA   )) ((resid  114 and name HD1* ))   4.46  2.66  0.00 ! #SUP  4.41
assign  ((resid   41 and name HD2* )) ((resid   80 and name HA   ))   4.83  3.03  0.00 ! #SUP  1.14
assign  ((resid   11 and name HD2* )) ((resid   12 and name HN   ))   3.92  2.12  0.00 ! #SUP  8.33
assign  ((resid  114 and name HN   )) ((resid  114 and name HD2* ))   4.08  2.28  0.00 ! #SUP  6.30
assign  ((resid   12 and name HN   )) ((resid   12 and name HG2  ))   4.29  2.49  0.00 ! #SUP  9.25
assign  ((resid   12 and name HA   )) ((resid   12 and name HG2  ))   4.26  2.46  0.00 ! #SUP  5.71
assign  ((resid   19 and name HG*  )) ((resid   20 and name HN   ))   4.47  2.67  0.00 ! #SUP  7.31
assign  ((resid   12 and name HG2  )) ((resid   13 and name HN   ))   4.54  2.74  0.00 ! #SUP  7.55
assign  ((resid   12 and name HN   )) ((resid   12 and name HG1  ))   4.56  2.76  0.00 ! #SUP  9.98
assign  ((resid   12 and name HG1  )) ((resid   13 and name HN   ))   4.71  2.91  0.00 ! #SUP  7.63
assign  ((resid   19 and name HG*  )) ((resid   93 and name HN   ))   4.81  3.01  0.00 ! #SUP  8.84
assign  ((resid   19 and name HG*  )) ((resid   20 and name HN   ))   4.36  2.56  0.00 ! #SUP  7.00
assign  ((resid   48 and name HB1  )) ((resid   48 and name HD1* ))   3.34  1.54  0.00 ! #SUP  5.38
assign  ((resid   11 and name HN   )) ((resid   11 and name HD2* ))   3.67  1.87  0.00 ! #SUP  7.31
assign  ((resid   11 and name HA   )) ((resid   11 and name HD2* ))   3.50  1.70  0.00 ! #SUP  6.66
assign  ((resid  114 and name HA   )) ((resid  114 and name HD2* ))   3.98  2.18  0.00 ! #SUP  5.50
assign  ((resid  113 and name HA   )) ((resid  114 and name HD2* ))   4.65  2.85  0.00 ! #SUP  4.63
assign  ((resid  123 and name HN   )) ((resid  123 and name HG*  ))   4.53  2.73  0.00 ! #SUP  5.61
assign  ((resid  123 and name HG*  )) ((resid  123 and name HD*  ))   2.75  0.95  0.00 ! #SUP  4.80
assign  ((resid   79 and name HN   )) ((resid   81 and name HG*  ))   4.93  3.13  0.00 ! #SUP  2.80
assign  ((resid   48 and name HD2* )) ((resid   49 and name HN   ))   3.49  1.69  0.00 ! #SUP  4.25
assign  ((resid   48 and name HA   )) ((resid   48 and name HD2* ))   3.28  1.48  0.00 ! #SUP  6.14
assign  ((resid   48 and name HD2* )) ((resid   53 and name HB*  ))   3.54  1.74  0.00 ! #SUP  4.27
assign  ((resid   44 and name HA   )) ((resid  103 and name HD1* ))   4.57  2.77  0.00 ! #SUP  1.88
assign  ((resid   20 and name HB2  )) ((resid   20 and name HD1* ))   3.98  2.18  0.00 ! #SUP  5.63
assign  ((resid   20 and name HD1* )) ((resid   55 and name HB2  ))   3.91  2.11  0.00 ! #SUP  2.46
assign  ((resid   81 and name HG*  )) ((resid   85 and name HN   ))   5.13  3.33  0.00 ! #SUP  2.67
assign  ((resid   44 and name HB2  )) ((resid  103 and name HD1* ))   3.23  1.43  0.00 ! #SUP  0.75
assign  ((resid   20 and name HN   )) ((resid   20 and name HD1* ))   4.06  2.26  0.00 ! #SUP  7.84
assign  ((resid   20 and name HD1* )) ((resid   55 and name HN   ))   4.43  2.63  0.00 ! #SUP  1.50
assign  ((resid   20 and name HD1* )) ((resid   21 and name HN   ))   3.75  1.95  0.00 ! #SUP  8.34
assign  ((resid   20 and name HD1* )) ((resid   52 and name HA   ))   3.34  1.54  0.00 ! #SUP  5.06
assign  ((resid   20 and name HD1* )) ((resid   55 and name HB1  ))   3.97  2.17  0.00 ! #SUP  1.50
assign  ((resid   20 and name HD1* )) ((resid   52 and name HB*  ))   3.36  1.56  0.00 ! #SUP  2.92
assign  ((resid   16 and name HN   )) ((resid   65 and name HG2* ))   5.40  3.60  0.00 ! #SUP  1.31
assign  ((resid   73 and name HD1* )) ((resid   74 and name HN   ))   4.25  2.45  0.00 ! #SUP  4.62
assign  ((resid   73 and name HN   )) ((resid   73 and name HD1* ))   3.78  1.98  0.00 ! #SUP  7.86
assign  ((resid   73 and name HA   )) ((resid   73 and name HD1* ))   3.45  1.65  0.00 ! #SUP  5.00
assign  ((resid    6 and name HA   )) ((resid   73 and name HD1* ))   4.66  2.86  0.00 ! #SUP  3.00
assign  ((resid   65 and name HA   )) ((resid   73 and name HD1* ))   3.42  1.62  0.00 ! #SUP  2.58
assign  ((resid   49 and name HN   )) ((resid   54 and name HD1* ))   3.73  1.93  0.00 ! #SUP  4.12
assign  ((resid   54 and name HN   )) ((resid   54 and name HD1* ))   3.69  1.89  0.00 ! #SUP  9.07
assign  ((resid   54 and name HA   )) ((resid   54 and name HD1* ))   2.87  1.07  0.00 ! #SUP  7.24
assign  ((resid   53 and name HB*  )) ((resid   54 and name HD1* ))   3.19  1.39  0.00 ! #SUP  5.53
assign  ((resid   93 and name HN   )) ((resid   93 and name HG1* ))   3.98  2.18  0.00 ! #SUP  6.90
assign  ((resid   68 and name HN   )) ((resid   93 and name HG1* ))   4.30  2.50  0.00 ! #SUP  7.10
assign  ((resid   93 and name HG1* )) ((resid   94 and name HN   ))   3.45  1.65  0.00 ! #SUP  6.50
assign  ((resid   68 and name HD21 )) ((resid   93 and name HG1* ))   4.58  2.78  0.00 ! #SUP  5.82
assign  ((resid   93 and name HA   )) ((resid   93 and name HG1* ))   3.67  1.87  0.00 ! #SUP  4.89
assign  ((resid   22 and name HD2  )) ((resid   93 and name HG1* ))   4.24  2.44  0.00 ! #SUP  0.02
assign  ((resid   40 and name HD*  )) ((resid   63 and name HG1* ))   4.56  2.76  0.00 ! #SUP  2.92
assign  ((resid   63 and name HG1* )) ((resid   98 and name HA   ))   5.06  3.26  0.00 ! #SUP  0.85
assign  ((resid   32 and name HG1* )) ((resid   33 and name HN   ))   4.66  2.86  0.00 ! #SUP  4.38
assign  ((resid   31 and name HA   )) ((resid   31 and name HG1* ))   3.77  1.97  0.00 ! #SUP  3.53
assign  ((resid   31 and name HN   )) ((resid   31 and name HG1* ))   4.07  2.27  0.00 ! #SUP  4.33
assign  ((resid   31 and name HG1* )) ((resid  161 and name HG*  ))   4.32  2.52  0.00 ! #SUP  2.49
assign  ((resid   63 and name HN   )) ((resid   63 and name HG1* ))   3.97  2.17  0.00 ! #SUP  4.71
assign  ((resid   63 and name HG1* )) ((resid   64 and name HN   ))   4.44  2.64  0.00 ! #SUP  6.05
assign  ((resid   63 and name HG1* )) ((resid  101 and name HB2  ))   5.03  3.23  0.00 ! #SUP  1.73
assign  ((resid   63 and name HG1* )) ((resid  101 and name HB1  ))   3.91  2.11  0.00 ! #SUP  2.25
assign  ((resid   42 and name HG2  )) ((resid   63 and name HG1* ))   4.31  2.51  0.00 ! #SUP  4.66
assign  ((resid   42 and name HG1  )) ((resid   63 and name HG1* ))   4.65  2.85  0.00 ! #SUP  1.08
assign  ((resid   32 and name HN   )) ((resid   32 and name HG1* ))   4.39  2.59  0.00 ! #SUP  4.85
assign  ((resid   32 and name HG1* )) ((resid   44 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.47
assign  ((resid   32 and name HA   )) ((resid   32 and name HG1* ))   3.86  2.06  0.00 ! #SUP  4.28
assign  ((resid   32 and name HG1* )) ((resid   44 and name HA   ))   4.98  3.18  0.00 ! #SUP  2.43
assign  ((resid   46 and name HA   )) ((resid   60 and name HG2* ))   4.74  2.94  0.00 ! #SUP  0.91
assign  ((resid   60 and name HA   )) ((resid   60 and name HG2* ))   3.59  1.79  0.00 ! #SUP  3.76
assign  ((resid   76 and name HG2* )) ((resid   77 and name HN   ))   4.04  2.24  0.00 ! #SUP  4.15
assign  ((resid  112 and name HG2* )) ((resid  113 and name HN   ))   3.47  1.67  0.00 ! #SUP  4.64
assign  ((resid   60 and name HG2* )) ((resid   61 and name HN   ))   3.72  1.92  0.00 ! #SUP  4.97
assign  ((resid   60 and name HN   )) ((resid   60 and name HG2* ))   3.47  1.67  0.00 ! #SUP  3.86
assign  ((resid   45 and name HN   )) ((resid   60 and name HG2* ))   4.55  2.75  0.00 ! #SUP  3.28
assign  ((resid   44 and name HA   )) ((resid   60 and name HG2* ))   3.50  1.70  0.00 ! #SUP  3.28
assign  ((resid   60 and name HG2* )) ((resid   61 and name HA2  ))   4.27  2.47  0.00 ! #SUP  3.68
assign  ((resid   60 and name HG2* )) ((resid  103 and name HB2  ))   3.80  2.00  0.00 ! #SUP  1.96
assign  ((resid   60 and name HG2* )) ((resid  103 and name HD2* ))   3.69  1.89  0.00 ! #SUP  4.75
assign  ((resid   76 and name HG2* )) ((resid   79 and name HE22 ))   5.02  3.22  0.00 ! #SUP  2.45
assign  ((resid   76 and name HG2* )) ((resid   78 and name HN   ))   3.10  1.30  0.00 ! #SUP  5.46
assign  ((resid   76 and name HG2* )) ((resid   79 and name HN   ))   4.48  2.68  0.00 ! #SUP  7.03
assign  ((resid   76 and name HA   )) ((resid   76 and name HG2* ))   3.22  1.42  0.00 ! #SUP  3.97
assign  ((resid   76 and name HG2* )) ((resid   79 and name HG2  ))   4.56  2.76  0.00 ! #SUP  5.13
assign  ((resid  116 and name HN   )) ((resid  116 and name HG2* ))   3.64  1.84  0.00 ! #SUP  4.08
assign  ((resid  116 and name HG2* )) ((resid  117 and name HN   ))   3.44  1.64  0.00 ! #SUP  4.08
assign  ((resid  116 and name HA   )) ((resid  116 and name HG2* ))   3.75  1.95  0.00 ! #SUP  3.84
assign  ((resid   29 and name HA   )) ((resid   30 and name HG2* ))   5.17  3.37  0.00 ! #SUP  4.10
assign  ((resid   30 and name HG2* )) ((resid  160 and name HB*  ))   3.06  1.26  0.00 ! #SUP  2.83
assign  ((resid  112 and name HN   )) ((resid  112 and name HG2* ))   4.32  2.52  0.00 ! #SUP  5.20
assign  ((resid  112 and name HA   )) ((resid  112 and name HG2* ))   3.56  1.76  0.00 ! #SUP  3.59
assign  ((resid  116 and name HG2* )) ((resid  117 and name HA   ))   4.45  2.65  0.00 ! #SUP  2.82
assign  ((resid   30 and name HN   )) ((resid   30 and name HG2* ))   3.65  1.85  0.00 ! #SUP  4.49
assign  ((resid   30 and name HG2* )) ((resid   31 and name HN   ))   3.88  2.08  0.00 ! #SUP  3.93
assign  ((resid   30 and name HG2* )) ((resid  161 and name HN   ))   3.87  2.07  0.00 ! #SUP  3.29
assign  ((resid   30 and name HA   )) ((resid   30 and name HG2* ))   3.64  1.84  0.00 ! #SUP  3.92
assign  ((resid   30 and name HG2* )) ((resid  160 and name HA   ))   3.39  1.59  0.00 ! #SUP  4.54
assign  ((resid   30 and name HG2* )) ((resid  161 and name HG*  ))   5.50  3.70  0.00 ! #SUP  5.85
assign  ((resid   65 and name HG1* )) ((resid   66 and name HN   ))   3.97  2.17  0.00 ! #SUP  8.13
assign  ((resid    8 and name HD1  )) ((resid   65 and name HG1* ))   4.23  2.43  0.00 ! #SUP  3.76
assign  ((resid   65 and name HA   )) ((resid   65 and name HG1* ))   3.38  1.58  0.00 ! #SUP  4.79
assign  ((resid    8 and name HB2  )) ((resid   65 and name HG1* ))   3.47  1.67  0.00 ! #SUP  4.51
assign  ((resid    8 and name HG*  )) ((resid   65 and name HG1* ))   3.49  1.69  0.00 ! #SUP  4.75
assign  ((resid   65 and name HN   )) ((resid   65 and name HG1* ))   4.00  2.20  0.00 ! #SUP  5.66
assign  ((resid  118 and name HG*  )) ((resid  119 and name HN   ))   3.81  2.01  0.00 ! #SUP  5.96
assign  ((resid   67 and name HG2* )) ((resid   68 and name HN   ))   3.73  1.93  0.00 ! #SUP  6.83
assign  ((resid   67 and name HN   )) ((resid   67 and name HG2* ))   4.25  2.45  0.00 ! #SUP  6.69
assign  ((resid   67 and name HG2* )) ((resid   68 and name HD21 ))   5.50  3.70  0.00 ! #SUP  5.85
assign  ((resid   67 and name HA   )) ((resid   67 and name HG2* ))   3.63  1.83  0.00 ! #SUP  5.13
assign  ((resid   67 and name HG2* )) ((resid   95 and name HD1* ))   4.02  2.22  0.00 ! #SUP  4.77
assign  ((resid   67 and name HG2* )) ((resid   93 and name HG1* ))   3.61  1.81  0.00 ! #SUP  3.10
assign  ((resid   70 and name HG2* )) ((resid   71 and name HB1  ))   4.71  2.91  0.00 ! #SUP  4.52
assign  ((resid  118 and name HG*  )) ((resid  120 and name HN   ))   4.10  2.30  0.00 ! #SUP  5.61
assign  ((resid  118 and name HA   )) ((resid  118 and name HG*  ))   3.39  1.59  0.00 ! #SUP  3.97
assign  ((resid   67 and name HG1* )) ((resid   68 and name HN   ))   4.27  2.47  0.00 ! #SUP  5.65
assign  ((resid   67 and name HN   )) ((resid   67 and name HG1* ))   3.92  2.12  0.00 ! #SUP  5.80
assign  ((resid   67 and name HA   )) ((resid   67 and name HG1* ))   3.73  1.93  0.00 ! #SUP  4.29
assign  ((resid   67 and name HG1* )) ((resid   95 and name HD1* ))   3.48  1.68  0.00 ! #SUP  3.09
assign  ((resid   70 and name HG2* )) ((resid   71 and name HN   ))   3.56  1.76  0.00 ! #SUP  4.95
assign  ((resid   67 and name HN   )) ((resid   70 and name HG2* ))   4.75  2.95  0.00 ! #SUP  0.75
assign  ((resid   70 and name HN   )) ((resid   70 and name HG2* ))   3.82  2.02  0.00 ! #SUP  5.37
assign  ((resid   70 and name HA   )) ((resid   70 and name HG2* ))   3.43  1.63  0.00 ! #SUP  4.74
assign  ((resid   70 and name HG2* )) ((resid   72 and name HG*  ))   3.78  1.98  0.00 ! #SUP  1.89
assign  ((resid  115 and name HG*  )) ((resid  117 and name HA   ))   3.86  2.06  0.00 ! #SUP  0.87
assign  ((resid   93 and name HN   )) ((resid   93 and name HG2* ))   3.56  1.76  0.00 ! #SUP  7.36
assign  ((resid   20 and name HN   )) ((resid   93 and name HG2* ))   4.04  2.24  0.00 ! #SUP  5.88
assign  ((resid   93 and name HG2* )) ((resid   94 and name HN   ))   4.57  2.77  0.00 ! #SUP  7.13
assign  ((resid   20 and name HB1  )) ((resid   93 and name HG2* ))   3.66  1.86  0.00 ! #SUP  1.88
assign  ((resid  115 and name HN   )) ((resid  115 and name HG*  ))   3.49  1.69  0.00 ! #SUP  3.55
assign  ((resid  115 and name HG*  )) ((resid  116 and name HN   ))   3.70  1.90  0.00 ! #SUP  3.14
assign  ((resid  115 and name HG*  )) ((resid  155 and name HA   ))   3.52  1.72  0.00 ! #SUP  2.31
assign  ((resid  115 and name HA   )) ((resid  115 and name HG*  ))   3.03  1.23  0.00 ! #SUP  3.97
assign  ((resid   31 and name HN   )) ((resid   31 and name HG2* ))   3.56  1.76  0.00 ! #SUP  5.73
assign  ((resid   31 and name HG2* )) ((resid  161 and name HG*  ))   4.05  2.25  0.00 ! #SUP  2.49
assign  ((resid   47 and name HG1* )) ((resid   48 and name HN   ))   3.27  1.47  0.00 ! #SUP  5.69
assign  ((resid   47 and name HN   )) ((resid   47 and name HG1* ))   3.60  1.80  0.00 ! #SUP  6.75
assign  ((resid   47 and name HA   )) ((resid   47 and name HG1* ))   3.28  1.48  0.00 ! #SUP  4.34
assign  ((resid   91 and name HB*  )) ((resid   92 and name HN   ))   3.12  1.32  0.00 ! #SUP  4.85
assign  ((resid   91 and name HN   )) ((resid   91 and name HB*  ))   2.98  1.18  0.00 ! #SUP  4.96
assign  ((resid   87 and name HA   )) ((resid   91 and name HB*  ))   4.76  2.96  0.00 ! #SUP  4.09
assign  ((resid   88 and name HD2  )) ((resid   91 and name HB*  ))   3.95  2.15  0.00 ! #SUP  4.58
assign  ((resid   88 and name HD1  )) ((resid   91 and name HB*  ))   3.60  1.80  0.00 ! #SUP  4.57
assign  ((resid   88 and name HB2  )) ((resid   91 and name HB*  ))   4.29  2.49  0.00 ! #SUP  3.57
assign  ((resid   88 and name HG*  )) ((resid   91 and name HB*  ))   3.65  1.85  0.00 ! #SUP  5.43
assign  ((resid   87 and name HG2* )) ((resid   91 and name HB*  ))   3.14  1.34  0.00 ! #SUP  7.12
assign  ((resid   22 and name HB1  )) ((resid   91 and name HB*  ))   3.90  2.10  0.00 ! #SUP  0.58
assign  ((resid   87 and name HD1* )) ((resid   91 and name HB*  ))   4.26  2.46  0.00 ! #SUP  3.57
assign  ((resid   47 and name HN   )) ((resid   47 and name HG2* ))   3.51  1.71  0.00 ! #SUP  7.54
assign  ((resid   29 and name HD*  )) ((resid   47 and name HG2* ))   4.69  2.89  0.00 ! #SUP  3.71
assign  ((resid   29 and name HA   )) ((resid   47 and name HG2* ))   4.14  2.34  0.00 ! #SUP  7.04
assign  ((resid   46 and name HA   )) ((resid   47 and name HG2* ))   4.17  2.37  0.00 ! #SUP  5.66
assign  ((resid   28 and name HA1  )) ((resid   47 and name HG2* ))   4.46  2.66  0.00 ! #SUP  4.95
assign  ((resid   28 and name HA2  )) ((resid   47 and name HG2* ))   4.07  2.27  0.00 ! #SUP  7.20
assign  ((resid   47 and name HA   )) ((resid   47 and name HG2* ))   3.34  1.54  0.00 ! #SUP  4.80
assign  ((resid   30 and name HN   )) ((resid   47 and name HG2* ))   4.60  2.80  0.00 ! #SUP  3.85
assign  ((resid   72 and name HN   )) ((resid   72 and name HG*  ))   4.17  2.37  0.00 ! #SUP  5.03
assign  ((resid   72 and name HG*  )) ((resid   75 and name HN   ))   3.93  2.13  0.00 ! #SUP  6.27
assign  ((resid   72 and name HG*  )) ((resid   73 and name HN   ))   4.64  2.84  0.00 ! #SUP  6.53
assign  ((resid   66 and name HA   )) ((resid   72 and name HG*  ))   4.64  2.84  0.00 ! #SUP  5.27
assign  ((resid   72 and name HG*  )) ((resid   75 and name HA   ))   4.97  3.17  0.00 ! #SUP  3.75
assign  ((resid   72 and name HA   )) ((resid   72 and name HG*  ))   3.41  1.61  0.00 ! #SUP  3.97
assign  ((resid   72 and name HG*  )) ((resid   75 and name HB2  ))   4.96  3.16  0.00 ! #SUP  7.41
assign  ((resid   72 and name HG*  )) ((resid   75 and name HB1  ))   5.22  3.42  0.00 ! #SUP  3.52
assign  ((resid   67 and name HB   )) ((resid   72 and name HG*  ))   4.09  2.29  0.00 ! #SUP  1.50
assign  ((resid   72 and name HG*  )) ((resid   80 and name HG*  ))   3.98  2.18  0.00 ! #SUP  1.50
assign  ((resid   91 and name HB*  )) ((resid   93 and name HG1* ))   5.43  3.63  0.00 ! #SUP  2.04
assign  ((resid  119 and name HN   )) ((resid  119 and name HB*  ))   3.83  2.03  0.00 ! #SUP  3.72
assign  ((resid  119 and name HB*  )) ((resid  120 and name HN   ))   4.04  2.24  0.00 ! #SUP  4.47
assign  ((resid   63 and name HG2* )) ((resid   65 and name HA   ))   4.60  2.80  0.00 ! #SUP  1.98
assign  ((resid   40 and name HB2  )) ((resid   63 and name HG2* ))   4.55  2.75  0.00 ! #SUP  5.60
assign  ((resid   40 and name HB1  )) ((resid   63 and name HG2* ))   4.48  2.68  0.00 ! #SUP  4.26
assign  ((resid   63 and name HG2* )) ((resid   98 and name HB*  ))   4.49  2.69  0.00 ! #SUP  2.77
assign  ((resid   63 and name HG2* )) ((resid   65 and name HG1* ))   4.63  2.83  0.00 ! #SUP  2.50
assign  ((resid   63 and name HG2* )) ((resid   98 and name HN   ))   4.70  2.90  0.00 ! #SUP  5.27
assign  ((resid   63 and name HN   )) ((resid   63 and name HG2* ))   4.53  2.73  0.00 ! #SUP  4.63
assign  ((resid   63 and name HG2* )) ((resid   64 and name HN   ))   3.93  2.13  0.00 ! #SUP  7.42
assign  ((resid   63 and name HA   )) ((resid   63 and name HG2* ))   4.21  2.41  0.00 ! #SUP  4.88
assign  ((resid   42 and name HA   )) ((resid   63 and name HG2* ))   4.75  2.95  0.00 ! #SUP  5.20
assign  ((resid   72 and name HN   )) ((resid   72 and name HG*  ))   3.58  1.78  0.00 ! #SUP  5.62
assign  ((resid   72 and name HG*  )) ((resid   73 and name HN   ))   3.95  2.15  0.00 ! #SUP  7.09
assign  ((resid   71 and name HA   )) ((resid   72 and name HG*  ))   4.67  2.87  0.00 ! #SUP  4.57
assign  ((resid   72 and name HG*  )) ((resid   80 and name HG*  ))   3.68  1.88  0.00 ! #SUP  1.50
assign  ((resid   67 and name HG1* )) ((resid   72 and name HG*  ))   3.62  1.82  0.00 ! #SUP  1.72
assign  ((resid   67 and name HN   )) ((resid   72 and name HG*  ))   4.01  2.21  0.00 ! #SUP  7.09
assign  ((resid   52 and name HB*  )) ((resid   53 and name HN   ))   4.00  2.20  0.00 ! #SUP  3.03
assign  ((resid   52 and name HN   )) ((resid   52 and name HB*  ))   3.33  1.53  0.00 ! #SUP  4.81
assign  ((resid   46 and name HA   )) ((resid   52 and name HB*  ))   4.90  3.10  0.00 ! #SUP  1.02
assign  ((resid    5 and name HG2* )) ((resid   10 and name HB1  ))   5.26  3.46  0.00 ! #SUP  1.50
assign  ((resid   52 and name HB*  )) ((resid   58 and name HG1  ))   4.86  3.06  0.00 ! #SUP  0.74
assign  ((resid   52 and name HB*  )) ((resid   55 and name HN   ))   5.28  3.48  0.00 ! #SUP  2.16
assign  ((resid   29 and name HB*  )) ((resid   52 and name HB*  ))   4.47  2.67  0.00 ! #SUP  2.44
assign  ((resid    5 and name HG2* )) ((resid    6 and name HA   ))   5.33  3.53  0.00 ! #SUP  5.27
assign  ((resid   18 and name HG2* )) ((resid   95 and name HN   ))   4.28  2.48  0.00 ! #SUP  5.21
assign  ((resid   18 and name HN   )) ((resid   18 and name HG2* ))   3.60  1.80  0.00 ! #SUP  5.70
assign  ((resid   18 and name HG2* )) ((resid   19 and name HN   ))   3.92  2.12  0.00 ! #SUP  5.42
assign  ((resid   17 and name HA   )) ((resid   18 and name HG2* ))   4.08  2.28  0.00 ! #SUP  4.04
assign  ((resid   18 and name HG2* )) ((resid   58 and name HB2  ))   4.56  2.76  0.00 ! #SUP  2.61
assign  ((resid   18 and name HG2* )) ((resid   95 and name HB*  ))   3.61  1.81  0.00 ! #SUP  4.34
assign  ((resid   18 and name HG2* )) ((resid   95 and name HD2* ))   4.02  2.22  0.00 ! #SUP  2.96
assign  ((resid   78 and name HB*  )) ((resid   79 and name HG2  ))   4.86  3.06  0.00 ! #SUP  5.80
assign  ((resid   77 and name HB1  )) ((resid   78 and name HB*  ))   3.86  2.06  0.00 ! #SUP  2.94
assign  ((resid   53 and name HN   )) ((resid   53 and name HB*  ))   3.44  1.64  0.00 ! #SUP  4.45
assign  ((resid   49 and name HN   )) ((resid   53 and name HB*  ))   4.05  2.25  0.00 ! #SUP  6.62
assign  ((resid   53 and name HB*  )) ((resid   54 and name HN   ))   3.61  1.81  0.00 ! #SUP  6.58
assign  ((resid   50 and name HN   )) ((resid   53 and name HB*  ))   3.82  2.02  0.00 ! #SUP  5.13
assign  ((resid   46 and name HA   )) ((resid   53 and name HB*  ))   4.94  3.14  0.00 ! #SUP  3.06
assign  ((resid   49 and name HB1  )) ((resid   53 and name HB*  ))   5.14  3.34  0.00 ! #SUP  4.04
assign  ((resid   46 and name HD1* )) ((resid   53 and name HB*  ))   4.08  2.28  0.00 ! #SUP  5.04
assign  ((resid   46 and name HD2* )) ((resid   53 and name HB*  ))   4.31  2.51  0.00 ! #SUP  3.97
assign  ((resid   78 and name HN   )) ((resid   78 and name HB*  ))   3.06  1.26  0.00 ! #SUP  5.95
assign  ((resid   78 and name HB*  )) ((resid   79 and name HN   ))   3.55  1.75  0.00 ! #SUP  5.41
assign  ((resid   32 and name HG2* )) ((resid   33 and name HN   ))   4.53  2.73  0.00 ! #SUP  5.01
assign  ((resid   32 and name HG2* )) ((resid   42 and name HN   ))   4.67  2.87  0.00 ! #SUP  5.45
assign  ((resid   32 and name HN   )) ((resid   32 and name HG2* ))   3.70  1.90  0.00 ! #SUP  5.87
assign  ((resid   32 and name HG2* )) ((resid   44 and name HA   ))   4.66  2.86  0.00 ! #SUP  3.20
assign  ((resid   31 and name HB   )) ((resid   32 and name HG2* ))   5.07  3.27  0.00 ! #SUP  4.12
assign  ((resid   32 and name HG2* )) ((resid   42 and name HB2  ))   4.06  2.26  0.00 ! #SUP  1.73
assign  ((resid   64 and name HG2* )) ((resid   65 and name HN   ))   3.86  2.06  0.00 ! #SUP  6.09
assign  ((resid   64 and name HN   )) ((resid   64 and name HG2* ))   4.28  2.48  0.00 ! #SUP  7.09
assign  ((resid   64 and name HG2* )) ((resid   66 and name HN   ))   4.17  2.37  0.00 ! #SUP  4.75
assign  ((resid   64 and name HG2* )) ((resid   64 and name HG12 ))   4.12  2.32  0.00 ! #SUP  5.62
assign  ((resid   64 and name HG2* )) ((resid   64 and name HD1* ))   3.42  1.62  0.00 ! #SUP  5.30
assign  ((resid   64 and name HG2* )) ((resid   72 and name HG*  ))   3.45  1.65  0.00 ! #SUP  0.87
assign  ((resid   16 and name HN   )) ((resid   16 and name HG2* ))   4.45  2.65  0.00 ! #SUP  7.69
assign  ((resid   16 and name HA   )) ((resid   16 and name HG2* ))   3.23  1.43  0.00 ! #SUP  6.50
assign  ((resid  120 and name HN   )) ((resid  120 and name HG2* ))   4.02  2.22  0.00 ! #SUP  6.72
assign  ((resid  120 and name HA   )) ((resid  120 and name HG2* ))   3.61  1.81  0.00 ! #SUP  5.74
assign  ((resid  120 and name HG2* )) ((resid  120 and name HG12 ))   3.94  2.14  0.00 ! #SUP  5.03
assign  ((resid   43 and name HG2* )) ((resid   44 and name HA   ))   4.14  2.34  0.00 ! #SUP  4.82
assign  ((resid   43 and name HG2* )) ((resid   61 and name HN   ))   4.10  2.30  0.00 ! #SUP  5.91
assign  ((resid   43 and name HG2* )) ((resid   44 and name HN   ))   3.49  1.69  0.00 ! #SUP  6.43
assign  ((resid   43 and name HN   )) ((resid   43 and name HG2* ))   4.09  2.29  0.00 ! #SUP  6.94
assign  ((resid   43 and name HG2* )) ((resid   45 and name HN   ))   4.06  2.26  0.00 ! #SUP  5.49
assign  ((resid   43 and name HA   )) ((resid   43 and name HG2* ))   3.54  1.74  0.00 ! #SUP  5.51
assign  ((resid   87 and name HN   )) ((resid   87 and name HG2* ))   3.98  2.18  0.00 ! #SUP  8.23
assign  ((resid   89 and name HG2* )) ((resid   90 and name HA*  ))   3.71  1.91  0.00 ! #SUP  5.45
assign  ((resid  120 and name HG2* )) ((resid  121 and name HA   ))   4.56  2.76  0.00 ! #SUP  4.66
assign  ((resid   87 and name HA   )) ((resid   87 and name HG2* ))   3.73  1.93  0.00 ! #SUP  8.14
assign  ((resid   87 and name HG2* )) ((resid   88 and name HD2  ))   3.98  2.18  0.00 ! #SUP  7.74
assign  ((resid   87 and name HG2* )) ((resid   88 and name HD1  ))   3.71  1.91  0.00 ! #SUP  6.52
assign  ((resid   87 and name HG2* )) ((resid   87 and name HG12 ))   3.75  1.95  0.00 ! #SUP  6.60
assign  ((resid   87 and name HG2* )) ((resid   87 and name HD1* ))   3.63  1.83  0.00 ! #SUP  6.31
assign  ((resid   87 and name HG2* )) ((resid   93 and name HG2* ))   5.16  3.36  0.00 ! #SUP  1.79
assign  ((resid   89 and name HG2* )) ((resid   90 and name HN   ))   3.45  1.65  0.00 ! #SUP  5.45
assign  ((resid   89 and name HN   )) ((resid   89 and name HG2* ))   3.68  1.88  0.00 ! #SUP  7.77
assign  ((resid   89 and name HA   )) ((resid   89 and name HG2* ))   3.41  1.61  0.00 ! #SUP  7.11
assign  ((resid   89 and name HG2* )) ((resid   89 and name HG11 ))   3.74  1.94  0.00 ! #SUP  5.62
assign  ((resid   89 and name HG2* )) ((resid   89 and name HD1* ))   2.97  1.17  0.00 ! #SUP  5.82
assign  ((resid   89 and name HG2* )) ((resid   90 and name HA*  ))   4.40  2.60  0.00 ! #SUP  6.04
assign  ((resid   89 and name HG2* )) ((resid   91 and name HN   ))   4.80  3.00  0.00 ! #SUP  4.26
assign  ((resid   80 and name HA   )) ((resid   83 and name HG2* ))   4.74  2.94  0.00 ! #SUP  2.25
assign  ((resid   83 and name HG2* )) ((resid   84 and name HN   ))   3.95  2.15  0.00 ! #SUP  7.10
assign  ((resid   83 and name HN   )) ((resid   83 and name HG2* ))   3.84  2.04  0.00 ! #SUP  8.73
assign  ((resid   83 and name HA   )) ((resid   83 and name HG2* ))   3.23  1.43  0.00 ! #SUP  6.98
assign  ((resid   83 and name HG2* )) ((resid   83 and name HG12 ))   3.63  1.83  0.00 ! #SUP  6.45
assign  ((resid   83 and name HG2* )) ((resid   83 and name HG11 ))   3.31  1.51  0.00 ! #SUP  6.65
assign  ((resid   83 and name HG2* )) ((resid   83 and name HD1* ))   3.23  1.43  0.00 ! #SUP  8.09
assign  ((resid   58 and name HG1  )) ((resid   58 and name HE*  ))   3.38  1.58  0.00 ! #SUP  3.87
assign  ((resid   52 and name HB*  )) ((resid   58 and name HE*  ))   3.28  1.48  0.00 ! #SUP  0.75
assign  ((resid   58 and name HE*  )) ((resid   97 and name HD*  ))   3.00  1.20  0.00 ! #SUP  3.46
assign  ((resid   43 and name HD1* )) ((resid   58 and name HE*  ))   3.30  1.50  0.00 ! #SUP  1.63
assign  ((resid   16 and name HA   )) ((resid   16 and name HD1* ))   3.89  2.09  0.00 ! #SUP  6.44
assign  ((resid   15 and name HN   )) ((resid   16 and name HD1* ))   3.72  1.92  0.00 ! #SUP  7.36
assign  ((resid   16 and name HD1* )) ((resid   99 and name HH2* ))   4.14  2.34  0.00 ! #SUP  4.14
assign  ((resid   14 and name HE*  )) ((resid   16 and name HD1* ))   4.19  2.39  0.00 ! #SUP  2.92
assign  ((resid   16 and name HD1* )) ((resid   99 and name HB*  ))   3.24  1.44  0.00 ! #SUP  5.29
assign  ((resid   83 and name HN   )) ((resid   83 and name HD1* ))   3.79  1.99  0.00 ! #SUP  8.78
assign  ((resid   83 and name HA   )) ((resid   83 and name HD1* ))   3.80  2.00  0.00 ! #SUP  6.84
assign  ((resid   83 and name HB   )) ((resid   83 and name HD1* ))   3.47  1.67  0.00 ! #SUP  7.08
assign  ((resid   16 and name HD1* )) ((resid   99 and name HN   ))   4.42  2.62  0.00 ! #SUP  6.71
assign  ((resid   16 and name HD1* )) ((resid   99 and name HD2  ))   5.04  3.24  0.00 ! #SUP  4.29
assign  ((resid   64 and name HD1* )) ((resid   84 and name HE*  ))   4.93  3.13  0.00 ! #SUP  1.08
assign  ((resid   87 and name HN   )) ((resid   87 and name HD1* ))   4.19  2.39  0.00 ! #SUP  7.29
assign  ((resid   84 and name HA   )) ((resid   87 and name HD1* ))   3.78  1.98  0.00 ! #SUP  0.99
assign  ((resid   87 and name HA   )) ((resid   87 and name HD1* ))   4.10  2.30  0.00 ! #SUP  7.80
assign  ((resid   87 and name HD1* )) ((resid   88 and name HD1  ))   4.22  2.42  0.00 ! #SUP  5.86
assign  ((resid   87 and name HD1* )) ((resid   93 and name HG2* ))   4.00  2.20  0.00 ! #SUP  0.75
assign  ((resid  119 and name HA   )) ((resid  120 and name HD1* ))   4.67  2.87  0.00 ! #SUP  5.53
assign  ((resid  120 and name HN   )) ((resid  120 and name HD1* ))   4.16  2.36  0.00 ! #SUP  7.34
assign  ((resid  120 and name HA   )) ((resid  120 and name HD1* ))   4.32  2.52  0.00 ! #SUP  5.62
assign  ((resid  120 and name HB   )) ((resid  120 and name HD1* ))   3.65  1.85  0.00 ! #SUP  6.27
assign  ((resid  118 and name HG*  )) ((resid  120 and name HD1* ))   3.71  1.91  0.00 ! #SUP  4.14
assign  ((resid  119 and name HN   )) ((resid  120 and name HD1* ))   4.75  2.95  0.00 ! #SUP  4.64
assign  ((resid   89 and name HA   )) ((resid   89 and name HD1* ))   3.91  2.11  0.00 ! #SUP  5.65
assign  ((resid   89 and name HN   )) ((resid   89 and name HD1* ))   3.57  1.77  0.00 ! #SUP  6.76
assign  ((resid   24 and name HA   )) ((resid   89 and name HD1* ))   3.43  1.63  0.00 ! #SUP  6.15
assign  ((resid   24 and name HB1  )) ((resid   89 and name HD1* ))   4.03  2.23  0.00 ! #SUP  1.72
assign  ((resid   89 and name HB   )) ((resid   89 and name HD1* ))   2.83  1.03  0.00 ! #SUP  5.10
assign  ((resid   43 and name HD1* )) ((resid   44 and name HN   ))   4.16  2.36  0.00 ! #SUP  5.33
assign  ((resid   43 and name HN   )) ((resid   43 and name HD1* ))   4.04  2.24  0.00 ! #SUP  7.39
assign  ((resid   43 and name HA   )) ((resid   43 and name HD1* ))   3.72  1.92  0.00 ! #SUP  6.57
assign  ((resid   43 and name HB   )) ((resid   43 and name HD1* ))   4.07  2.27  0.00 ! #SUP  6.62
assign  ((resid   43 and name HD1* )) ((resid   64 and name HD1* ))   3.63  1.83  0.00 ! #SUP  2.02
assign  ((resid   43 and name HG2* )) ((resid   43 and name HD1* ))   3.36  1.56  0.00 ! #SUP  7.06
assign  ((resid   29 and name HD*  )) ((resid   43 and name HG12 ))   5.48  3.68  0.00 ! #SUP  1.50
assign  ((resid   84 and name HD*  )) ((resid  161 and name HG*  ))   4.92  3.12  0.00 ! #SUP  3.11
assign  ((resid   27 and name HZ   )) ((resid   95 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   75 and name HA   )) ((resid   75 and name HE1  ))   5.50  3.70  0.00 ! #SUP  2.69
assign  ((resid   75 and name HD2  )) ((resid   76 and name HN   ))   5.46  3.66  0.00 ! #SUP  5.06
assign  ((resid   41 and name HD1* )) ((resid   75 and name HD2  ))   4.82  3.02  0.00 ! #SUP  1.46
assign  ((resid   77 and name HE1  )) ((resid   80 and name HG*  ))   5.33  3.53  0.00 ! #SUP  0.81
assign  ((resid   75 and name HN   )) ((resid   75 and name HD2  ))   5.35  3.55  0.00 ! #SUP  5.16

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY  -3           HT1      GLY  -3 113.949  16.798 -20.639
    2    H2   GLY  -3           HT2      GLY  -3 113.651  17.974 -21.826
    3    H3   GLY  -3           HT3      GLY  -3 115.223  17.736 -21.222
    4    HA2  GLY  -3           HA1      GLY  -3 113.678  15.756 -22.761
    5    HA3  GLY  -3           HA2      GLY  -3 114.998  16.746 -23.376
    6    H    ALA  -2           HN       ALA  -2 115.000  13.962 -23.449
    7    HA   ALA  -2           HA       ALA  -2 116.240  12.157 -23.059
    8    HB1  ALA  -2           HB1      ALA  -2 118.024  13.673 -23.835
    9    HB2  ALA  -2           HB2      ALA  -2 118.633  12.486 -22.679
   10    HB3  ALA  -2           HB3      ALA  -2 118.335  14.144 -22.165
   11    H    MET  -1           HN       MET  -1 114.492  12.232 -21.165
   12    HA   MET  -1           HA       MET  -1 115.783  12.248 -18.582
   13    HB2  MET  -1           HB2      MET  -1 113.350  13.042 -19.133
   14    HB3  MET  -1           HB1      MET  -1 112.951  11.335 -19.092
   15    HG2  MET  -1           HG2      MET  -1 114.149  12.918 -16.818
   16    HG3  MET  -1           HG1      MET  -1 112.454  12.502 -16.987
   17    HE1  MET  -1           HE1      MET  -1 112.467   9.499 -17.941
   18    HE2  MET  -1           HE2      MET  -1 111.475  10.090 -16.606
   19    HE3  MET  -1           HE3      MET  -1 112.468   8.648 -16.395
   20    H    GLY   0           HN       GLY   0 117.253  10.621 -18.971
   21    HA2  GLY   0           HA2      GLY   0 116.105   7.909 -18.948
   22    HA3  GLY   0           HA1      GLY   0 117.691   8.298 -19.611
   23    H    LYS   1           HN       LYS   1 116.399   9.649 -16.702
   24    HA   LYS   1           HA       LYS   1 118.542   8.348 -15.146
   25    HB2  LYS   1           HB2      LYS   1 117.453  11.172 -14.964
   26    HB3  LYS   1           HB1      LYS   1 118.429  10.454 -13.706
   27    HG2  LYS   1           HG2      LYS   1 119.855  11.856 -14.991
   28    HG3  LYS   1           HG1      LYS   1 120.263  10.193 -15.388
   29    HD2  LYS   1           HD2      LYS   1 120.258  11.512 -17.403
   30    HD3  LYS   1           HD1      LYS   1 118.905  10.388 -17.438
   31    HE2  LYS   1           HE2      LYS   1 118.198  12.558 -18.254
   32    HE3  LYS   1           HE1      LYS   1 117.387  12.197 -16.741
   33    HZ1  LYS   1           HZ1      LYS   1 118.176  14.464 -16.886
   34    HZ2  LYS   1           HZ2      LYS   1 119.782  13.946 -16.986
   35    HZ3  LYS   1           HZ3      LYS   1 118.864  13.655 -15.590
   36    HA   PRO   2           HA       PRO   2 115.250   7.055 -12.502
   37    HB2  PRO   2           HB2      PRO   2 116.398   7.120 -10.051
   38    HB3  PRO   2           HB1      PRO   2 116.649   5.848 -11.254
   39    HG2  PRO   2           HG2      PRO   2 118.361   8.184 -10.552
   40    HG3  PRO   2           HG1      PRO   2 118.884   6.525 -10.928
   41    HD2  PRO   2           HD2      PRO   2 119.022   8.593 -12.703
   42    HD3  PRO   2           HD1      PRO   2 118.777   6.915 -13.215
   43    H    PHE   3           HN       PHE   3 113.710   8.080 -12.098
   44    HA   PHE   3           HA       PHE   3 113.596  10.823 -11.485
   45    HB2  PHE   3           HB2      PHE   3 111.030  10.266 -11.356
   46    HB3  PHE   3           HB1      PHE   3 111.895  10.101 -12.904
   47    HD1  PHE   3           HD2      PHE   3 110.678   8.291  -9.975
   48    HD2  PHE   3           HD1      PHE   3 111.883   8.082 -14.017
   49    HE1  PHE   3           HE2      PHE   3 109.909   6.012 -10.048
   50    HE2  PHE   3           HE1      PHE   3 111.110   5.742 -14.144
   51    HZ   PHE   3           HZ       PHE   3 110.115   4.686 -12.152
   52    H    PHE   4           HN       PHE   4 112.859  11.758  -9.738
   53    HA   PHE   4           HA       PHE   4 112.518  10.198  -7.319
   54    HB2  PHE   4           HB2      PHE   4 114.871  10.514  -7.168
   55    HB3  PHE   4           HB1      PHE   4 114.729  12.151  -7.811
   56    HD1  PHE   4           HD1      PHE   4 114.101  14.015  -6.418
   57    HD2  PHE   4           HD2      PHE   4 114.461  10.100  -4.760
   58    HE1  PHE   4           HE1      PHE   4 113.963  14.965  -4.197
   59    HE2  PHE   4           HE2      PHE   4 114.340  11.072  -2.514
   60    HZ   PHE   4           HZ       PHE   4 114.102  13.496  -2.218
   61    H    THR   5           HN       THR   5 111.101  11.041  -6.059
   62    HA   THR   5           HA       THR   5 111.349  13.657  -5.230
   63    HB   THR   5           HB       THR   5 109.781  14.180  -7.031
   64    HG1  THR   5           HG1      THR   5 109.103  15.658  -5.752
   65   HG21  THR   5          HG21      THR   5 107.412  13.469  -6.912
   66   HG22  THR   5          HG22      THR   5 107.801  12.498  -5.494
   67   HG23  THR   5          HG23      THR   5 108.466  12.055  -7.051
   68    H    ARG   6           HN       ARG   6 109.511  10.927  -4.894
   69    HA   ARG   6           HA       ARG   6 110.121   9.990  -2.312
   70    HB2  ARG   6           HB2      ARG   6 108.760  11.147  -0.688
   71    HB3  ARG   6           HB1      ARG   6 109.683  12.365  -1.533
   72    HG2  ARG   6           HG2      ARG   6 107.513  12.513  -3.016
   73    HG3  ARG   6           HG1      ARG   6 106.762  11.855  -1.558
   74    HD2  ARG   6           HD2      ARG   6 107.888  13.649  -0.264
   75    HD3  ARG   6           HD1      ARG   6 108.441  14.301  -1.812
   76    HE   ARG   6           HE       ARG   6 105.696  14.232  -0.813
   77   HH11  ARG   6          HH11      ARG   6 107.872  15.183  -3.503
   78   HH12  ARG   6          HH12      ARG   6 106.865  16.425  -4.019
   79   HH21  ARG   6          HH21      ARG   6 104.334  15.974  -1.590
   80   HH22  ARG   6          HH22      ARG   6 104.832  16.898  -2.918
   81    H    ASN   7           HN       ASN   7 107.896  10.849  -4.567
   82    HA   ASN   7           HA       ASN   7 105.481   9.720  -3.888
   83    HB2  ASN   7           HB2      ASN   7 106.235  11.232  -5.736
   84    HB3  ASN   7           HB1      ASN   7 106.705   9.774  -6.590
   85   HD21  ASN   7          HD21      ASN   7 105.048  11.656  -7.303
   86   HD22  ASN   7          HD22      ASN   7 103.430  11.053  -7.569
   87    HA   PRO   8           HA       PRO   8 106.747   5.260  -4.089
   88    HB2  PRO   8           HB2      PRO   8 103.998   4.757  -3.795
   89    HB3  PRO   8           HB1      PRO   8 105.214   4.282  -2.709
   90    HG2  PRO   8           HG2      PRO   8 103.269   6.246  -2.508
   91    HG3  PRO   8           HG1      PRO   8 104.584   6.055  -1.312
   92    HD2  PRO   8           HD2      PRO   8 104.051   8.104  -3.175
   93    HD3  PRO   8           HD1      PRO   8 105.462   8.033  -2.086
   94    H    SER   9           HN       SER   9 104.153   7.039  -5.393
   95    HA   SER   9           HA       SER   9 103.441   4.942  -6.888
   96    HB2  SER   9           HB2      SER   9 101.808   6.367  -5.933
   97    HB3  SER   9           HB1      SER   9 102.353   7.726  -6.926
   98    HG   SER   9           HG       SER   9 101.807   6.130  -8.746
   99    H    GLU  10           HN       GLU  10 105.681   7.638  -7.246
  100    HA   GLU  10           HA       GLU  10 105.579   7.912 -10.087
  101    HB2  GLU  10           HB2      GLU  10 107.716   9.166  -9.952
  102    HB3  GLU  10           HB1      GLU  10 106.718   9.695  -8.601
  103    HG2  GLU  10           HG2      GLU  10 108.080   8.062  -7.200
  104    HG3  GLU  10           HG1      GLU  10 109.110   7.860  -8.608
  105    H    LEU  11           HN       LEU  11 107.200   6.077  -7.692
  106    HA   LEU  11           HA       LEU  11 108.980   4.595  -9.226
  107    HB2  LEU  11           HB2      LEU  11 107.487   3.905  -6.718
  108    HB3  LEU  11           HB1      LEU  11 108.840   2.993  -7.360
  109    HG   LEU  11           HG       LEU  11 109.023   5.888  -6.533
  110   HD11  LEU  11          HD11      LEU  11 110.186   5.037  -4.559
  111   HD12  LEU  11          HD12      LEU  11 109.786   3.390  -5.073
  112   HD13  LEU  11          HD13      LEU  11 108.503   4.503  -4.620
  113   HD21  LEU  11          HD21      LEU  11 111.076   3.802  -7.233
  114   HD22  LEU  11          HD22      LEU  11 111.455   5.407  -6.597
  115   HD23  LEU  11          HD23      LEU  11 110.677   5.231  -8.173
  116    H    LYS  12           HN       LYS  12 108.842   2.871 -10.273
  117    HA   LYS  12           HA       LYS  12 106.209   2.184 -11.389
  118    HB2  LYS  12           HB2      LYS  12 107.468   1.296 -13.264
  119    HB3  LYS  12           HB1      LYS  12 107.866   2.983 -12.932
  120    HG2  LYS  12           HG2      LYS  12 109.876   2.468 -11.971
  121    HG3  LYS  12           HG1      LYS  12 109.453   0.785 -11.741
  122    HD2  LYS  12           HD2      LYS  12 111.049   0.972 -13.578
  123    HD3  LYS  12           HD1      LYS  12 109.472   0.598 -14.282
  124    HE2  LYS  12           HE2      LYS  12 109.108   3.007 -14.635
  125    HE3  LYS  12           HE1      LYS  12 110.743   3.311 -14.060
  126    HZ1  LYS  12           HZ1      LYS  12 109.922   1.842 -16.480
  127    HZ2  LYS  12           HZ2      LYS  12 111.503   1.842 -15.910
  128    HZ3  LYS  12           HZ3      LYS  12 110.733   3.321 -16.357
  129    H    GLY  13           HN       GLY  13 106.173  -0.094 -12.370
  130    HA2  GLY  13           HA2      GLY  13 106.676  -2.361 -12.244
  131    HA3  GLY  13           HA1      GLY  13 107.498  -2.068 -10.714
  132    H    LYS  14           HN       LYS  14 106.446  -2.214  -8.914
  133    HA   LYS  14           HA       LYS  14 103.563  -2.479  -8.857
  134    HB2  LYS  14           HB2      LYS  14 103.762  -4.618  -7.552
  135    HB3  LYS  14           HB1      LYS  14 104.213  -4.773  -9.245
  136    HG2  LYS  14           HG2      LYS  14 106.551  -4.103  -7.873
  137    HG3  LYS  14           HG1      LYS  14 105.753  -5.323  -6.889
  138    HD2  LYS  14           HD2      LYS  14 106.225  -5.605  -9.851
  139    HD3  LYS  14           HD1      LYS  14 107.366  -6.182  -8.640
  140    HE2  LYS  14           HE2      LYS  14 105.703  -7.673  -7.737
  141    HE3  LYS  14           HE1      LYS  14 104.480  -7.059  -8.843
  142    HZ1  LYS  14           HZ1      LYS  14 105.431  -9.178  -9.592
  143    HZ2  LYS  14           HZ2      LYS  14 106.969  -8.503  -9.657
  144    HZ3  LYS  14           HZ3      LYS  14 105.754  -7.951 -10.683
  145    H    PHE  15           HN       PHE  15 102.804  -1.556  -7.177
  146    HA   PHE  15           HA       PHE  15 104.575  -0.715  -5.039
  147    HB2  PHE  15           HB2      PHE  15 103.539   1.084  -6.380
  148    HB3  PHE  15           HB1      PHE  15 101.968   0.354  -6.120
  149    HD1  PHE  15           HD1      PHE  15 104.089   0.399  -3.202
  150    HD2  PHE  15           HD2      PHE  15 101.357   2.656  -5.502
  151    HE1  PHE  15           HE1      PHE  15 103.742   1.916  -1.272
  152    HE2  PHE  15           HE2      PHE  15 100.996   4.198  -3.605
  153    HZ   PHE  15           HZ       PHE  15 102.186   3.843  -1.499
  154    H    ILE  16           HN       ILE  16 104.287  -1.911  -3.329
  155    HA   ILE  16           HA       ILE  16 101.692  -3.106  -2.875
  156    HB   ILE  16           HB       ILE  16 102.893  -5.083  -1.848
  157   HG12  ILE  16          HG12      ILE  16 105.215  -4.056  -1.957
  158   HG13  ILE  16          HG11      ILE  16 105.102  -5.713  -2.520
  159   HG21  ILE  16          HG21      ILE  16 103.078  -6.298  -3.970
  160   HG22  ILE  16          HG22      ILE  16 102.899  -4.762  -4.824
  161   HG23  ILE  16          HG23      ILE  16 101.594  -5.362  -3.799
  162   HD11  ILE  16          HD11      ILE  16 106.579  -4.317  -3.929
  163   HD12  ILE  16          HD12      ILE  16 105.188  -3.288  -4.331
  164   HD13  ILE  16          HD13      ILE  16 105.206  -4.966  -4.821
  165    H    HIS  17           HN       HIS  17 101.175  -3.562  -0.790
  166    HA   HIS  17           HA       HIS  17 102.816  -2.247   1.238
  167    HB2  HIS  17           HB2      HIS  17 100.861  -0.894   0.569
  168    HB3  HIS  17           HB1      HIS  17  99.805  -2.253   0.985
  169    HD1  HIS  17           HD1      HIS  17  98.534  -1.021   2.844
  170    HD2  HIS  17           HD2      HIS  17 102.643  -0.958   3.326
  171    HE1  HIS  17           HE1      HIS  17  98.959   0.036   5.093
  172    H    THR  18           HN       THR  18 103.591  -3.937   2.189
  173    HA   THR  18           HA       THR  18 101.826  -6.210   2.788
  174    HB   THR  18           HB       THR  18 103.300  -6.782   0.873
  175    HG1  THR  18           HG1      THR  18 104.471  -8.564   2.351
  176   HG21  THR  18          HG21      THR  18 105.712  -7.071   1.178
  177   HG22  THR  18          HG22      THR  18 105.577  -6.503   2.841
  178   HG23  THR  18          HG23      THR  18 105.251  -5.397   1.510
  179    H    LYS  19           HN       LYS  19 102.085  -7.200   4.750
  180    HA   LYS  19           HA       LYS  19 103.478  -5.655   6.757
  181    HB2  LYS  19           HB2      LYS  19 101.170  -6.274   7.108
  182    HB3  LYS  19           HB1      LYS  19 101.529  -7.963   6.860
  183    HG2  LYS  19           HG2      LYS  19 102.574  -6.366   9.213
  184    HG3  LYS  19           HG1      LYS  19 101.045  -7.230   9.240
  185    HD2  LYS  19           HD2      LYS  19 102.546  -9.291   8.514
  186    HD3  LYS  19           HD1      LYS  19 103.836  -8.296   9.189
  187    HE2  LYS  19           HE2      LYS  19 103.016  -9.829  10.853
  188    HE3  LYS  19           HE1      LYS  19 102.664  -8.159  11.296
  189    HZ1  LYS  19           HZ1      LYS  19 100.735 -10.036  10.061
  190    HZ2  LYS  19           HZ2      LYS  19 100.380  -8.478  10.611
  191    HZ3  LYS  19           HZ3      LYS  19 100.828  -9.686  11.697
  192    H    LEU  20           HN       LEU  20 105.331  -6.234   7.712
  193    HA   LEU  20           HA       LEU  20 106.295  -8.969   7.320
  194    HB2  LEU  20           HB2      LEU  20 107.670  -6.415   7.012
  195    HB3  LEU  20           HB1      LEU  20 108.481  -7.476   8.139
  196    HG   LEU  20           HG       LEU  20 108.823  -9.144   6.445
  197   HD11  LEU  20          HD11      LEU  20 106.750  -8.958   5.267
  198   HD12  LEU  20          HD12      LEU  20 108.157  -8.911   4.211
  199   HD13  LEU  20          HD13      LEU  20 107.268  -7.410   4.563
  200   HD21  LEU  20          HD21      LEU  20 109.461  -6.400   5.431
  201   HD22  LEU  20          HD22      LEU  20 110.200  -7.906   4.890
  202   HD23  LEU  20          HD23      LEU  20 110.420  -7.367   6.553
  203    H    ARG  21           HN       ARG  21 106.329 -10.060   9.053
  204    HA   ARG  21           HA       ARG  21 105.824  -8.714  11.498
  205    HB2  ARG  21           HB2      ARG  21 104.765 -10.900  10.753
  206    HB3  ARG  21           HB1      ARG  21 106.317 -11.649  11.084
  207    HG2  ARG  21           HG2      ARG  21 106.203 -10.956  13.393
  208    HG3  ARG  21           HG1      ARG  21 104.673 -10.138  13.085
  209    HD2  ARG  21           HD2      ARG  21 103.802 -12.368  12.320
  210    HD3  ARG  21           HD1      ARG  21 105.264 -13.073  13.011
  211    HE   ARG  21           HE       ARG  21 103.821 -11.320  14.768
  212   HH11  ARG  21          HH11      ARG  21 104.214 -14.704  13.764
  213   HH12  ARG  21          HH12      ARG  21 103.447 -15.326  15.142
  214   HH21  ARG  21          HH21      ARG  21 102.790 -12.212  16.669
  215   HH22  ARG  21          HH22      ARG  21 102.634 -13.885  16.827
  216    H    LYS  22           HN       LYS  22 107.576  -7.839  12.528
  217    HA   LYS  22           HA       LYS  22 110.224  -8.320  12.488
  218    HB2  LYS  22           HB2      LYS  22 108.270  -7.510  14.536
  219    HB3  LYS  22           HB1      LYS  22 109.826  -8.047  15.131
  220    HG2  LYS  22           HG2      LYS  22 109.825  -5.679  14.905
  221    HG3  LYS  22           HG1      LYS  22 110.908  -6.494  13.760
  222    HD2  LYS  22           HD2      LYS  22 109.794  -4.660  12.610
  223    HD3  LYS  22           HD1      LYS  22 109.168  -6.178  11.994
  224    HE2  LYS  22           HE2      LYS  22 107.284  -4.791  12.282
  225    HE3  LYS  22           HE1      LYS  22 107.268  -5.880  13.650
  226    HZ1  LYS  22           HZ1      LYS  22 108.268  -3.073  13.722
  227    HZ2  LYS  22           HZ2      LYS  22 108.142  -4.083  15.054
  228    HZ3  LYS  22           HZ3      LYS  22 106.780  -3.574  14.261
  229    H    SER  23           HN       SER  23 110.999 -10.286  12.330
  230    HA   SER  23           HA       SER  23 110.151 -12.315  14.275
  231    HB2  SER  23           HB2      SER  23 109.298 -12.719  11.950
  232    HB3  SER  23           HB1      SER  23 110.965 -12.774  11.389
  233    HG   SER  23           HG       SER  23 111.039 -14.754  12.000
  234    H    SER  24           HN       SER  24 111.745 -13.393  15.264
  235    HA   SER  24           HA       SER  24 113.739 -13.719  16.231
  236    HB2  SER  24           HB2      SER  24 114.698 -13.664  13.383
  237    HB3  SER  24           HB1      SER  24 115.537 -14.387  14.763
  238    HG   SER  24           HG       SER  24 112.905 -15.157  14.300
  239    H    ARG  25           HN       ARG  25 112.961 -10.908  15.833
  240    HA   ARG  25           HA       ARG  25 113.638  -9.000  16.631
  241    HB2  ARG  25           HB2      ARG  25 115.387 -10.524  17.914
  242    HB3  ARG  25           HB1      ARG  25 116.527  -9.861  16.760
  243    HG2  ARG  25           HG2      ARG  25 114.840  -8.304  18.691
  244    HG3  ARG  25           HG1      ARG  25 116.554  -8.684  18.914
  245    HD2  ARG  25           HD2      ARG  25 115.353  -7.226  16.665
  246    HD3  ARG  25           HD1      ARG  25 116.142  -6.374  18.023
  247    HE   ARG  25           HE       ARG  25 118.045  -8.061  17.056
  248   HH11  ARG  25          HH11      ARG  25 116.071  -5.543  15.590
  249   HH12  ARG  25          HH12      ARG  25 117.069  -5.322  14.230
  250   HH21  ARG  25          HH21      ARG  25 119.508  -7.709  15.191
  251   HH22  ARG  25          HH22      ARG  25 119.057  -6.565  14.015
  252    H    GLY  26           HN       GLY  26 113.247  -7.735  15.051
  253    HA2  GLY  26           HA2      GLY  26 113.931  -6.206  13.378
  254    HA3  GLY  26           HA1      GLY  26 115.343  -7.237  13.099
  255    H    PHE  27           HN       PHE  27 115.189  -7.757  11.061
  256    HA   PHE  27           HA       PHE  27 112.607  -8.750  10.133
  257    HB2  PHE  27           HB2      PHE  27 114.549  -6.861   8.997
  258    HB3  PHE  27           HB1      PHE  27 113.442  -7.644   7.895
  259    HD1  PHE  27           HD1      PHE  27 110.904  -7.328   8.575
  260    HD2  PHE  27           HD2      PHE  27 114.104  -4.982  10.044
  261    HE1  PHE  27           HE1      PHE  27 109.318  -5.552   9.190
  262    HE2  PHE  27           HE2      PHE  27 112.561  -3.234  10.664
  263    HZ   PHE  27           HZ       PHE  27 110.167  -3.483  10.262
  264    H    GLY  28           HN       GLY  28 115.823  -8.518   8.633
  265    HA2  GLY  28           HA2      GLY  28 117.033 -10.542   8.152
  266    HA3  GLY  28           HA1      GLY  28 115.479 -11.359   7.986
  267    H    PHE  29           HN       PHE  29 116.847  -8.348   6.774
  268    HA   PHE  29           HA       PHE  29 117.112  -9.300   4.143
  269    HB2  PHE  29           HB2      PHE  29 115.571  -7.823   2.962
  270    HB3  PHE  29           HB1      PHE  29 114.665  -8.877   4.018
  271    HD1  PHE  29           HD1      PHE  29 115.960  -5.467   3.641
  272    HD2  PHE  29           HD2      PHE  29 113.129  -7.957   5.566
  273    HE1  PHE  29           HE1      PHE  29 114.738  -3.461   4.433
  274    HE2  PHE  29           HE2      PHE  29 111.927  -5.975   6.375
  275    HZ   PHE  29           HZ       PHE  29 112.718  -3.732   5.803
  276    H    THR  30           HN       THR  30 118.450  -7.972   2.960
  277    HA   THR  30           HA       THR  30 119.443  -5.745   4.574
  278    HB   THR  30           HB       THR  30 121.614  -6.132   3.393
  279    HG1  THR  30           HG1      THR  30 120.858  -8.713   2.690
  280   HG21  THR  30          HG21      THR  30 120.579  -8.575   4.823
  281   HG22  THR  30          HG22      THR  30 121.146  -7.122   5.615
  282   HG23  THR  30          HG23      THR  30 122.271  -8.096   4.661
  283    H    VAL  31           HN       VAL  31 119.702  -3.912   3.854
  284    HA   VAL  31           HA       VAL  31 118.554  -3.463   1.274
  285    HB   VAL  31           HB       VAL  31 116.681  -3.433   2.602
  286   HG11  VAL  31          HG11      VAL  31 118.176  -1.787   4.647
  287   HG12  VAL  31          HG12      VAL  31 117.696  -3.475   4.833
  288   HG13  VAL  31          HG13      VAL  31 116.469  -2.208   4.757
  289   HG21  VAL  31          HG21      VAL  31 115.998  -1.130   2.795
  290   HG22  VAL  31          HG22      VAL  31 116.834  -1.531   1.260
  291   HG23  VAL  31          HG23      VAL  31 117.708  -0.708   2.578
  292    H    VAL  32           HN       VAL  32 119.284  -1.730   0.283
  293    HA   VAL  32           HA       VAL  32 121.360  -0.209   1.612
  294    HB   VAL  32           HB       VAL  32 122.404   0.034  -0.676
  295   HG11  VAL  32          HG11      VAL  32 123.470  -2.201  -0.602
  296   HG12  VAL  32          HG12      VAL  32 122.218  -2.731   0.521
  297   HG13  VAL  32          HG13      VAL  32 123.350  -1.465   0.993
  298   HG21  VAL  32          HG21      VAL  32 120.509  -0.591  -2.036
  299   HG22  VAL  32          HG22      VAL  32 120.419  -2.144  -1.240
  300   HG23  VAL  32          HG23      VAL  32 121.791  -1.788  -2.309
  301    H    GLY  33           HN       GLY  33 121.240   1.790   1.639
  302    HA2  GLY  33           HA2      GLY  33 120.692   3.726   0.051
  303    HA3  GLY  33           HA1      GLY  33 119.067   3.059   0.155
  304    H    GLY  34           HN       GLY  34 118.253   4.700   1.075
  305    HA2  GLY  34           HA2      GLY  34 117.587   6.163   2.632
  306    HA3  GLY  34           HA1      GLY  34 117.776   4.873   3.774
  307    H    ASP  35           HN       ASP  35 119.373   7.353   2.063
  308    HA   ASP  35           HA       ASP  35 121.241   7.640   4.341
  309    HB2  ASP  35           HB2      ASP  35 122.106   6.840   2.111
  310    HB3  ASP  35           HB1      ASP  35 121.775   8.448   1.524
  311    H    GLU  36           HN       GLU  36 118.972   9.138   2.250
  312    HA   GLU  36           HA       GLU  36 118.937  11.610   3.748
  313    HB2  GLU  36           HB2      GLU  36 119.662  12.867   1.687
  314    HB3  GLU  36           HB1      GLU  36 120.956  12.160   2.632
  315    HG2  GLU  36           HG2      GLU  36 121.122  10.377   1.172
  316    HG3  GLU  36           HG1      GLU  36 119.765  10.952   0.181
  317    HA   PRO  37           HA       PRO  37 114.992  11.971   2.252
  318    HB2  PRO  37           HB2      PRO  37 115.931  14.513   1.070
  319    HB3  PRO  37           HB1      PRO  37 114.481  14.310   2.122
  320    HG2  PRO  37           HG2      PRO  37 116.620  15.429   3.161
  321    HG3  PRO  37           HG1      PRO  37 116.021  13.986   4.016
  322    HD2  PRO  37           HD2      PRO  37 118.119  14.167   1.905
  323    HD3  PRO  37           HD1      PRO  37 118.358  13.518   3.508
  324    H    ASP  38           HN       ASP  38 117.597  12.672   0.281
  325    HA   ASP  38           HA       ASP  38 116.307  12.466  -2.225
  326    HB2  ASP  38           HB2      ASP  38 117.954  14.075  -1.999
  327    HB3  ASP  38           HB1      ASP  38 119.082  12.966  -1.245
  328    H    GLU  39           HN       GLU  39 117.930  10.233  -0.044
  329    HA   GLU  39           HA       GLU  39 117.990   8.244  -2.183
  330    HB2  GLU  39           HB2      GLU  39 120.257   8.829  -1.548
  331    HB3  GLU  39           HB1      GLU  39 119.878   8.559   0.146
  332    HG2  GLU  39           HG2      GLU  39 121.114   6.768  -0.659
  333    HG3  GLU  39           HG1      GLU  39 119.483   6.182  -0.353
  334    H    PHE  40           HN       PHE  40 116.679   6.729  -1.897
  335    HA   PHE  40           HA       PHE  40 115.182   6.165   0.601
  336    HB2  PHE  40           HB2      PHE  40 114.731   4.951  -2.141
  337    HB3  PHE  40           HB1      PHE  40 113.630   4.956  -0.785
  338    HD1  PHE  40           HD2      PHE  40 113.599   7.864  -0.107
  339    HD2  PHE  40           HD1      PHE  40 113.581   5.852  -3.863
  340    HE1  PHE  40           HE2      PHE  40 112.429   9.776  -1.130
  341    HE2  PHE  40           HE1      PHE  40 112.420   7.760  -4.888
  342    HZ   PHE  40           HZ       PHE  40 111.837   9.719  -3.528
  343    H    LEU  41           HN       LEU  41 114.653   3.740   0.927
  344    HA   LEU  41           HA       LEU  41 117.277   2.459   0.733
  345    HB2  LEU  41           HB2      LEU  41 114.963   1.578   2.492
  346    HB3  LEU  41           HB1      LEU  41 116.576   0.900   2.303
  347    HG   LEU  41           HG       LEU  41 117.418   3.089   3.172
  348   HD11  LEU  41          HD11      LEU  41 114.563   3.245   4.145
  349   HD12  LEU  41          HD12      LEU  41 115.365   4.395   3.073
  350   HD13  LEU  41          HD13      LEU  41 115.884   4.238   4.752
  351   HD21  LEU  41          HD21      LEU  41 117.215   2.255   5.465
  352   HD22  LEU  41          HD22      LEU  41 117.572   0.971   4.317
  353   HD23  LEU  41          HD23      LEU  41 115.934   1.165   4.939
  354    H    GLN  42           HN       GLN  42 117.509   0.368  -0.149
  355    HA   GLN  42           HA       GLN  42 115.154  -0.578  -1.643
  356    HB2  GLN  42           HB2      GLN  42 116.665   0.758  -2.895
  357    HB3  GLN  42           HB1      GLN  42 117.993  -0.388  -2.486
  358    HG2  GLN  42           HG2      GLN  42 116.350  -2.096  -3.625
  359    HG3  GLN  42           HG1      GLN  42 115.532  -0.681  -4.218
  360   HE21  GLN  42          HE21      GLN  42 118.386  -2.573  -4.494
  361   HE22  GLN  42          HE22      GLN  42 118.951  -1.846  -5.963
  362    H    ILE  43           HN       ILE  43 115.169  -2.812  -1.861
  363    HA   ILE  43           HA       ILE  43 116.784  -4.284   0.100
  364    HB   ILE  43           HB       ILE  43 114.869  -5.565  -1.870
  365   HG12  ILE  43          HG12      ILE  43 113.589  -3.886  -0.713
  366   HG13  ILE  43          HG11      ILE  43 113.170  -5.458  -0.042
  367   HG21  ILE  43          HG21      ILE  43 115.850  -6.493   0.850
  368   HG22  ILE  43          HG22      ILE  43 116.368  -7.122  -0.706
  369   HG23  ILE  43          HG23      ILE  43 114.703  -7.350  -0.179
  370   HD11  ILE  43          HD11      ILE  43 115.007  -3.420   1.174
  371   HD12  ILE  43          HD12      ILE  43 114.648  -5.010   1.851
  372   HD13  ILE  43          HD13      ILE  43 113.368  -3.807   1.697
  373    H    LYS  44           HN       LYS  44 118.727  -5.153  -0.330
  374    HA   LYS  44           HA       LYS  44 119.256  -5.628  -3.149
  375    HB2  LYS  44           HB2      LYS  44 121.564  -5.236  -2.911
  376    HB3  LYS  44           HB1      LYS  44 120.723  -3.958  -2.071
  377    HG2  LYS  44           HG2      LYS  44 122.582  -4.434  -0.697
  378    HG3  LYS  44           HG1      LYS  44 121.287  -5.351   0.080
  379    HD2  LYS  44           HD2      LYS  44 122.033  -7.387  -0.958
  380    HD3  LYS  44           HD1      LYS  44 123.176  -6.510  -1.964
  381    HE2  LYS  44           HE2      LYS  44 124.267  -7.702  -0.124
  382    HE3  LYS  44           HE1      LYS  44 124.507  -5.965  -0.028
  383    HZ1  LYS  44           HZ1      LYS  44 123.044  -5.797   1.754
  384    HZ2  LYS  44           HZ2      LYS  44 123.959  -7.163   2.085
  385    HZ3  LYS  44           HZ3      LYS  44 122.386  -7.336   1.527
  386    H    SER  45           HN       SER  45 118.948  -7.243  -0.192
  387    HA   SER  45           HA       SER  45 118.967  -9.731  -1.612
  388    HB2  SER  45           HB2      SER  45 120.891  -9.343   0.715
  389    HB3  SER  45           HB1      SER  45 120.562 -10.866  -0.104
  390    HG   SER  45           HG       SER  45 121.254  -9.110  -1.929
  391    H    LEU  46           HN       LEU  46 117.213 -10.811  -0.726
  392    HA   LEU  46           HA       LEU  46 116.542  -9.913   1.829
  393    HB2  LEU  46           HB2      LEU  46 114.510 -11.431   1.665
  394    HB3  LEU  46           HB1      LEU  46 114.605 -10.026   0.645
  395    HG   LEU  46           HG       LEU  46 115.082 -11.471  -1.294
  396   HD11  LEU  46          HD11      LEU  46 116.103 -13.394  -0.130
  397   HD12  LEU  46          HD12      LEU  46 114.694 -13.824  -1.134
  398   HD13  LEU  46          HD13      LEU  46 114.531 -13.716   0.624
  399   HD21  LEU  46          HD21      LEU  46 112.727 -12.222   0.325
  400   HD22  LEU  46          HD22      LEU  46 112.858 -12.268  -1.452
  401   HD23  LEU  46          HD23      LEU  46 112.956 -10.722  -0.546
  402    H    VAL  47           HN       VAL  47 116.768 -11.006   3.640
  403    HA   VAL  47           HA       VAL  47 118.691 -13.115   3.528
  404    HB   VAL  47           HB       VAL  47 117.414 -11.721   5.909
  405   HG11  VAL  47          HG11      VAL  47 119.217 -12.680   7.228
  406   HG12  VAL  47          HG12      VAL  47 119.767 -13.556   5.786
  407   HG13  VAL  47          HG13      VAL  47 118.178 -13.907   6.483
  408   HG21  VAL  47          HG21      VAL  47 120.137 -11.274   4.657
  409   HG22  VAL  47          HG22      VAL  47 119.581 -10.533   6.147
  410   HG23  VAL  47          HG23      VAL  47 118.788 -10.143   4.635
  411    H    LEU  48           HN       LEU  48 118.202 -15.164   3.684
  412    HA   LEU  48           HA       LEU  48 115.521 -16.128   3.801
  413    HB2  LEU  48           HB2      LEU  48 118.140 -17.575   4.179
  414    HB3  LEU  48           HB1      LEU  48 116.589 -18.330   3.850
  415    HG   LEU  48           HG       LEU  48 118.034 -16.468   1.963
  416   HD11  LEU  48          HD11      LEU  48 119.203 -18.580   2.193
  417   HD12  LEU  48          HD12      LEU  48 118.429 -18.451   0.611
  418   HD13  LEU  48          HD13      LEU  48 117.701 -19.448   1.871
  419   HD21  LEU  48          HD21      LEU  48 115.545 -18.128   1.585
  420   HD22  LEU  48          HD22      LEU  48 116.359 -17.202   0.325
  421   HD23  LEU  48          HD23      LEU  48 115.615 -16.369   1.691
  422    H    ASP  49           HN       ASP  49 114.337 -16.890   5.320
  423    HA   ASP  49           HA       ASP  49 113.488 -17.221   7.368
  424    HB2  ASP  49           HB2      ASP  49 115.519 -18.346   8.038
  425    HB3  ASP  49           HB1      ASP  49 116.321 -16.831   8.311
  426    H    GLY  50           HN       GLY  50 114.333 -14.665   5.974
  427    HA2  GLY  50           HA2      GLY  50 113.742 -12.590   7.951
  428    HA3  GLY  50           HA1      GLY  50 114.036 -12.520   6.187
  429    HA   PRO  51           HA       PRO  51 109.538 -13.039   7.180
  430    HB2  PRO  51           HB2      PRO  51 108.482 -10.491   7.676
  431    HB3  PRO  51           HB1      PRO  51 109.034 -11.621   8.869
  432    HG2  PRO  51           HG2      PRO  51 110.285  -9.162   8.065
  433    HG3  PRO  51           HG1      PRO  51 110.631 -10.192   9.458
  434    HD2  PRO  51           HD2      PRO  51 111.959 -10.009   6.879
  435    HD3  PRO  51           HD1      PRO  51 112.555 -10.751   8.352
  436    H    ALA  52           HN       ALA  52 111.151 -10.669   5.304
  437    HA   ALA  52           HA       ALA  52 109.312 -10.327   3.188
  438    HB1  ALA  52           HB1      ALA  52 111.329  -8.949   3.446
  439    HB2  ALA  52           HB2      ALA  52 111.308  -9.732   1.867
  440    HB3  ALA  52           HB3      ALA  52 112.334 -10.365   3.152
  441    H    ALA  53           HN       ALA  53 111.907 -12.639   3.788
  442    HA   ALA  53           HA       ALA  53 111.877 -14.119   1.388
  443    HB1  ALA  53           HB1      ALA  53 113.122 -15.780   2.693
  444    HB2  ALA  53           HB2      ALA  53 112.607 -14.997   4.179
  445    HB3  ALA  53           HB3      ALA  53 113.707 -14.151   3.082
  446    H    LEU  54           HN       LEU  54 110.455 -14.498   4.445
  447    HA   LEU  54           HA       LEU  54 109.348 -16.987   4.102
  448    HB2  LEU  54           HB2      LEU  54 108.930 -14.868   6.024
  449    HB3  LEU  54           HB1      LEU  54 108.404 -16.538   6.210
  450    HG   LEU  54           HG       LEU  54 111.293 -15.651   5.831
  451   HD11  LEU  54          HD11      LEU  54 109.695 -16.764   7.852
  452   HD12  LEU  54          HD12      LEU  54 110.319 -15.064   7.561
  453   HD13  LEU  54          HD13      LEU  54 111.491 -16.421   7.929
  454   HD21  LEU  54          HD21      LEU  54 110.088 -18.407   6.233
  455   HD22  LEU  54          HD22      LEU  54 111.795 -18.010   6.315
  456   HD23  LEU  54          HD23      LEU  54 110.947 -17.866   4.785
  457    H    ASP  55           HN       ASP  55 107.962 -13.705   4.201
  458    HA   ASP  55           HA       ASP  55 105.254 -14.491   3.869
  459    HB2  ASP  55           HB2      ASP  55 106.063 -12.281   4.817
  460    HB3  ASP  55           HB1      ASP  55 106.494 -11.815   3.180
  461    H    GLY  56           HN       GLY  56 107.911 -13.979   1.878
  462    HA2  GLY  56           HA2      GLY  56 108.310 -14.434  -0.376
  463    HA3  GLY  56           HA1      GLY  56 106.759 -15.276  -0.321
  464    H    LYS  57           HN       LYS  57 106.181 -12.164   0.474
  465    HA   LYS  57           HA       LYS  57 105.418 -11.615  -2.292
  466    HB2  LYS  57           HB2      LYS  57 103.546 -12.063  -0.872
  467    HB3  LYS  57           HB1      LYS  57 104.135 -10.943   0.333
  468    HG2  LYS  57           HG2      LYS  57 103.537  -9.075  -1.100
  469    HG3  LYS  57           HG1      LYS  57 103.228 -10.157  -2.450
  470    HD2  LYS  57           HD2      LYS  57 101.128  -9.381  -1.531
  471    HD3  LYS  57           HD1      LYS  57 101.308 -11.101  -1.230
  472    HE2  LYS  57           HE2      LYS  57 101.992  -9.024   0.844
  473    HE3  LYS  57           HE1      LYS  57 100.354  -9.622   0.638
  474    HZ1  LYS  57           HZ1      LYS  57 101.289 -11.904   1.091
  475    HZ2  LYS  57           HZ2      LYS  57 101.328 -10.813   2.349
  476    HZ3  LYS  57           HZ3      LYS  57 102.752 -11.161   1.569
  477    H    MET  58           HN       MET  58 107.851 -11.039  -0.732
  478    HA   MET  58           HA       MET  58 108.269  -8.366  -1.675
  479    HB2  MET  58           HB2      MET  58 107.717  -7.963   0.663
  480    HB3  MET  58           HB1      MET  58 108.748  -9.268   1.193
  481    HG2  MET  58           HG2      MET  58 110.701  -8.017   0.425
  482    HG3  MET  58           HG1      MET  58 109.647  -6.687  -0.054
  483    HE1  MET  58           HE1      MET  58 111.184  -5.113   1.486
  484    HE2  MET  58           HE2      MET  58 112.145  -6.496   2.007
  485    HE3  MET  58           HE3      MET  58 111.462  -5.394   3.203
  486    H    GLU  59           HN       GLU  59 110.307  -8.269  -2.495
  487    HA   GLU  59           HA       GLU  59 112.069 -10.596  -2.223
  488    HB2  GLU  59           HB2      GLU  59 110.928  -9.594  -4.843
  489    HB3  GLU  59           HB1      GLU  59 112.235 -10.752  -4.701
  490    HG2  GLU  59           HG2      GLU  59 110.674 -12.295  -3.542
  491    HG3  GLU  59           HG1      GLU  59 109.379 -11.135  -3.814
  492    H    THR  60           HN       THR  60 114.182 -10.159  -3.141
  493    HA   THR  60           HA       THR  60 115.310  -7.692  -2.691
  494    HB   THR  60           HB       THR  60 116.109  -9.819  -4.647
  495    HG1  THR  60           HG1      THR  60 116.958 -10.904  -2.886
  496   HG21  THR  60          HG21      THR  60 117.644  -7.997  -2.896
  497   HG22  THR  60          HG22      THR  60 117.382  -7.737  -4.635
  498   HG23  THR  60          HG23      THR  60 118.332  -9.127  -4.059
  499    H    GLY  61           HN       GLY  61 115.072  -5.866  -3.797
  500    HA2  GLY  61           HA2      GLY  61 115.205  -4.876  -6.092
  501    HA3  GLY  61           HA1      GLY  61 113.947  -6.032  -6.515
  502    H    ASP  62           HN       ASP  62 112.770  -5.583  -3.705
  503    HA   ASP  62           HA       ASP  62 110.965  -3.476  -4.337
  504    HB2  ASP  62           HB2      ASP  62 111.574  -4.833  -1.693
  505    HB3  ASP  62           HB1      ASP  62 110.437  -3.509  -1.843
  506    H    VAL  63           HN       VAL  63 111.084  -1.343  -3.918
  507    HA   VAL  63           HA       VAL  63 113.417  -0.536  -2.411
  508    HB   VAL  63           HB       VAL  63 113.417   1.562  -3.460
  509   HG11  VAL  63          HG11      VAL  63 113.234   1.286  -5.828
  510   HG12  VAL  63          HG12      VAL  63 112.234  -0.139  -5.593
  511   HG13  VAL  63          HG13      VAL  63 113.937  -0.186  -5.127
  512   HG21  VAL  63          HG21      VAL  63 111.599   2.553  -4.696
  513   HG22  VAL  63          HG22      VAL  63 111.140   2.202  -3.016
  514   HG23  VAL  63          HG23      VAL  63 110.584   1.152  -4.332
  515    H    ILE  64           HN       ILE  64 113.215   0.418  -0.515
  516    HA   ILE  64           HA       ILE  64 110.676   0.211   0.743
  517    HB   ILE  64           HB       ILE  64 113.400   0.868   1.825
  518   HG12  ILE  64          HG12      ILE  64 113.107  -1.466   1.197
  519   HG13  ILE  64          HG11      ILE  64 113.257  -1.319   2.943
  520   HG21  ILE  64          HG21      ILE  64 112.451   0.709   4.113
  521   HG22  ILE  64          HG22      ILE  64 110.839   0.584   3.410
  522   HG23  ILE  64          HG23      ILE  64 111.778   2.062   3.201
  523   HD11  ILE  64          HD11      ILE  64 110.713  -1.770   1.386
  524   HD12  ILE  64          HD12      ILE  64 110.803  -1.513   3.125
  525   HD13  ILE  64          HD13      ILE  64 111.554  -2.937   2.409
  526    H    VAL  65           HN       VAL  65 109.355   1.751   0.618
  527    HA   VAL  65           HA       VAL  65 110.027   4.542   0.184
  528    HB   VAL  65           HB       VAL  65 107.361   3.060   0.199
  529   HG11  VAL  65          HG11      VAL  65 107.026   5.447   0.609
  530   HG12  VAL  65          HG12      VAL  65 106.420   4.966  -0.982
  531   HG13  VAL  65          HG13      VAL  65 107.944   5.822  -0.856
  532   HG21  VAL  65          HG21      VAL  65 108.780   2.243  -1.587
  533   HG22  VAL  65          HG22      VAL  65 109.051   3.890  -2.152
  534   HG23  VAL  65          HG23      VAL  65 107.439   3.181  -2.244
  535    H    SER  66           HN       SER  66 107.865   2.635   2.355
  536    HA   SER  66           HA       SER  66 108.770   4.154   4.592
  537    HB2  SER  66           HB2      SER  66 106.426   5.004   5.173
  538    HB3  SER  66           HB1      SER  66 107.262   5.840   3.867
  539    HG   SER  66           HG       SER  66 105.029   4.222   3.848
  540    H    VAL  67           HN       VAL  67 107.346   3.535   6.643
  541    HA   VAL  67           HA       VAL  67 106.264   0.871   6.482
  542    HB   VAL  67           HB       VAL  67 108.624   0.294   6.496
  543   HG11  VAL  67          HG11      VAL  67 110.105   0.903   8.344
  544   HG12  VAL  67          HG12      VAL  67 108.845   1.966   8.980
  545   HG13  VAL  67          HG13      VAL  67 109.569   2.298   7.405
  546   HG21  VAL  67          HG21      VAL  67 108.714  -1.064   8.520
  547   HG22  VAL  67          HG22      VAL  67 107.115  -1.114   7.774
  548   HG23  VAL  67          HG23      VAL  67 107.391  -0.122   9.203
  549    H    ASN  68           HN       ASN  68 104.645   0.825   7.610
  550    HA   ASN  68           HA       ASN  68 103.103   1.087   9.275
  551    HB2  ASN  68           HB2      ASN  68 104.820  -0.332  10.128
  552    HB3  ASN  68           HB1      ASN  68 105.609   1.007  10.946
  553   HD21  ASN  68          HD21      ASN  68 102.969  -1.274  10.999
  554   HD22  ASN  68          HD22      ASN  68 102.459  -0.934  12.586
  555    H    ASP  69           HN       ASP  69 103.240   3.220   8.193
  556    HA   ASP  69           HA       ASP  69 102.581   5.422   8.272
  557    HB2  ASP  69           HB2      ASP  69 101.266   5.030  10.260
  558    HB3  ASP  69           HB1      ASP  69 102.696   5.065  11.281
  559    H    THR  70           HN       THR  70 105.435   4.537   9.937
  560    HA   THR  70           HA       THR  70 106.610   7.096  10.234
  561    HB   THR  70           HB       THR  70 108.072   4.460   9.914
  562    HG1  THR  70           HG1      THR  70 106.858   3.938  11.604
  563   HG21  THR  70          HG21      THR  70 108.705   6.978  11.476
  564   HG22  THR  70          HG22      THR  70 109.472   6.494   9.965
  565   HG23  THR  70          HG23      THR  70 109.703   5.527  11.420
  566    H    CYS  71           HN       CYS  71 107.520   8.378   8.872
  567    HA   CYS  71           HA       CYS  71 107.585   7.767   6.086
  568    HB2  CYS  71           HB2      CYS  71 106.871   9.945   7.079
  569    HB3  CYS  71           HB1      CYS  71 108.534  10.228   7.544
  570    HG   CYS  71           HG       CYS  71 107.100  10.828   4.628
  571    H    VAL  72           HN       VAL  72 109.104   6.059   6.297
  572    HA   VAL  72           HA       VAL  72 111.850   6.736   6.820
  573    HB   VAL  72           HB       VAL  72 110.531   4.121   5.932
  574   HG11  VAL  72          HG11      VAL  72 112.619   2.982   6.451
  575   HG12  VAL  72          HG12      VAL  72 113.389   4.520   6.831
  576   HG13  VAL  72          HG13      VAL  72 112.891   4.170   5.174
  577   HG21  VAL  72          HG21      VAL  72 111.635   5.068   8.556
  578   HG22  VAL  72          HG22      VAL  72 111.064   3.438   8.238
  579   HG23  VAL  72          HG23      VAL  72 109.939   4.799   8.151
  580    H    LEU  73           HN       LEU  73 109.921   7.483   4.456
  581    HA   LEU  73           HA       LEU  73 111.254   7.001   2.016
  582    HB2  LEU  73           HB2      LEU  73 108.883   7.888   2.632
  583    HB3  LEU  73           HB1      LEU  73 109.694   9.420   2.831
  584    HG   LEU  73           HG       LEU  73 110.147   9.626   0.551
  585   HD11  LEU  73          HD11      LEU  73 109.218   6.762   0.372
  586   HD12  LEU  73          HD12      LEU  73 110.849   7.356   0.023
  587   HD13  LEU  73          HD13      LEU  73 109.499   7.800  -1.021
  588   HD21  LEU  73          HD21      LEU  73 107.899  10.152   1.259
  589   HD22  LEU  73          HD22      LEU  73 107.424   8.468   1.077
  590   HD23  LEU  73          HD23      LEU  73 107.848   9.408  -0.345
  591    H    GLY  74           HN       GLY  74 113.295   7.529   1.815
  592    HA2  GLY  74           HA2      GLY  74 115.269   8.684   1.911
  593    HA3  GLY  74           HA1      GLY  74 114.265  10.124   2.001
  594    H    HIS  75           HN       HIS  75 114.485   7.459   4.281
  595    HA   HIS  75           HA       HIS  75 114.818   9.250   6.512
  596    HB2  HIS  75           HB2      HIS  75 113.912   6.554   6.172
  597    HB3  HIS  75           HB1      HIS  75 115.472   6.485   6.963
  598    HD1  HIS  75           HD1      HIS  75 112.247   8.493   7.649
  599    HD2  HIS  75           HD2      HIS  75 115.295   6.380   9.488
  600    HE1  HIS  75           HE1      HIS  75 111.676   8.476  10.063
  601    H    THR  76           HN       THR  76 116.770   9.397   7.684
  602    HA   THR  76           HA       THR  76 119.182   9.091   6.188
  603    HB   THR  76           HB       THR  76 118.684   9.674   9.098
  604    HG1  THR  76           HG1      THR  76 119.025  11.557   6.975
  605   HG21  THR  76          HG21      THR  76 120.803  10.894   9.038
  606   HG22  THR  76          HG22      THR  76 121.054  10.407   7.353
  607   HG23  THR  76          HG23      THR  76 121.022   9.195   8.645
  608    H    HIS  77           HN       HIS  77 120.793   7.376   6.480
  609    HA   HIS  77           HA       HIS  77 120.078   4.899   7.176
  610    HB2  HIS  77           HB2      HIS  77 122.145   5.214   6.025
  611    HB3  HIS  77           HB1      HIS  77 122.816   6.134   7.366
  612    HD1  HIS  77           HD1      HIS  77 121.786   2.471   6.602
  613    HD2  HIS  77           HD2      HIS  77 124.249   4.667   9.152
  614    HE1  HIS  77           HE1      HIS  77 123.160   0.810   7.849
  615    H    ALA  78           HN       ALA  78 121.584   7.138   9.314
  616    HA   ALA  78           HA       ALA  78 121.891   5.433  11.538
  617    HB1  ALA  78           HB1      ALA  78 122.209   7.461  12.858
  618    HB2  ALA  78           HB2      ALA  78 121.527   8.421  11.539
  619    HB3  ALA  78           HB3      ALA  78 123.051   7.567  11.306
  620    H    GLN  79           HN       GLN  79 119.196   7.275  10.391
  621    HA   GLN  79           HA       GLN  79 117.730   7.058  12.802
  622    HB2  GLN  79           HB2      GLN  79 117.019   7.967  10.056
  623    HB3  GLN  79           HB1      GLN  79 115.907   8.101  11.393
  624    HG2  GLN  79           HG2      GLN  79 118.600   9.426  11.066
  625    HG3  GLN  79           HG1      GLN  79 117.027  10.227  11.031
  626   HE21  GLN  79          HE21      GLN  79 119.354  10.704  12.635
  627   HE22  GLN  79          HE22      GLN  79 118.876  10.555  14.278
  628    H    VAL  80           HN       VAL  80 117.540   5.719   9.542
  629    HA   VAL  80           HA       VAL  80 115.310   4.089  10.045
  630    HB   VAL  80           HB       VAL  80 115.862   4.675   7.725
  631   HG11  VAL  80          HG11      VAL  80 118.287   4.660   7.967
  632   HG12  VAL  80          HG12      VAL  80 117.725   3.821   6.533
  633   HG13  VAL  80          HG13      VAL  80 118.270   2.895   7.945
  634   HG21  VAL  80          HG21      VAL  80 115.561   2.489   6.696
  635   HG22  VAL  80          HG22      VAL  80 114.571   2.646   8.146
  636   HG23  VAL  80          HG23      VAL  80 116.058   1.705   8.195
  637    H    VAL  81           HN       VAL  81 118.768   3.410  10.217
  638    HA   VAL  81           HA       VAL  81 118.442   0.679  10.843
  639    HB   VAL  81           HB       VAL  81 120.634   1.727  10.071
  640   HG11  VAL  81          HG11      VAL  81 122.179   2.612  11.715
  641   HG12  VAL  81          HG12      VAL  81 120.911   2.553  12.941
  642   HG13  VAL  81          HG13      VAL  81 120.742   3.621  11.547
  643   HG21  VAL  81          HG21      VAL  81 122.084   0.227  11.362
  644   HG22  VAL  81          HG22      VAL  81 120.588  -0.562  10.860
  645   HG23  VAL  81          HG23      VAL  81 120.780  -0.012  12.523
  646    H    LYS  82           HN       LYS  82 118.501   3.544  12.819
  647    HA   LYS  82           HA       LYS  82 118.575   2.355  15.307
  648    HB2  LYS  82           HB2      LYS  82 118.872   4.704  14.946
  649    HB3  LYS  82           HB1      LYS  82 117.260   4.865  14.307
  650    HG2  LYS  82           HG2      LYS  82 117.696   4.040  17.172
  651    HG3  LYS  82           HG1      LYS  82 117.814   5.732  16.711
  652    HD2  LYS  82           HD2      LYS  82 115.396   3.955  16.306
  653    HD3  LYS  82           HD1      LYS  82 115.575   5.161  17.582
  654    HE2  LYS  82           HE2      LYS  82 115.772   6.916  15.830
  655    HE3  LYS  82           HE1      LYS  82 115.479   5.688  14.604
  656    HZ1  LYS  82           HZ1      LYS  82 113.452   6.801  15.057
  657    HZ2  LYS  82           HZ2      LYS  82 113.597   6.598  16.703
  658    HZ3  LYS  82           HZ3      LYS  82 113.298   5.261  15.733
  659    H    ILE  83           HN       ILE  83 115.781   2.829  13.145
  660    HA   ILE  83           HA       ILE  83 113.848   2.000  15.136
  661    HB   ILE  83           HB       ILE  83 113.550   2.120  12.121
  662   HG12  ILE  83          HG12      ILE  83 112.725   4.140  14.213
  663   HG13  ILE  83          HG11      ILE  83 114.093   4.315  13.118
  664   HG21  ILE  83          HG21      ILE  83 111.125   2.158  12.558
  665   HG22  ILE  83          HG22      ILE  83 111.440   1.947  14.280
  666   HG23  ILE  83          HG23      ILE  83 111.874   0.670  13.142
  667   HD11  ILE  83          HD11      ILE  83 112.585   4.332  11.223
  668   HD12  ILE  83          HD12      ILE  83 112.130   5.586  12.387
  669   HD13  ILE  83          HD13      ILE  83 111.220   4.078  12.305
  670    H    PHE  84           HN       PHE  84 115.305   0.644  12.320
  671    HA   PHE  84           HA       PHE  84 113.983  -1.810  12.314
  672    HB2  PHE  84           HB2      PHE  84 116.250  -0.544  10.914
  673    HB3  PHE  84           HB1      PHE  84 115.992  -2.249  10.667
  674    HD1  PHE  84           HD2      PHE  84 114.072   0.959  10.669
  675    HD2  PHE  84           HD1      PHE  84 114.602  -2.842   8.877
  676    HE1  PHE  84           HE2      PHE  84 112.351   1.510   9.000
  677    HE2  PHE  84           HE1      PHE  84 112.899  -2.301   7.207
  678    HZ   PHE  84           HZ       PHE  84 111.763  -0.141   7.265
  679    H    GLN  85           HN       GLN  85 116.987  -0.802  13.760
  680    HA   GLN  85           HA       GLN  85 117.671  -3.489  14.479
  681    HB2  GLN  85           HB2      GLN  85 118.974  -0.939  14.391
  682    HB3  GLN  85           HB1      GLN  85 119.335  -1.774  15.908
  683    HG2  GLN  85           HG2      GLN  85 120.989  -2.122  14.133
  684    HG3  GLN  85           HG1      GLN  85 120.244  -3.627  14.657
  685   HE21  GLN  85          HE21      GLN  85 120.892  -4.604  12.760
  686   HE22  GLN  85          HE22      GLN  85 120.141  -4.302  11.238
  687    H    SER  86           HN       SER  86 115.886  -0.892  16.017
  688    HA   SER  86           HA       SER  86 116.391  -2.035  18.612
  689    HB2  SER  86           HB2      SER  86 114.925  -0.219  19.481
  690    HB3  SER  86           HB1      SER  86 116.312   0.349  18.555
  691    HG   SER  86           HG       SER  86 115.049   0.961  16.963
  692    H    ILE  87           HN       ILE  87 113.895  -2.383  16.249
  693    HA   ILE  87           HA       ILE  87 111.756  -2.983  17.689
  694    HB   ILE  87           HB       ILE  87 111.547  -4.912  15.821
  695   HG12  ILE  87          HG12      ILE  87 113.269  -2.762  14.639
  696   HG13  ILE  87          HG11      ILE  87 113.668  -4.476  14.833
  697   HG21  ILE  87          HG21      ILE  87 110.676  -2.057  15.605
  698   HG22  ILE  87          HG22      ILE  87 109.791  -3.524  16.140
  699   HG23  ILE  87          HG23      ILE  87 110.239  -3.361  14.481
  700   HD11  ILE  87          HD11      ILE  87 111.761  -4.957  13.406
  701   HD12  ILE  87          HD12      ILE  87 113.047  -4.062  12.587
  702   HD13  ILE  87          HD13      ILE  87 111.565  -3.243  13.162
  703    HA   PRO  88           HA       PRO  88 112.410  -7.100  19.548
  704    HB2  PRO  88           HB2      PRO  88 109.888  -7.212  20.509
  705    HB3  PRO  88           HB1      PRO  88 111.086  -6.088  21.170
  706    HG2  PRO  88           HG2      PRO  88 108.651  -5.486  19.725
  707    HG3  PRO  88           HG1      PRO  88 109.807  -4.347  20.429
  708    HD2  PRO  88           HD2      PRO  88 109.643  -5.364  17.617
  709    HD3  PRO  88           HD1      PRO  88 110.264  -3.841  18.126
  710    H    ILE  89           HN       ILE  89 111.752  -9.190  19.462
  711    HA   ILE  89           HA       ILE  89 110.747 -10.222  17.033
  712    HB   ILE  89           HB       ILE  89 110.923 -11.659  19.692
  713   HG12  ILE  89          HG12      ILE  89 113.043 -11.238  17.599
  714   HG13  ILE  89          HG11      ILE  89 113.030 -10.510  19.191
  715   HG21  ILE  89          HG21      ILE  89 111.271 -13.648  18.294
  716   HG22  ILE  89          HG22      ILE  89 111.085 -12.644  16.851
  717   HG23  ILE  89          HG23      ILE  89 109.722 -12.867  17.951
  718   HD11  ILE  89          HD11      ILE  89 114.569 -12.282  19.076
  719   HD12  ILE  89          HD12      ILE  89 113.334 -13.398  18.507
  720   HD13  ILE  89          HD13      ILE  89 113.251 -12.730  20.168
  721    H    GLY  90           HN       GLY  90 108.661 -10.640  16.444
  722    HA2  GLY  90           HA2      GLY  90 106.545 -11.596  16.918
  723    HA3  GLY  90           HA1      GLY  90 106.664 -10.969  18.554
  724    H    ALA  91           HN       ALA  91 107.641  -8.715  16.116
  725    HA   ALA  91           HA       ALA  91 105.109  -7.337  16.751
  726    HB1  ALA  91           HB1      ALA  91 107.734  -6.085  15.914
  727    HB2  ALA  91           HB2      ALA  91 107.140  -6.221  17.565
  728    HB3  ALA  91           HB3      ALA  91 106.265  -5.238  16.394
  729    H    SER  92           HN       SER  92 104.655  -5.522  14.912
  730    HA   SER  92           HA       SER  92 104.761  -6.829  12.236
  731    HB2  SER  92           HB2      SER  92 102.680  -7.453  13.249
  732    HB3  SER  92           HB1      SER  92 102.354  -5.780  13.748
  733    HG   SER  92           HG       SER  92 101.752  -5.340  11.777
  734    H    VAL  93           HN       VAL  93 104.772  -5.537  10.561
  735    HA   VAL  93           HA       VAL  93 104.166  -2.743  10.780
  736    HB   VAL  93           HB       VAL  93 106.154  -2.090   9.396
  737   HG11  VAL  93          HG11      VAL  93 106.740  -2.769  12.263
  738   HG12  VAL  93          HG12      VAL  93 105.933  -1.330  11.624
  739   HG13  VAL  93          HG13      VAL  93 107.618  -1.626  11.221
  740   HG21  VAL  93          HG21      VAL  93 106.980  -4.194   8.757
  741   HG22  VAL  93          HG22      VAL  93 107.217  -4.694  10.416
  742   HG23  VAL  93          HG23      VAL  93 108.221  -3.402   9.727
  743    H    ASP  94           HN       ASP  94 103.755  -1.737   8.989
  744    HA   ASP  94           HA       ASP  94 102.952  -3.410   6.768
  745    HB2  ASP  94           HB2      ASP  94 102.294  -0.603   7.643
  746    HB3  ASP  94           HB1      ASP  94 101.675  -1.340   6.185
  747    H    LEU  95           HN       LEU  95 104.517  -3.442   5.279
  748    HA   LEU  95           HA       LEU  95 106.347  -1.198   4.948
  749    HB2  LEU  95           HB2      LEU  95 106.281  -3.938   3.687
  750    HB3  LEU  95           HB1      LEU  95 107.370  -2.684   3.154
  751    HG   LEU  95           HG       LEU  95 108.546  -4.247   4.522
  752   HD11  LEU  95          HD11      LEU  95 109.241  -1.954   4.731
  753   HD12  LEU  95          HD12      LEU  95 109.411  -2.834   6.265
  754   HD13  LEU  95          HD13      LEU  95 108.061  -1.730   6.032
  755   HD21  LEU  95          HD21      LEU  95 108.028  -4.564   6.855
  756   HD22  LEU  95          HD22      LEU  95 106.751  -5.178   5.782
  757   HD23  LEU  95          HD23      LEU  95 106.526  -3.657   6.654
  758    H    GLU  96           HN       GLU  96 106.052   0.276   3.542
  759    HA   GLU  96           HA       GLU  96 104.257  -0.152   1.277
  760    HB2  GLU  96           HB2      GLU  96 105.406   2.385   2.478
  761    HB3  GLU  96           HB1      GLU  96 104.218   2.304   1.182
  762    HG2  GLU  96           HG2      GLU  96 102.584   1.370   2.644
  763    HG3  GLU  96           HG1      GLU  96 103.770   1.208   3.935
  764    H    LEU  97           HN       LEU  97 105.458  -0.891  -0.366
  765    HA   LEU  97           HA       LEU  97 107.988   0.372  -0.859
  766    HB2  LEU  97           HB2      LEU  97 109.263  -1.677  -0.917
  767    HB3  LEU  97           HB1      LEU  97 108.548  -1.450   0.649
  768    HG   LEU  97           HG       LEU  97 107.884  -3.559  -1.419
  769   HD11  LEU  97          HD11      LEU  97 108.809  -3.650   1.420
  770   HD12  LEU  97          HD12      LEU  97 109.788  -3.944  -0.003
  771   HD13  LEU  97          HD13      LEU  97 108.477  -5.056   0.411
  772   HD21  LEU  97          HD21      LEU  97 106.170  -4.407   0.041
  773   HD22  LEU  97          HD22      LEU  97 105.756  -2.743  -0.398
  774   HD23  LEU  97          HD23      LEU  97 106.436  -3.098   1.190
  775    H    CYS  98           HN       CYS  98 108.905  -0.201  -2.949
  776    HA   CYS  98           HA       CYS  98 106.834  -1.033  -4.839
  777    HB2  CYS  98           HB2      CYS  98 107.007   1.521  -4.543
  778    HB3  CYS  98           HB1      CYS  98 108.565   1.377  -5.342
  779    HG   CYS  98           HG       CYS  98 106.179   2.225  -6.897
  780    H    ARG  99           HN       ARG  99 107.489  -2.453  -6.102
  781    HA   ARG  99           HA       ARG  99 110.363  -2.965  -6.403
  782    HB2  ARG  99           HB2      ARG  99 109.342  -4.591  -4.971
  783    HB3  ARG  99           HB1      ARG  99 108.000  -4.781  -6.065
  784    HG2  ARG  99           HG2      ARG  99 109.220  -6.077  -7.527
  785    HG3  ARG  99           HG1      ARG  99 110.772  -5.560  -6.848
  786    HD2  ARG  99           HD2      ARG  99 109.917  -7.916  -6.194
  787    HD3  ARG  99           HD1      ARG  99 110.493  -6.832  -4.924
  788    HE   ARG  99           HE       ARG  99 108.411  -6.496  -4.161
  789   HH11  ARG  99          HH11      ARG  99 108.286  -8.671  -6.931
  790   HH12  ARG  99          HH12      ARG  99 106.831  -9.436  -6.512
  791   HH21  ARG  99          HH21      ARG  99 106.385  -7.558  -3.524
  792   HH22  ARG  99          HH22      ARG  99 105.680  -8.740  -4.531
  793    H    GLY 100           HN       GLY 100 110.922  -4.079  -8.433
  794    HA2  GLY 100           HA2      GLY 100 109.740  -4.588 -10.683
  795    HA3  GLY 100           HA1      GLY 100 109.378  -2.866 -10.603
  796    H    TYR 101           HN       TYR 101 111.932  -2.691  -9.049
  797    HA   TYR 101           HA       TYR 101 113.693  -2.168 -11.283
  798    HB2  TYR 101           HB2      TYR 101 113.949  -1.628  -8.316
  799    HB3  TYR 101           HB1      TYR 101 115.063  -1.028  -9.528
  800    HD1  TYR 101           HD1      TYR 101 114.278   0.684 -11.164
  801    HD2  TYR 101           HD2      TYR 101 111.884  -0.573  -7.883
  802    HE1  TYR 101           HE1      TYR 101 112.864   2.669 -11.436
  803    HE2  TYR 101           HE2      TYR 101 110.468   1.407  -8.147
  804    HH   TYR 101           HH       TYR 101 110.714   3.659  -9.087
  805    HA   PRO 102           HA       PRO 102 115.473  -6.143 -10.154
  806    HB2  PRO 102           HB2      PRO 102 117.054  -6.409 -12.338
  807    HB3  PRO 102           HB1      PRO 102 115.332  -6.800 -12.350
  808    HG2  PRO 102           HG2      PRO 102 116.739  -4.423 -13.448
  809    HG3  PRO 102           HG1      PRO 102 115.280  -5.250 -14.022
  810    HD2  PRO 102           HD2      PRO 102 115.322  -2.879 -12.571
  811    HD3  PRO 102           HD1      PRO 102 113.918  -3.949 -12.752
  812    H    LEU 103           HN       LEU 103 117.315  -6.642  -9.155
  813    HA   LEU 103           HA       LEU 103 119.113  -4.568  -8.405
  814    HB2  LEU 103           HB2      LEU 103 118.282  -6.792  -7.214
  815    HB3  LEU 103           HB1      LEU 103 119.676  -7.487  -8.003
  816    HG   LEU 103           HG       LEU 103 120.223  -6.987  -5.736
  817   HD11  LEU 103          HD11      LEU 103 122.098  -5.454  -5.930
  818   HD12  LEU 103          HD12      LEU 103 121.513  -4.946  -7.516
  819   HD13  LEU 103          HD13      LEU 103 122.038  -6.610  -7.261
  820   HD21  LEU 103          HD21      LEU 103 120.102  -4.707  -4.825
  821   HD22  LEU 103          HD22      LEU 103 118.528  -5.389  -5.224
  822   HD23  LEU 103          HD23      LEU 103 119.261  -4.190  -6.288
  823    HA   PRO 104           HA       PRO 104 121.645  -5.695 -12.023
  824    HB2  PRO 104           HB2      PRO 104 122.630  -3.114 -12.371
  825    HB3  PRO 104           HB1      PRO 104 121.157  -3.760 -13.097
  826    HG2  PRO 104           HG2      PRO 104 121.297  -1.697 -11.150
  827    HG3  PRO 104           HG1      PRO 104 119.844  -2.548 -11.714
  828    HD2  PRO 104           HD2      PRO 104 121.484  -3.027  -9.271
  829    HD3  PRO 104           HD1      PRO 104 119.725  -3.166  -9.525
  830    H    PHE 105           HN       PHE 105 123.384  -3.024 -10.504
  831    HA   PHE 105           HA       PHE 105 125.819  -4.588 -10.442
  832    HB2  PHE 105           HB2      PHE 105 125.235  -1.693  -9.748
  833    HB3  PHE 105           HB1      PHE 105 126.838  -2.409  -9.712
  834    HD1  PHE 105           HD1      PHE 105 124.075  -1.327 -11.885
  835    HD2  PHE 105           HD2      PHE 105 128.070  -2.757 -11.716
  836    HE1  PHE 105           HE1      PHE 105 124.387  -0.721 -14.244
  837    HE2  PHE 105           HE2      PHE 105 128.386  -2.154 -14.079
  838    HZ   PHE 105           HZ       PHE 105 126.544  -1.135 -15.345
  839    H    ASP 106           HN       ASP 106 127.053  -4.819  -8.420
  840    HA   ASP 106           HA       ASP 106 125.243  -5.632  -6.369
  841    HB2  ASP 106           HB2      ASP 106 128.171  -5.456  -6.134
  842    HB3  ASP 106           HB1      ASP 106 127.119  -6.515  -5.245
  843    HA   PRO 107           HA       PRO 107 126.214  -1.842  -4.170
  844    HB2  PRO 107           HB2      PRO 107 123.892  -2.327  -2.545
  845    HB3  PRO 107           HB1      PRO 107 123.985  -1.250  -3.949
  846    HG2  PRO 107           HG2      PRO 107 122.420  -3.526  -3.986
  847    HG3  PRO 107           HG1      PRO 107 123.285  -2.892  -5.424
  848    HD2  PRO 107           HD2      PRO 107 124.309  -4.882  -3.473
  849    HD3  PRO 107           HD1      PRO 107 124.022  -5.199  -5.158
  850    H    ASP 108           HN       ASP 108 126.591  -4.848  -3.592
  851    HA   ASP 108           HA       ASP 108 126.736  -4.920  -0.787
  852    HB2  ASP 108           HB2      ASP 108 125.891  -6.884  -1.951
  853    HB3  ASP 108           HB1      ASP 108 127.403  -7.049  -2.833
  854    H    ASP 109           HN       ASP 109 128.602  -4.187  -3.485
  855    HA   ASP 109           HA       ASP 109 131.239  -4.877  -2.400
  856    HB2  ASP 109           HB2      ASP 109 130.582  -5.511  -4.836
  857    HB3  ASP 109           HB1      ASP 109 130.508  -3.805  -5.109
  858    HA   PRO 110           HA       PRO 110 131.347  -0.391  -1.288
  859    HB2  PRO 110           HB2      PRO 110 133.850  -1.415  -0.151
  860    HB3  PRO 110           HB1      PRO 110 132.651  -0.387   0.608
  861    HG2  PRO 110           HG2      PRO 110 132.804  -2.922   1.319
  862    HG3  PRO 110           HG1      PRO 110 131.193  -2.269   0.942
  863    HD2  PRO 110           HD2      PRO 110 133.006  -3.903  -0.820
  864    HD3  PRO 110           HD1      PRO 110 131.279  -4.130  -0.468
  865    H    ASN 111           HN       ASN 111 133.674   0.786  -0.882
  866    HA   ASN 111           HA       ASN 111 135.451   1.700  -1.531
  867    HB2  ASN 111           HB2      ASN 111 135.807  -0.584  -3.450
  868    HB3  ASN 111           HB1      ASN 111 136.864   0.829  -3.341
  869   HD21  ASN 111          HD21      ASN 111 135.475  -0.457  -0.437
  870   HD22  ASN 111          HD22      ASN 111 136.928  -1.168   0.160
  871    H    THR 112           HN       THR 112 132.969   2.334  -2.536
  872    HA   THR 112           HA       THR 112 133.625   4.202  -4.582
  873    HB   THR 112           HB       THR 112 131.836   1.825  -5.124
  874    HG1  THR 112           HG1      THR 112 134.395   2.172  -5.645
  875   HG21  THR 112          HG21      THR 112 131.452   2.780  -7.386
  876   HG22  THR 112          HG22      THR 112 132.370   4.208  -6.912
  877   HG23  THR 112          HG23      THR 112 130.844   3.835  -6.109
  878    H    SER 113           HN       SER 113 131.758   5.767  -4.651
  879    HA   SER 113           HA       SER 113 129.860   5.556  -2.561
  880    HB2  SER 113           HB2      SER 113 129.937   7.284  -5.030
  881    HB3  SER 113           HB1      SER 113 129.033   7.621  -3.560
  882    HG   SER 113           HG       SER 113 131.290   7.495  -2.560
  883    H    LEU 114           HN       LEU 114 128.046   4.234  -2.798
  884    HA   LEU 114           HA       LEU 114 127.996   2.687  -5.203
  885    HB2  LEU 114           HB2      LEU 114 126.240   2.438  -2.787
  886    HB3  LEU 114           HB1      LEU 114 126.533   1.234  -4.023
  887    HG   LEU 114           HG       LEU 114 128.448   2.202  -1.920
  888   HD11  LEU 114          HD11      LEU 114 128.416  -0.094  -1.171
  889   HD12  LEU 114          HD12      LEU 114 127.279  -0.502  -2.457
  890   HD13  LEU 114          HD13      LEU 114 126.797   0.610  -1.177
  891   HD21  LEU 114          HD21      LEU 114 129.663   1.934  -3.945
  892   HD22  LEU 114          HD22      LEU 114 128.965   0.327  -4.215
  893   HD23  LEU 114          HD23      LEU 114 130.056   0.616  -2.844
  894    H    VAL 115           HN       VAL 115 127.090   3.717  -6.802
  895    HA   VAL 115           HA       VAL 115 124.294   4.167  -6.410
  896    HB   VAL 115           HB       VAL 115 126.066   5.628  -8.414
  897   HG11  VAL 115          HG11      VAL 115 124.038   6.876  -9.064
  898   HG12  VAL 115          HG12      VAL 115 123.075   5.842  -8.006
  899   HG13  VAL 115          HG13      VAL 115 123.887   5.153  -9.413
  900   HG21  VAL 115          HG21      VAL 115 124.480   6.675  -6.071
  901   HG22  VAL 115          HG22      VAL 115 125.416   7.656  -7.199
  902   HG23  VAL 115          HG23      VAL 115 126.232   6.506  -6.137
  903    H    THR 116           HN       THR 116 123.573   2.233  -7.117
  904    HA   THR 116           HA       THR 116 124.818   0.839  -9.266
  905    HB   THR 116           HB       THR 116 123.659  -0.281  -7.268
  906    HG1  THR 116           HG1      THR 116 123.562  -1.934  -8.494
  907   HG21  THR 116          HG21      THR 116 121.212  -0.563  -7.393
  908   HG22  THR 116          HG22      THR 116 121.224   0.522  -8.798
  909   HG23  THR 116          HG23      THR 116 121.681   1.144  -7.210
  910    H    SER 117           HN       SER 117 123.994   0.640 -11.334
  911    HA   SER 117           HA       SER 117 122.006   2.666 -12.077
  912    HB2  SER 117           HB2      SER 117 124.118   1.326 -13.793
  913    HB3  SER 117           HB1      SER 117 122.968   2.542 -14.355
  914    HG   SER 117           HG       SER 117 124.334   3.268 -12.113
  915    H    VAL 118           HN       VAL 118 120.132   2.021 -12.485
  916    HA   VAL 118           HA       VAL 118 119.687  -0.831 -12.640
  917    HB   VAL 118           HB       VAL 118 118.557   0.404 -10.862
  918   HG11  VAL 118          HG11      VAL 118 116.781   2.022 -11.342
  919   HG12  VAL 118          HG12      VAL 118 117.160   1.883 -13.063
  920   HG13  VAL 118          HG13      VAL 118 118.363   2.550 -11.952
  921   HG21  VAL 118          HG21      VAL 118 116.691  -0.677 -12.978
  922   HG22  VAL 118          HG22      VAL 118 116.219  -0.376 -11.306
  923   HG23  VAL 118          HG23      VAL 118 117.444  -1.594 -11.679
  924    H    ALA 119           HN       ALA 119 118.666  -1.809 -14.192
  925    HA   ALA 119           HA       ALA 119 118.134  -0.394 -16.648
  926    HB1  ALA 119           HB1      ALA 119 119.421  -2.484 -16.781
  927    HB2  ALA 119           HB2      ALA 119 117.865  -2.669 -17.588
  928    HB3  ALA 119           HB3      ALA 119 118.110  -3.353 -15.983
  929    H    ILE 120           HN       ILE 120 116.005  -1.182 -17.700
  930    HA   ILE 120           HA       ILE 120 113.824  -1.071 -17.799
  931    HB   ILE 120           HB       ILE 120 114.079  -2.184 -15.023
  932   HG12  ILE 120          HG12      ILE 120 113.163  -4.297 -16.057
  933   HG13  ILE 120          HG11      ILE 120 113.326  -3.531 -17.627
  934   HG21  ILE 120          HG21      ILE 120 111.512  -1.965 -16.607
  935   HG22  ILE 120          HG22      ILE 120 111.887  -1.094 -15.117
  936   HG23  ILE 120          HG23      ILE 120 111.660  -2.851 -15.084
  937   HD11  ILE 120          HD11      ILE 120 115.540  -4.141 -15.684
  938   HD12  ILE 120          HD12      ILE 120 115.734  -3.460 -17.294
  939   HD13  ILE 120          HD13      ILE 120 115.128  -5.107 -17.101
  940    H    LEU 121           HN       LEU 121 115.583   0.912 -16.856
  941    HA   LEU 121           HA       LEU 121 113.921   2.791 -15.447
  942    HB2  LEU 121           HB2      LEU 121 116.269   2.611 -14.862
  943    HB3  LEU 121           HB1      LEU 121 116.736   2.824 -16.535
  944    HG   LEU 121           HG       LEU 121 115.912   5.046 -16.504
  945   HD11  LEU 121          HD11      LEU 121 115.403   4.578 -13.546
  946   HD12  LEU 121          HD12      LEU 121 114.170   4.861 -14.777
  947   HD13  LEU 121          HD13      LEU 121 115.301   6.146 -14.352
  948   HD21  LEU 121          HD21      LEU 121 117.865   4.440 -14.295
  949   HD22  LEU 121          HD22      LEU 121 117.652   6.024 -15.043
  950   HD23  LEU 121          HD23      LEU 121 118.236   4.666 -16.005
  951    H    ASP 122           HN       ASP 122 113.268   4.764 -16.555
  952    HA   ASP 122           HA       ASP 122 112.560   4.290 -19.252
  953    HB2  ASP 122           HB2      ASP 122 112.135   6.706 -17.482
  954    HB3  ASP 122           HB1      ASP 122 111.471   6.488 -19.099
  955    H    LYS 123           HN       LYS 123 113.644   4.730 -20.822
  956    HA   LYS 123           HA       LYS 123 115.918   6.631 -20.792
  957    HB2  LYS 123           HB2      LYS 123 115.212   4.603 -22.920
  958    HB3  LYS 123           HB1      LYS 123 116.756   5.377 -22.644
  959    HG2  LYS 123           HG2      LYS 123 115.575   3.406 -20.691
  960    HG3  LYS 123           HG1      LYS 123 116.535   2.893 -22.066
  961    HD2  LYS 123           HD2      LYS 123 117.967   2.933 -20.189
  962    HD3  LYS 123           HD1      LYS 123 118.381   4.339 -21.170
  963    HE2  LYS 123           HE2      LYS 123 117.099   5.754 -19.607
  964    HE3  LYS 123           HE1      LYS 123 116.715   4.321 -18.652
  965    HZ1  LYS 123           HZ1      LYS 123 118.594   5.667 -17.809
  966    HZ2  LYS 123           HZ2      LYS 123 119.452   5.292 -19.198
  967    HZ3  LYS 123           HZ3      LYS 123 119.011   4.058 -18.131
  968    H    GLU 124           HN       GLU 124 113.757   8.121 -20.838
  969    HA   GLU 124           HA       GLU 124 112.429   8.090 -23.400
  970    HB2  GLU 124           HB2      GLU 124 112.029  10.025 -21.130
  971    HB3  GLU 124           HB1      GLU 124 110.965   9.774 -22.507
  972    HG2  GLU 124           HG2      GLU 124 110.775   7.363 -21.656
  973    HG3  GLU 124           HG1      GLU 124 111.495   8.024 -20.185
  974    HA   PRO 125           HA       PRO 125 114.838  11.314 -25.220
  975    HB2  PRO 125           HB2      PRO 125 113.202  12.086 -27.209
  976    HB3  PRO 125           HB1      PRO 125 113.985  10.500 -27.215
  977    HG2  PRO 125           HG2      PRO 125 111.186  11.226 -26.463
  978    HG3  PRO 125           HG1      PRO 125 111.762   9.841 -27.405
  979    HD2  PRO 125           HD2      PRO 125 111.104   9.715 -24.744
  980    HD3  PRO 125           HD1      PRO 125 112.260   8.623 -25.526
  981    H1   ARG 151           HT1      ARG 151 130.365  13.455   3.103
  982    H2   ARG 151           HT2      ARG 151 131.250  14.599   3.971
  983    H3   ARG 151           HT3      ARG 151 131.838  13.033   3.795
  984    HA   ARG 151           HA       ARG 151 132.045  15.271   2.056
  985    HB2  ARG 151           HB2      ARG 151 133.905  13.805   2.976
  986    HB3  ARG 151           HB1      ARG 151 133.330  12.543   1.903
  987    HG2  ARG 151           HG2      ARG 151 135.202  13.562   0.856
  988    HG3  ARG 151           HG1      ARG 151 133.766  14.077  -0.021
  989    HD2  ARG 151           HD2      ARG 151 135.143  15.712   2.112
  990    HD3  ARG 151           HD1      ARG 151 135.436  15.901   0.393
  991    HE   ARG 151           HE       ARG 151 133.049  16.556   0.216
  992   HH11  ARG 151          HH11      ARG 151 134.654  16.868   3.379
  993   HH12  ARG 151          HH12      ARG 151 133.685  18.164   3.872
  994   HH21  ARG 151          HH21      ARG 151 131.736  18.344   0.944
  995   HH22  ARG 151          HH22      ARG 151 132.007  19.027   2.488
  996    H    SER 152           HN       SER 152 131.369  11.758   1.426
  997    HA   SER 152           HA       SER 152 130.345  12.444  -1.155
  998    HB2  SER 152           HB2      SER 152 130.094   9.799  -1.007
  999    HB3  SER 152           HB1      SER 152 131.662  10.559  -1.295
 1000    HG   SER 152           HG       SER 152 132.031   9.205   0.318
 1001    H    SER 153           HN       SER 153 128.212  11.857  -1.802
 1002    HA   SER 153           HA       SER 153 126.333  11.847   0.454
 1003    HB2  SER 153           HB2      SER 153 126.615  14.060  -0.772
 1004    HB3  SER 153           HB1      SER 153 125.886  13.278  -2.169
 1005    HG   SER 153           HG       SER 153 124.066  12.791  -0.568
 1006    H    ARG 154           HN       ARG 154 126.425  11.251  -3.112
 1007    HA   ARG 154           HA       ARG 154 124.197   9.474  -2.870
 1008    HB2  ARG 154           HB2      ARG 154 125.938  10.164  -5.234
 1009    HB3  ARG 154           HB1      ARG 154 124.647   8.981  -5.314
 1010    HG2  ARG 154           HG2      ARG 154 124.345  11.912  -4.682
 1011    HG3  ARG 154           HG1      ARG 154 123.958  11.131  -6.212
 1012    HD2  ARG 154           HD2      ARG 154 122.614  10.648  -3.545
 1013    HD3  ARG 154           HD1      ARG 154 121.933  11.491  -4.926
 1014    HE   ARG 154           HE       ARG 154 122.650   8.886  -5.681
 1015   HH11  ARG 154          HH11      ARG 154 120.153  10.696  -3.913
 1016   HH12  ARG 154          HH12      ARG 154 119.032   9.443  -3.887
 1017   HH21  ARG 154          HH21      ARG 154 121.033   7.092  -5.651
 1018   HH22  ARG 154          HH22      ARG 154 119.590   7.328  -4.786
 1019    H    THR 155           HN       THR 155 124.971   7.995  -1.416
 1020    HA   THR 155           HA       THR 155 125.880   5.711  -2.776
 1021    HB   THR 155           HB       THR 155 128.063   6.513  -2.149
 1022    HG1  THR 155           HG1      THR 155 127.763   4.538  -0.189
 1023   HG21  THR 155          HG21      THR 155 128.777   6.795   0.162
 1024   HG22  THR 155          HG22      THR 155 127.110   6.581   0.705
 1025   HG23  THR 155          HG23      THR 155 127.549   7.986  -0.286
 1026    H    ARG 156           HN       ARG 156 124.494   4.338  -2.321
 1027    HA   ARG 156           HA       ARG 156 122.817   4.613  -0.059
 1028    HB2  ARG 156           HB2      ARG 156 121.819   2.395  -0.973
 1029    HB3  ARG 156           HB1      ARG 156 121.576   3.907  -1.827
 1030    HG2  ARG 156           HG2      ARG 156 123.438   3.218  -3.346
 1031    HG3  ARG 156           HG1      ARG 156 123.422   1.646  -2.532
 1032    HD2  ARG 156           HD2      ARG 156 122.029   1.729  -4.614
 1033    HD3  ARG 156           HD1      ARG 156 121.142   1.261  -3.163
 1034    HE   ARG 156           HE       ARG 156 120.941   4.058  -3.481
 1035   HH11  ARG 156          HH11      ARG 156 119.724   1.161  -5.181
 1036   HH12  ARG 156          HH12      ARG 156 118.257   1.909  -5.598
 1037   HH21  ARG 156          HH21      ARG 156 118.901   4.985  -4.019
 1038   HH22  ARG 156          HH22      ARG 156 117.794   4.091  -4.964
 1039    H    ARG 157           HN       ARG 157 122.759   3.680   1.845
 1040    HA   ARG 157           HA       ARG 157 125.214   2.303   2.596
 1041    HB2  ARG 157           HB2      ARG 157 122.993   3.353   4.333
 1042    HB3  ARG 157           HB1      ARG 157 124.580   2.821   4.859
 1043    HG2  ARG 157           HG2      ARG 157 123.997   5.195   3.117
 1044    HG3  ARG 157           HG1      ARG 157 124.413   5.232   4.827
 1045    HD2  ARG 157           HD2      ARG 157 126.604   4.283   4.327
 1046    HD3  ARG 157           HD1      ARG 157 126.177   4.182   2.617
 1047    HE   ARG 157           HE       ARG 157 125.750   6.736   3.122
 1048   HH11  ARG 157          HH11      ARG 157 128.567   4.677   3.813
 1049   HH12  ARG 157          HH12      ARG 157 129.697   5.933   3.730
 1050   HH21  ARG 157          HH21      ARG 157 127.349   8.470   2.983
 1051   HH22  ARG 157          HH22      ARG 157 129.001   8.110   3.237
 1052    H    GLU 158           HN       GLU 158 125.334   0.376   3.522
 1053    HA   GLU 158           HA       GLU 158 123.255  -1.539   3.102
 1054    HB2  GLU 158           HB2      GLU 158 125.705  -1.979   2.871
 1055    HB3  GLU 158           HB1      GLU 158 125.857  -1.784   4.608
 1056    HG2  GLU 158           HG2      GLU 158 125.798  -4.094   4.212
 1057    HG3  GLU 158           HG1      GLU 158 124.200  -3.679   4.832
 1058    H    THR 159           HN       THR 159 121.612  -1.512   4.437
 1059    HA   THR 159           HA       THR 159 122.078  -1.253   7.316
 1060    HB   THR 159           HB       THR 159 119.464  -0.796   5.827
 1061    HG1  THR 159           HG1      THR 159 120.986   0.701   5.090
 1062   HG21  THR 159          HG21      THR 159 119.255  -1.179   8.288
 1063   HG22  THR 159          HG22      THR 159 118.855   0.489   7.903
 1064   HG23  THR 159          HG23      THR 159 120.419   0.099   8.585
 1065    H    GLN 160           HN       GLN 160 122.550  -3.506   7.467
 1066    HA   GLN 160           HA       GLN 160 120.674  -5.368   6.416
 1067    HB2  GLN 160           HB2      GLN 160 122.004  -7.140   7.499
 1068    HB3  GLN 160           HB1      GLN 160 122.997  -6.074   6.535
 1069    HG2  GLN 160           HG2      GLN 160 122.743  -5.995   9.519
 1070    HG3  GLN 160           HG1      GLN 160 124.001  -6.842   8.627
 1071   HE21  GLN 160          HE21      GLN 160 124.270  -4.642  10.543
 1072   HE22  GLN 160          HE22      GLN 160 125.091  -3.379   9.701
 1073    H    VAL 161           HN       VAL 161 118.783  -5.877   7.238
 1074    HA   VAL 161           HA       VAL 161 118.492  -5.364  10.058
 1075    HB   VAL 161           HB       VAL 161 116.163  -4.711   9.704
 1076   HG11  VAL 161          HG11      VAL 161 118.082  -3.270   7.937
 1077   HG12  VAL 161          HG12      VAL 161 117.796  -2.965   9.671
 1078   HG13  VAL 161          HG13      VAL 161 116.517  -2.667   8.468
 1079   HG21  VAL 161          HG21      VAL 161 115.234  -4.386   7.504
 1080   HG22  VAL 161          HG22      VAL 161 115.764  -6.069   7.669
 1081   HG23  VAL 161          HG23      VAL 161 116.738  -4.918   6.773
  Start of MODEL    2
    1    H1   GLY  -3           HT1      GLY  -3 120.273  23.013 -12.417
    2    H2   GLY  -3           HT2      GLY  -3 120.491  24.593 -12.971
    3    H3   GLY  -3           HT3      GLY  -3 121.785  23.491 -12.961
    4    HA2  GLY  -3           HA1      GLY  -3 119.339  23.226 -14.573
    5    HA3  GLY  -3           HA2      GLY  -3 120.905  23.754 -15.182
    6    H    ALA  -2           HN       ALA  -2 120.527  21.868 -16.588
    7    HA   ALA  -2           HA       ALA  -2 120.892  19.763 -17.294
    8    HB1  ALA  -2           HB1      ALA  -2 122.895  19.694 -15.025
    9    HB2  ALA  -2           HB2      ALA  -2 123.201  20.332 -16.640
   10    HB3  ALA  -2           HB3      ALA  -2 122.872  18.613 -16.418
   11    H    MET  -1           HN       MET  -1 118.685  19.525 -16.408
   12    HA   MET  -1           HA       MET  -1 118.345  18.072 -13.985
   13    HB2  MET  -1           HB2      MET  -1 116.384  18.899 -16.112
   14    HB3  MET  -1           HB1      MET  -1 115.915  17.869 -14.774
   15    HG2  MET  -1           HG2      MET  -1 115.317  20.133 -14.271
   16    HG3  MET  -1           HG1      MET  -1 116.615  19.631 -13.196
   17    HE1  MET  -1           HE1      MET  -1 115.525  21.915 -16.168
   18    HE2  MET  -1           HE2      MET  -1 116.681  20.837 -16.949
   19    HE3  MET  -1           HE3      MET  -1 117.068  22.543 -16.746
   20    H    GLY   0           HN       GLY   0 119.869  16.508 -14.709
   21    HA2  GLY   0           HA2      GLY   0 118.413  14.149 -15.697
   22    HA3  GLY   0           HA1      GLY   0 120.124  14.423 -16.049
   23    H    LYS   1           HN       LYS   1 118.415  15.127 -13.099
   24    HA   LYS   1           HA       LYS   1 120.426  13.726 -11.567
   25    HB2  LYS   1           HB2      LYS   1 118.142  15.547 -10.791
   26    HB3  LYS   1           HB1      LYS   1 119.099  14.679  -9.618
   27    HG2  LYS   1           HG2      LYS   1 120.011  16.819  -9.637
   28    HG3  LYS   1           HG1      LYS   1 121.106  15.858 -10.621
   29    HD2  LYS   1           HD2      LYS   1 120.155  16.755 -12.644
   30    HD3  LYS   1           HD1      LYS   1 118.912  17.603 -11.724
   31    HE2  LYS   1           HE2      LYS   1 121.880  18.100 -11.523
   32    HE3  LYS   1           HE1      LYS   1 120.746  19.098 -12.430
   33    HZ1  LYS   1           HZ1      LYS   1 120.756  18.672  -9.486
   34    HZ2  LYS   1           HZ2      LYS   1 119.579  19.514 -10.304
   35    HZ3  LYS   1           HZ3      LYS   1 121.168  20.090 -10.300
   36    HA   PRO   2           HA       PRO   2 117.989  10.131 -10.804
   37    HB2  PRO   2           HB2      PRO   2 118.672   9.675  -8.181
   38    HB3  PRO   2           HB1      PRO   2 119.632   9.190  -9.581
   39    HG2  PRO   2           HG2      PRO   2 119.900  11.568  -7.808
   40    HG3  PRO   2           HG1      PRO   2 121.199  10.545  -8.463
   41    HD2  PRO   2           HD2      PRO   2 120.606  12.953  -9.497
   42    HD3  PRO   2           HD1      PRO   2 121.114  11.633 -10.557
   43    H    PHE   3           HN       PHE   3 116.040   9.990 -10.369
   44    HA   PHE   3           HA       PHE   3 114.557  12.152  -9.560
   45    HB2  PHE   3           HB2      PHE   3 112.586  10.783  -9.953
   46    HB3  PHE   3           HB1      PHE   3 113.776  10.595 -11.234
   47    HD1  PHE   3           HD1      PHE   3 115.299   8.506 -11.064
   48    HD2  PHE   3           HD2      PHE   3 111.693   9.035  -8.944
   49    HE1  PHE   3           HE1      PHE   3 115.151   6.062 -10.747
   50    HE2  PHE   3           HE2      PHE   3 111.498   6.630  -8.603
   51    HZ   PHE   3           HZ       PHE   3 113.246   5.112  -9.507
   52    H    PHE   4           HN       PHE   4 113.776  12.809  -7.858
   53    HA   PHE   4           HA       PHE   4 113.024  11.135  -5.651
   54    HB2  PHE   4           HB2      PHE   4 115.258  11.676  -4.825
   55    HB3  PHE   4           HB1      PHE   4 115.025  13.353  -5.350
   56    HD1  PHE   4           HD1      PHE   4 114.120  10.913  -2.718
   57    HD2  PHE   4           HD2      PHE   4 113.796  14.938  -4.087
   58    HE1  PHE   4           HE1      PHE   4 113.125  11.598  -0.566
   59    HE2  PHE   4           HE2      PHE   4 112.818  15.614  -2.012
   60    HZ   PHE   4           HZ       PHE   4 112.476  13.941  -0.190
   61    H    THR   5           HN       THR   5 111.148  11.807  -5.039
   62    HA   THR   5           HA       THR   5 110.785  14.436  -4.114
   63    HB   THR   5           HB       THR   5 110.241  14.889  -6.405
   64    HG1  THR   5           HG1      THR   5 108.154  14.926  -4.528
   65   HG21  THR   5          HG21      THR   5 108.035  12.822  -6.166
   66   HG22  THR   5          HG22      THR   5 109.511  12.632  -7.084
   67   HG23  THR   5          HG23      THR   5 108.320  13.844  -7.579
   68    H    ARG   6           HN       ARG   6 110.943  11.870  -3.163
   69    HA   ARG   6           HA       ARG   6 110.033  10.367  -1.817
   70    HB2  ARG   6           HB2      ARG   6 108.929  11.308   0.192
   71    HB3  ARG   6           HB1      ARG   6 110.428  12.041  -0.398
   72    HG2  ARG   6           HG2      ARG   6 109.270  13.888   0.176
   73    HG3  ARG   6           HG1      ARG   6 108.867  13.682  -1.536
   74    HD2  ARG   6           HD2      ARG   6 106.835  14.223  -0.373
   75    HD3  ARG   6           HD1      ARG   6 106.818  12.537  -0.911
   76    HE   ARG   6           HE       ARG   6 107.499  13.305   1.844
   77   HH11  ARG   6          HH11      ARG   6 105.702  11.184  -0.344
   78   HH12  ARG   6          HH12      ARG   6 104.942  10.314   0.908
   79   HH21  ARG   6          HH21      ARG   6 106.471  12.153   3.513
   80   HH22  ARG   6          HH22      ARG   6 105.395  10.865   3.177
   81    H    ASN   7           HN       ASN   7 108.933  10.451  -4.004
   82    HA   ASN   7           HA       ASN   7 106.142   9.687  -3.431
   83    HB2  ASN   7           HB2      ASN   7 107.420  10.698  -5.887
   84    HB3  ASN   7           HB1      ASN   7 106.099   9.562  -6.085
   85   HD21  ASN   7          HD21      ASN   7 106.302  11.872  -3.455
   86   HD22  ASN   7          HD22      ASN   7 104.995  12.861  -3.991
   87    HA   PRO   8           HA       PRO   8 107.371   5.281  -3.711
   88    HB2  PRO   8           HB2      PRO   8 104.556   5.108  -4.087
   89    HB3  PRO   8           HB1      PRO   8 105.433   4.306  -2.873
   90    HG2  PRO   8           HG2      PRO   8 103.746   6.482  -2.715
   91    HG3  PRO   8           HG1      PRO   8 104.776   5.972  -1.357
   92    HD2  PRO   8           HD2      PRO   8 104.793   8.293  -2.818
   93    HD3  PRO   8           HD1      PRO   8 106.075   7.814  -1.685
   94    H    SER   9           HN       SER   9 104.946   7.052  -5.130
   95    HA   SER   9           HA       SER   9 104.300   5.418  -7.103
   96    HB2  SER   9           HB2      SER   9 103.838   8.118  -6.238
   97    HB3  SER   9           HB1      SER   9 102.894   7.509  -7.669
   98    HG   SER   9           HG       SER   9 101.915   6.144  -6.250
   99    H    GLU  10           HN       GLU  10 106.916   7.819  -6.801
  100    HA   GLU  10           HA       GLU  10 107.173   8.395  -9.633
  101    HB2  GLU  10           HB2      GLU  10 109.170   9.657  -9.081
  102    HB3  GLU  10           HB1      GLU  10 107.978  10.065  -7.850
  103    HG2  GLU  10           HG2      GLU  10 109.187   8.364  -6.384
  104    HG3  GLU  10           HG1      GLU  10 110.415   8.308  -7.639
  105    H    LEU  11           HN       LEU  11 108.374   6.303  -7.183
  106    HA   LEU  11           HA       LEU  11 110.275   4.907  -8.735
  107    HB2  LEU  11           HB2      LEU  11 108.530   4.023  -6.442
  108    HB3  LEU  11           HB1      LEU  11 109.857   3.085  -7.095
  109    HG   LEU  11           HG       LEU  11 110.205   5.814  -5.854
  110   HD11  LEU  11          HD11      LEU  11 109.342   4.225  -4.230
  111   HD12  LEU  11          HD12      LEU  11 111.048   4.582  -3.917
  112   HD13  LEU  11          HD13      LEU  11 110.585   3.070  -4.708
  113   HD21  LEU  11          HD21      LEU  11 111.952   5.106  -7.440
  114   HD22  LEU  11          HD22      LEU  11 112.155   3.617  -6.546
  115   HD23  LEU  11          HD23      LEU  11 112.554   5.169  -5.785
  116    H    LYS  12           HN       LYS  12 110.004   3.300 -10.000
  117    HA   LYS  12           HA       LYS  12 107.418   3.118 -11.320
  118    HB2  LYS  12           HB2      LYS  12 108.516   1.867 -13.098
  119    HB3  LYS  12           HB1      LYS  12 109.353   3.367 -12.749
  120    HG2  LYS  12           HG2      LYS  12 111.206   2.347 -12.083
  121    HG3  LYS  12           HG1      LYS  12 110.300   1.102 -11.227
  122    HD2  LYS  12           HD2      LYS  12 110.566   1.211 -14.237
  123    HD3  LYS  12           HD1      LYS  12 111.706   0.302 -13.224
  124    HE2  LYS  12           HE2      LYS  12 109.891  -1.107 -12.447
  125    HE3  LYS  12           HE1      LYS  12 108.711  -0.155 -13.334
  126    HZ1  LYS  12           HZ1      LYS  12 110.911  -1.721 -14.548
  127    HZ2  LYS  12           HZ2      LYS  12 109.723  -0.886 -15.398
  128    HZ3  LYS  12           HZ3      LYS  12 109.314  -2.219 -14.467
  129    H    GLY  13           HN       GLY  13 107.009   0.853 -12.356
  130    HA2  GLY  13           HA2      GLY  13 106.609  -1.384 -12.094
  131    HA3  GLY  13           HA1      GLY  13 107.399  -1.353 -10.527
  132    H    LYS  14           HN       LYS  14 106.092  -1.924  -9.090
  133    HA   LYS  14           HA       LYS  14 103.364  -0.909  -9.138
  134    HB2  LYS  14           HB2      LYS  14 102.696  -3.112  -8.134
  135    HB3  LYS  14           HB1      LYS  14 103.163  -3.156  -9.837
  136    HG2  LYS  14           HG2      LYS  14 105.503  -3.642  -8.557
  137    HG3  LYS  14           HG1      LYS  14 104.338  -4.440  -7.500
  138    HD2  LYS  14           HD2      LYS  14 104.477  -4.820 -10.457
  139    HD3  LYS  14           HD1      LYS  14 105.352  -5.856  -9.339
  140    HE2  LYS  14           HE2      LYS  14 103.346  -7.059  -9.889
  141    HE3  LYS  14           HE1      LYS  14 103.090  -6.398  -8.283
  142    HZ1  LYS  14           HZ1      LYS  14 101.735  -4.612  -9.329
  143    HZ2  LYS  14           HZ2      LYS  14 101.143  -6.134  -9.578
  144    HZ3  LYS  14           HZ3      LYS  14 101.940  -5.364 -10.834
  145    H    PHE  15           HN       PHE  15 102.449  -0.530  -7.139
  146    HA   PHE  15           HA       PHE  15 104.373  -0.151  -4.991
  147    HB2  PHE  15           HB2      PHE  15 103.621   1.914  -6.088
  148    HB3  PHE  15           HB1      PHE  15 101.958   1.394  -5.876
  149    HD1  PHE  15           HD2      PHE  15 104.093   0.783  -3.050
  150    HD2  PHE  15           HD1      PHE  15 101.661   3.646  -4.981
  151    HE1  PHE  15           HE2      PHE  15 103.969   2.073  -0.941
  152    HE2  PHE  15           HE1      PHE  15 101.520   4.966  -2.908
  153    HZ   PHE  15           HZ       PHE  15 102.678   4.212  -0.897
  154    H    ILE  16           HN       ILE  16 103.943  -1.552  -3.464
  155    HA   ILE  16           HA       ILE  16 101.188  -2.268  -2.952
  156    HB   ILE  16           HB       ILE  16 101.929  -4.562  -2.330
  157   HG12  ILE  16          HG12      ILE  16 104.403  -4.071  -2.294
  158   HG13  ILE  16          HG11      ILE  16 103.953  -5.551  -3.111
  159   HG21  ILE  16          HG21      ILE  16 102.079  -3.818  -5.235
  160   HG22  ILE  16          HG22      ILE  16 100.639  -4.250  -4.307
  161   HG23  ILE  16          HG23      ILE  16 101.884  -5.460  -4.626
  162   HD11  ILE  16          HD11      ILE  16 105.740  -4.289  -4.310
  163   HD12  ILE  16          HD12      ILE  16 104.577  -2.966  -4.577
  164   HD13  ILE  16          HD13      ILE  16 104.293  -4.537  -5.276
  165    H    HIS  17           HN       HIS  17 100.734  -2.949  -0.899
  166    HA   HIS  17           HA       HIS  17 102.617  -2.048   1.165
  167    HB2  HIS  17           HB2      HIS  17 100.825  -0.493   0.877
  168    HB3  HIS  17           HB1      HIS  17  99.623  -1.784   0.879
  169    HD1  HIS  17           HD1      HIS  17 100.769   0.898   2.941
  170    HD2  HIS  17           HD2      HIS  17  99.630  -3.034   3.660
  171    HE1  HIS  17           HE1      HIS  17  99.989   0.824   5.317
  172    H    THR  18           HN       THR  18 103.344  -3.826   2.035
  173    HA   THR  18           HA       THR  18 101.476  -6.012   2.674
  174    HB   THR  18           HB       THR  18 102.763  -6.590   0.597
  175    HG1  THR  18           HG1      THR  18 102.164  -8.358   1.559
  176   HG21  THR  18          HG21      THR  18 105.165  -6.616   2.440
  177   HG22  THR  18          HG22      THR  18 104.879  -5.457   1.147
  178   HG23  THR  18          HG23      THR  18 105.146  -7.160   0.759
  179    H    LYS  19           HN       LYS  19 102.029  -7.266   4.504
  180    HA   LYS  19           HA       LYS  19 103.521  -5.729   6.489
  181    HB2  LYS  19           HB2      LYS  19 101.240  -6.203   6.999
  182    HB3  LYS  19           HB1      LYS  19 101.428  -7.904   6.647
  183    HG2  LYS  19           HG2      LYS  19 102.730  -6.514   9.012
  184    HG3  LYS  19           HG1      LYS  19 101.135  -7.246   9.080
  185    HD2  LYS  19           HD2      LYS  19 102.344  -9.435   8.285
  186    HD3  LYS  19           HD1      LYS  19 103.815  -8.581   8.748
  187    HE2  LYS  19           HE2      LYS  19 103.086 -10.010  10.535
  188    HE3  LYS  19           HE1      LYS  19 103.001  -8.313  10.991
  189    HZ1  LYS  19           HZ1      LYS  19 100.617  -8.369  10.631
  190    HZ2  LYS  19           HZ2      LYS  19 101.085  -9.585  11.706
  191    HZ3  LYS  19           HZ3      LYS  19 100.704  -9.988  10.144
  192    H    LEU  20           HN       LEU  20 105.246  -6.483   7.607
  193    HA   LEU  20           HA       LEU  20 106.144  -9.239   7.081
  194    HB2  LEU  20           HB2      LEU  20 107.567  -6.775   6.664
  195    HB3  LEU  20           HB1      LEU  20 108.341  -7.653   7.967
  196    HG   LEU  20           HG       LEU  20 108.756  -9.544   6.509
  197   HD11  LEU  20          HD11      LEU  20 107.345  -7.995   4.366
  198   HD12  LEU  20          HD12      LEU  20 106.826  -9.520   5.127
  199   HD13  LEU  20          HD13      LEU  20 108.301  -9.469   4.174
  200   HD21  LEU  20          HD21      LEU  20 110.276  -8.491   4.932
  201   HD22  LEU  20          HD22      LEU  20 110.419  -7.813   6.542
  202   HD23  LEU  20          HD23      LEU  20 109.557  -6.923   5.284
  203    H    ARG  21           HN       ARG  21 106.327 -10.401   8.882
  204    HA   ARG  21           HA       ARG  21 105.577  -9.071  11.265
  205    HB2  ARG  21           HB2      ARG  21 104.636 -11.295  10.517
  206    HB3  ARG  21           HB1      ARG  21 106.199 -11.991  10.898
  207    HG2  ARG  21           HG2      ARG  21 105.973 -11.271  13.221
  208    HG3  ARG  21           HG1      ARG  21 104.386 -10.595  12.848
  209    HD2  ARG  21           HD2      ARG  21 103.687 -12.852  12.104
  210    HD3  ARG  21           HD1      ARG  21 105.236 -13.458  12.679
  211    HE   ARG  21           HE       ARG  21 103.531 -12.007  14.559
  212   HH11  ARG  21          HH11      ARG  21 104.942 -15.107  13.549
  213   HH12  ARG  21          HH12      ARG  21 104.520 -15.921  14.976
  214   HH21  ARG  21          HH21      ARG  21 102.913 -13.172  16.547
  215   HH22  ARG  21          HH22      ARG  21 103.342 -14.796  16.721
  216    H    LYS  22           HN       LYS  22 107.176  -8.142  12.380
  217    HA   LYS  22           HA       LYS  22 109.751  -8.275  12.465
  218    HB2  LYS  22           HB2      LYS  22 107.678  -7.979  14.519
  219    HB3  LYS  22           HB1      LYS  22 109.343  -8.054  15.040
  220    HG2  LYS  22           HG2      LYS  22 108.585  -5.747  14.842
  221    HG3  LYS  22           HG1      LYS  22 109.865  -6.212  13.763
  222    HD2  LYS  22           HD2      LYS  22 107.033  -6.069  12.814
  223    HD3  LYS  22           HD1      LYS  22 108.084  -4.652  12.874
  224    HE2  LYS  22           HE2      LYS  22 108.305  -7.105  11.238
  225    HE3  LYS  22           HE1      LYS  22 108.410  -5.414  10.760
  226    HZ1  LYS  22           HZ1      LYS  22 110.609  -6.432  10.730
  227    HZ2  LYS  22           HZ2      LYS  22 110.537  -6.820  12.341
  228    HZ3  LYS  22           HZ3      LYS  22 110.537  -5.208  11.865
  229    H    SER  23           HN       SER  23 110.931 -10.023  12.421
  230    HA   SER  23           HA       SER  23 110.479 -12.149  14.374
  231    HB2  SER  23           HB2      SER  23 109.991 -12.789  11.948
  232    HB3  SER  23           HB1      SER  23 111.677 -12.435  11.588
  233    HG   SER  23           HG       SER  23 111.177 -14.159  13.709
  234    H    SER  24           HN       SER  24 112.268 -12.539  15.585
  235    HA   SER  24           HA       SER  24 114.116 -11.971  16.734
  236    HB2  SER  24           HB2      SER  24 115.315 -11.228  14.060
  237    HB3  SER  24           HB1      SER  24 116.184 -11.742  15.505
  238    HG   SER  24           HG       SER  24 114.831 -13.183  13.621
  239    H    ARG  25           HN       ARG  25 115.977  -9.749  16.322
  240    HA   ARG  25           HA       ARG  25 114.040  -7.681  16.878
  241    HB2  ARG  25           HB2      ARG  25 117.037  -7.697  17.237
  242    HB3  ARG  25           HB1      ARG  25 116.079  -6.239  17.403
  243    HG2  ARG  25           HG2      ARG  25 116.313  -6.954  19.599
  244    HG3  ARG  25           HG1      ARG  25 114.734  -7.590  19.136
  245    HD2  ARG  25           HD2      ARG  25 115.715  -9.772  18.737
  246    HD3  ARG  25           HD1      ARG  25 117.310  -9.146  19.150
  247    HE   ARG  25           HE       ARG  25 115.474  -8.621  21.224
  248   HH11  ARG  25          HH11      ARG  25 117.424 -11.283  19.887
  249   HH12  ARG  25          HH12      ARG  25 117.472 -12.146  21.332
  250   HH21  ARG  25          HH21      ARG  25 115.539  -9.851  23.206
  251   HH22  ARG  25          HH22      ARG  25 116.392 -11.320  23.287
  252    H    GLY  26           HN       GLY  26 113.493  -8.075  14.570
  253    HA2  GLY  26           HA2      GLY  26 113.681  -5.808  13.121
  254    HA3  GLY  26           HA1      GLY  26 115.162  -6.657  12.720
  255    H    PHE  27           HN       PHE  27 115.096  -7.779  11.054
  256    HA   PHE  27           HA       PHE  27 112.543  -8.713   9.973
  257    HB2  PHE  27           HB2      PHE  27 114.427  -6.718   9.065
  258    HB3  PHE  27           HB1      PHE  27 113.587  -7.635   7.758
  259    HD1  PHE  27           HD1      PHE  27 110.911  -7.294   8.287
  260    HD2  PHE  27           HD2      PHE  27 114.105  -4.903   9.741
  261    HE1  PHE  27           HE1      PHE  27 109.378  -5.426   8.631
  262    HE2  PHE  27           HE2      PHE  27 112.597  -3.074  10.103
  263    HZ   PHE  27           HZ       PHE  27 110.264  -3.294   9.610
  264    H    GLY  28           HN       GLY  28 115.374  -8.441   7.996
  265    HA2  GLY  28           HA2      GLY  28 116.949 -10.416   8.010
  266    HA3  GLY  28           HA1      GLY  28 115.494 -11.361   7.752
  267    H    PHE  29           HN       PHE  29 116.820  -8.316   6.516
  268    HA   PHE  29           HA       PHE  29 117.231  -9.411   3.910
  269    HB2  PHE  29           HB2      PHE  29 115.733  -7.970   2.634
  270    HB3  PHE  29           HB1      PHE  29 114.797  -8.969   3.724
  271    HD1  PHE  29           HD1      PHE  29 115.949  -5.591   2.971
  272    HD2  PHE  29           HD2      PHE  29 113.478  -7.965   5.468
  273    HE1  PHE  29           HE1      PHE  29 114.767  -3.555   3.720
  274    HE2  PHE  29           HE2      PHE  29 112.299  -5.944   6.238
  275    HZ   PHE  29           HZ       PHE  29 112.942  -3.736   5.363
  276    H    THR  30           HN       THR  30 118.644  -8.109   2.706
  277    HA   THR  30           HA       THR  30 119.539  -5.836   4.316
  278    HB   THR  30           HB       THR  30 121.714  -6.028   3.073
  279    HG1  THR  30           HG1      THR  30 121.306  -8.627   2.414
  280   HG21  THR  30          HG21      THR  30 122.526  -7.971   4.328
  281   HG22  THR  30          HG22      THR  30 120.866  -8.515   4.555
  282   HG23  THR  30          HG23      THR  30 121.405  -7.030   5.317
  283    H    VAL  31           HN       VAL  31 119.726  -3.908   3.674
  284    HA   VAL  31           HA       VAL  31 118.409  -3.460   1.167
  285    HB   VAL  31           HB       VAL  31 117.008  -3.433   3.075
  286   HG11  VAL  31          HG11      VAL  31 117.031  -1.573   4.705
  287   HG12  VAL  31          HG12      VAL  31 118.571  -1.059   4.011
  288   HG13  VAL  31          HG13      VAL  31 118.452  -2.620   4.828
  289   HG21  VAL  31          HG21      VAL  31 115.975  -1.276   2.751
  290   HG22  VAL  31          HG22      VAL  31 116.372  -2.271   1.318
  291   HG23  VAL  31          HG23      VAL  31 117.407  -0.887   1.752
  292    H    VAL  32           HN       VAL  32 119.013  -1.738   0.137
  293    HA   VAL  32           HA       VAL  32 121.411  -0.324   1.015
  294    HB   VAL  32           HB       VAL  32 121.866  -0.027  -1.492
  295   HG11  VAL  32          HG11      VAL  32 121.970  -2.790  -0.299
  296   HG12  VAL  32          HG12      VAL  32 123.191  -1.530  -0.105
  297   HG13  VAL  32          HG13      VAL  32 122.906  -2.251  -1.692
  298   HG21  VAL  32          HG21      VAL  32 119.818  -2.242  -1.592
  299   HG22  VAL  32          HG22      VAL  32 120.876  -1.833  -2.948
  300   HG23  VAL  32          HG23      VAL  32 119.686  -0.670  -2.370
  301    H    GLY  33           HN       GLY  33 121.312   1.744   1.126
  302    HA2  GLY  33           HA2      GLY  33 120.452   3.747  -0.223
  303    HA3  GLY  33           HA1      GLY  33 118.900   2.972  -0.010
  304    H    GLY  34           HN       GLY  34 118.017   4.534   1.029
  305    HA2  GLY  34           HA2      GLY  34 117.420   5.960   2.650
  306    HA3  GLY  34           HA1      GLY  34 117.634   4.630   3.734
  307    H    ASP  35           HN       ASP  35 119.261   7.059   2.014
  308    HA   ASP  35           HA       ASP  35 121.303   7.251   4.153
  309    HB2  ASP  35           HB2      ASP  35 121.819   6.765   1.692
  310    HB3  ASP  35           HB1      ASP  35 121.412   8.432   1.407
  311    H    GLU  36           HN       GLU  36 118.945   8.993   2.213
  312    HA   GLU  36           HA       GLU  36 118.784  11.191   4.041
  313    HB2  GLU  36           HB2      GLU  36 119.785  12.790   2.337
  314    HB3  GLU  36           HB1      GLU  36 120.937  11.859   3.277
  315    HG2  GLU  36           HG2      GLU  36 121.160  10.341   1.482
  316    HG3  GLU  36           HG1      GLU  36 120.056  11.302   0.479
  317    HA   PRO  37           HA       PRO  37 115.127  11.829   2.029
  318    HB2  PRO  37           HB2      PRO  37 115.774  14.663   2.040
  319    HB3  PRO  37           HB1      PRO  37 114.410  13.825   2.898
  320    HG2  PRO  37           HG2      PRO  37 116.449  14.881   4.245
  321    HG3  PRO  37           HG1      PRO  37 115.972  13.205   4.623
  322    HD2  PRO  37           HD2      PRO  37 118.065  14.061   2.617
  323    HD3  PRO  37           HD1      PRO  37 118.370  13.029   3.976
  324    H    ASP  38           HN       ASP  38 116.521  11.068   0.387
  325    HA   ASP  38           HA       ASP  38 116.162  12.266  -2.148
  326    HB2  ASP  38           HB2      ASP  38 117.929  13.669  -1.509
  327    HB3  ASP  38           HB1      ASP  38 118.900  12.372  -0.857
  328    H    GLU  39           HN       GLU  39 118.158  10.099  -0.183
  329    HA   GLU  39           HA       GLU  39 117.877   8.026  -2.222
  330    HB2  GLU  39           HB2      GLU  39 120.179   8.547  -1.642
  331    HB3  GLU  39           HB1      GLU  39 119.819   8.323   0.062
  332    HG2  GLU  39           HG2      GLU  39 121.003   6.442  -0.767
  333    HG3  GLU  39           HG1      GLU  39 119.361   5.947  -0.364
  334    H    PHE  40           HN       PHE  40 116.508   6.597  -1.899
  335    HA   PHE  40           HA       PHE  40 115.018   6.002   0.598
  336    HB2  PHE  40           HB2      PHE  40 114.534   4.790  -2.126
  337    HB3  PHE  40           HB1      PHE  40 113.403   4.966  -0.804
  338    HD1  PHE  40           HD2      PHE  40 113.384   7.782  -0.211
  339    HD2  PHE  40           HD1      PHE  40 113.775   5.824  -3.965
  340    HE1  PHE  40           HE2      PHE  40 112.433   9.746  -1.339
  341    HE2  PHE  40           HE1      PHE  40 112.834   7.790  -5.103
  342    HZ   PHE  40           HZ       PHE  40 112.155   9.754  -3.790
  343    H    LEU  41           HN       LEU  41 114.412   3.526   0.857
  344    HA   LEU  41           HA       LEU  41 117.031   2.247   0.633
  345    HB2  LEU  41           HB2      LEU  41 114.771   1.380   2.460
  346    HB3  LEU  41           HB1      LEU  41 116.390   0.718   2.260
  347    HG   LEU  41           HG       LEU  41 117.193   2.987   2.968
  348   HD11  LEU  41          HD11      LEU  41 115.717   4.083   4.669
  349   HD12  LEU  41          HD12      LEU  41 114.413   3.021   4.150
  350   HD13  LEU  41          HD13      LEU  41 115.092   4.191   3.022
  351   HD21  LEU  41          HD21      LEU  41 117.579   0.933   4.142
  352   HD22  LEU  41          HD22      LEU  41 115.991   1.029   4.903
  353   HD23  LEU  41          HD23      LEU  41 117.236   2.226   5.282
  354    H    GLN  42           HN       GLN  42 117.214   0.108  -0.201
  355    HA   GLN  42           HA       GLN  42 114.856  -0.852  -1.658
  356    HB2  GLN  42           HB2      GLN  42 116.173   0.537  -3.049
  357    HB3  GLN  42           HB1      GLN  42 117.641  -0.403  -2.629
  358    HG2  GLN  42           HG2      GLN  42 116.305  -2.364  -3.733
  359    HG3  GLN  42           HG1      GLN  42 115.251  -1.125  -4.325
  360   HE21  GLN  42          HE21      GLN  42 117.168  -2.951  -5.700
  361   HE22  GLN  42          HE22      GLN  42 118.112  -1.889  -6.692
  362    H    ILE  43           HN       ILE  43 114.958  -3.087  -1.951
  363    HA   ILE  43           HA       ILE  43 116.679  -4.507  -0.062
  364    HB   ILE  43           HB       ILE  43 114.434  -5.682  -1.786
  365   HG12  ILE  43          HG12      ILE  43 113.236  -6.021   0.276
  366   HG13  ILE  43          HG11      ILE  43 114.597  -5.436   1.213
  367   HG21  ILE  43          HG21      ILE  43 116.051  -7.071   0.371
  368   HG22  ILE  43          HG22      ILE  43 116.267  -7.320  -1.347
  369   HG23  ILE  43          HG23      ILE  43 114.745  -7.780  -0.577
  370   HD11  ILE  43          HD11      ILE  43 114.322  -3.299   0.261
  371   HD12  ILE  43          HD12      ILE  43 112.853  -3.823   1.126
  372   HD13  ILE  43          HD13      ILE  43 112.908  -3.825  -0.656
  373    H    LYS  44           HN       LYS  44 118.446  -5.224  -0.549
  374    HA   LYS  44           HA       LYS  44 119.056  -5.841  -3.366
  375    HB2  LYS  44           HB2      LYS  44 121.385  -5.711  -2.954
  376    HB3  LYS  44           HB1      LYS  44 120.629  -4.333  -2.171
  377    HG2  LYS  44           HG2      LYS  44 120.980  -5.244  -0.009
  378    HG3  LYS  44           HG1      LYS  44 121.289  -6.853  -0.658
  379    HD2  LYS  44           HD2      LYS  44 123.360  -5.954  -1.724
  380    HD3  LYS  44           HD1      LYS  44 123.082  -4.428  -0.892
  381    HE2  LYS  44           HE2      LYS  44 124.686  -5.779   0.338
  382    HE3  LYS  44           HE1      LYS  44 123.199  -5.606   1.269
  383    HZ1  LYS  44           HZ1      LYS  44 124.047  -7.875   1.319
  384    HZ2  LYS  44           HZ2      LYS  44 123.965  -8.017  -0.331
  385    HZ3  LYS  44           HZ3      LYS  44 122.544  -7.841   0.586
  386    H    SER  45           HN       SER  45 118.678  -7.375  -0.294
  387    HA   SER  45           HA       SER  45 118.833  -9.902  -1.718
  388    HB2  SER  45           HB2      SER  45 120.488  -9.394   0.764
  389    HB3  SER  45           HB1      SER  45 120.389 -10.907  -0.133
  390    HG   SER  45           HG       SER  45 121.001  -9.070  -1.865
  391    H    LEU  46           HN       LEU  46 117.122 -11.111  -1.059
  392    HA   LEU  46           HA       LEU  46 115.955 -10.305   1.366
  393    HB2  LEU  46           HB2      LEU  46 114.101 -11.806   0.895
  394    HB3  LEU  46           HB1      LEU  46 114.446 -10.799  -0.484
  395    HG   LEU  46           HG       LEU  46 115.809 -13.045  -1.160
  396   HD11  LEU  46          HD11      LEU  46 114.991 -14.228   0.861
  397   HD12  LEU  46          HD12      LEU  46 114.397 -14.947  -0.650
  398   HD13  LEU  46          HD13      LEU  46 113.346 -13.891   0.298
  399   HD21  LEU  46          HD21      LEU  46 113.901 -13.506  -2.572
  400   HD22  LEU  46          HD22      LEU  46 114.296 -11.773  -2.438
  401   HD23  LEU  46          HD23      LEU  46 112.929 -12.442  -1.529
  402    H    VAL  47           HN       VAL  47 116.559 -11.296   3.234
  403    HA   VAL  47           HA       VAL  47 118.530 -13.360   2.979
  404    HB   VAL  47           HB       VAL  47 117.632 -11.706   5.355
  405   HG11  VAL  47          HG11      VAL  47 119.648 -12.503   6.432
  406   HG12  VAL  47          HG12      VAL  47 119.989 -13.528   5.029
  407   HG13  VAL  47          HG13      VAL  47 118.554 -13.830   6.020
  408   HG21  VAL  47          HG21      VAL  47 120.153 -11.478   3.721
  409   HG22  VAL  47          HG22      VAL  47 119.630 -10.415   5.040
  410   HG23  VAL  47          HG23      VAL  47 118.748 -10.446   3.518
  411    H    LEU  48           HN       LEU  48 118.260 -15.398   3.618
  412    HA   LEU  48           HA       LEU  48 115.741 -16.566   4.141
  413    HB2  LEU  48           HB2      LEU  48 118.503 -17.599   4.783
  414    HB3  LEU  48           HB1      LEU  48 117.037 -18.551   4.766
  415    HG   LEU  48           HG       LEU  48 118.259 -17.212   2.369
  416   HD11  LEU  48          HD11      LEU  48 118.831 -19.493   1.659
  417   HD12  LEU  48          HD12      LEU  48 118.210 -20.117   3.187
  418   HD13  LEU  48          HD13      LEU  48 119.629 -19.068   3.174
  419   HD21  LEU  48          HD21      LEU  48 115.847 -17.410   2.171
  420   HD22  LEU  48          HD22      LEU  48 115.938 -19.116   2.606
  421   HD23  LEU  48          HD23      LEU  48 116.644 -18.555   1.091
  422    H    ASP  49           HN       ASP  49 114.773 -17.221   5.968
  423    HA   ASP  49           HA       ASP  49 114.191 -17.312   8.144
  424    HB2  ASP  49           HB2      ASP  49 116.502 -18.006   8.605
  425    HB3  ASP  49           HB1      ASP  49 116.984 -16.327   8.653
  426    H    GLY  50           HN       GLY  50 114.699 -14.749   6.371
  427    HA2  GLY  50           HA2      GLY  50 113.927 -12.616   8.232
  428    HA3  GLY  50           HA1      GLY  50 114.280 -12.588   6.476
  429    HA   PRO  51           HA       PRO  51 109.792 -13.354   7.398
  430    HB2  PRO  51           HB2      PRO  51 108.573 -10.852   7.759
  431    HB3  PRO  51           HB1      PRO  51 109.183 -11.882   9.009
  432    HG2  PRO  51           HG2      PRO  51 110.268  -9.386   8.095
  433    HG3  PRO  51           HG1      PRO  51 110.664 -10.310   9.543
  434    HD2  PRO  51           HD2      PRO  51 111.976 -10.187   6.936
  435    HD3  PRO  51           HD1      PRO  51 112.681 -10.763   8.427
  436    H    ALA  52           HN       ALA  52 111.267 -11.002   5.370
  437    HA   ALA  52           HA       ALA  52 109.372 -10.919   3.262
  438    HB1  ALA  52           HB1      ALA  52 111.264 -10.216   1.863
  439    HB2  ALA  52           HB2      ALA  52 112.388 -10.707   3.127
  440    HB3  ALA  52           HB3      ALA  52 111.286  -9.359   3.404
  441    H    ALA  53           HN       ALA  53 112.090 -13.039   3.986
  442    HA   ALA  53           HA       ALA  53 112.086 -14.673   1.678
  443    HB1  ALA  53           HB1      ALA  53 113.414 -16.200   3.049
  444    HB2  ALA  53           HB2      ALA  53 112.930 -15.336   4.501
  445    HB3  ALA  53           HB3      ALA  53 113.957 -14.537   3.303
  446    H    LEU  54           HN       LEU  54 110.764 -14.923   4.798
  447    HA   LEU  54           HA       LEU  54 109.841 -17.509   4.628
  448    HB2  LEU  54           HB2      LEU  54 109.311 -15.318   6.446
  449    HB3  LEU  54           HB1      LEU  54 108.952 -17.015   6.745
  450    HG   LEU  54           HG       LEU  54 111.722 -15.853   6.243
  451   HD11  LEU  54          HD11      LEU  54 110.327 -17.121   8.309
  452   HD12  LEU  54          HD12      LEU  54 110.719 -15.356   8.003
  453   HD13  LEU  54          HD13      LEU  54 112.067 -16.556   8.330
  454   HD21  LEU  54          HD21      LEU  54 112.522 -18.112   6.730
  455   HD22  LEU  54          HD22      LEU  54 111.600 -18.093   5.242
  456   HD23  LEU  54          HD23      LEU  54 110.868 -18.723   6.724
  457    H    ASP  55           HN       ASP  55 108.249 -14.336   4.462
  458    HA   ASP  55           HA       ASP  55 105.606 -15.390   4.151
  459    HB2  ASP  55           HB2      ASP  55 106.177 -13.082   5.014
  460    HB3  ASP  55           HB1      ASP  55 106.648 -12.656   3.380
  461    H    GLY  56           HN       GLY  56 108.296 -14.725   2.235
  462    HA2  GLY  56           HA2      GLY  56 108.838 -15.311   0.049
  463    HA3  GLY  56           HA1      GLY  56 107.270 -16.124   0.012
  464    H    LYS  57           HN       LYS  57 106.514 -13.139   0.721
  465    HA   LYS  57           HA       LYS  57 105.841 -12.738  -2.048
  466    HB2  LYS  57           HB2      LYS  57 104.032 -12.833  -0.565
  467    HB3  LYS  57           HB1      LYS  57 104.764 -11.632   0.475
  468    HG2  LYS  57           HG2      LYS  57 102.833 -10.750  -0.880
  469    HG3  LYS  57           HG1      LYS  57 104.338  -9.907  -1.243
  470    HD2  LYS  57           HD2      LYS  57 103.110 -10.420  -3.300
  471    HD3  LYS  57           HD1      LYS  57 104.638 -11.289  -3.252
  472    HE2  LYS  57           HE2      LYS  57 103.370 -13.304  -2.443
  473    HE3  LYS  57           HE1      LYS  57 101.878 -12.398  -2.704
  474    HZ1  LYS  57           HZ1      LYS  57 103.890 -13.097  -4.765
  475    HZ2  LYS  57           HZ2      LYS  57 102.468 -12.222  -5.063
  476    HZ3  LYS  57           HZ3      LYS  57 102.391 -13.821  -4.575
  477    H    MET  58           HN       MET  58 107.370 -10.948   0.596
  478    HA   MET  58           HA       MET  58 108.035  -8.762  -1.194
  479    HB2  MET  58           HB2      MET  58 107.600  -8.187   1.108
  480    HB3  MET  58           HB1      MET  58 108.770  -9.339   1.694
  481    HG2  MET  58           HG2      MET  58 110.536  -7.997   0.552
  482    HG3  MET  58           HG1      MET  58 109.305  -6.815   0.195
  483    HE1  MET  58           HE1      MET  58 111.374  -5.272   3.211
  484    HE2  MET  58           HE2      MET  58 110.954  -5.096   1.500
  485    HE3  MET  58           HE3      MET  58 112.016  -6.401   2.020
  486    H    GLU  59           HN       GLU  59 110.049  -8.430  -2.131
  487    HA   GLU  59           HA       GLU  59 111.928 -10.646  -1.887
  488    HB2  GLU  59           HB2      GLU  59 110.654  -9.857  -4.501
  489    HB3  GLU  59           HB1      GLU  59 111.984 -10.988  -4.319
  490    HG2  GLU  59           HG2      GLU  59 110.443 -12.373  -2.895
  491    HG3  GLU  59           HG1      GLU  59 109.141 -11.303  -3.408
  492    H    THR  60           HN       THR  60 113.834 -10.284  -3.304
  493    HA   THR  60           HA       THR  60 115.018  -7.802  -2.877
  494    HB   THR  60           HB       THR  60 115.742  -9.968  -4.839
  495    HG1  THR  60           HG1      THR  60 115.609  -9.894  -2.102
  496   HG21  THR  60          HG21      THR  60 117.321  -8.104  -3.178
  497   HG22  THR  60          HG22      THR  60 116.977  -7.859  -4.905
  498   HG23  THR  60          HG23      THR  60 117.967  -9.237  -4.363
  499    H    GLY  61           HN       GLY  61 114.869  -6.020  -4.132
  500    HA2  GLY  61           HA2      GLY  61 114.788  -5.125  -6.400
  501    HA3  GLY  61           HA1      GLY  61 113.557  -6.340  -6.735
  502    H    ASP  62           HN       ASP  62 112.725  -5.708  -3.766
  503    HA   ASP  62           HA       ASP  62 110.773  -3.705  -4.409
  504    HB2  ASP  62           HB2      ASP  62 111.522  -5.120  -1.851
  505    HB3  ASP  62           HB1      ASP  62 110.437  -3.741  -1.859
  506    H    VAL  63           HN       VAL  63 110.846  -1.625  -3.817
  507    HA   VAL  63           HA       VAL  63 113.092  -0.941  -2.183
  508    HB   VAL  63           HB       VAL  63 113.851   0.296  -3.940
  509   HG11  VAL  63          HG11      VAL  63 112.342  -0.418  -5.527
  510   HG12  VAL  63          HG12      VAL  63 112.456   1.344  -5.667
  511   HG13  VAL  63          HG13      VAL  63 111.037   0.600  -4.900
  512   HG21  VAL  63          HG21      VAL  63 113.196   2.670  -3.883
  513   HG22  VAL  63          HG22      VAL  63 113.418   2.004  -2.265
  514   HG23  VAL  63          HG23      VAL  63 111.795   2.248  -2.899
  515    H    ILE  64           HN       ILE  64 112.907  -0.179  -0.416
  516    HA   ILE  64           HA       ILE  64 110.410  -0.110   0.794
  517    HB   ILE  64           HB       ILE  64 113.161   0.457   1.885
  518   HG12  ILE  64          HG12      ILE  64 112.712  -1.839   1.270
  519   HG13  ILE  64          HG11      ILE  64 112.907  -1.686   3.013
  520   HG21  ILE  64          HG21      ILE  64 112.212   0.368   4.146
  521   HG22  ILE  64          HG22      ILE  64 110.591   0.305   3.452
  522   HG23  ILE  64          HG23      ILE  64 111.595   1.738   3.224
  523   HD11  ILE  64          HD11      ILE  64 110.440  -1.736   3.244
  524   HD12  ILE  64          HD12      ILE  64 111.111  -3.201   2.542
  525   HD13  ILE  64          HD13      ILE  64 110.310  -2.024   1.505
  526    H    VAL  65           HN       VAL  65 109.122   1.470   0.770
  527    HA   VAL  65           HA       VAL  65 109.903   4.240   0.398
  528    HB   VAL  65           HB       VAL  65 107.247   2.813   0.100
  529   HG11  VAL  65          HG11      VAL  65 106.385   4.799  -0.915
  530   HG12  VAL  65          HG12      VAL  65 107.915   5.619  -0.721
  531   HG13  VAL  65          HG13      VAL  65 106.961   5.188   0.713
  532   HG21  VAL  65          HG21      VAL  65 107.550   3.153  -2.303
  533   HG22  VAL  65          HG22      VAL  65 108.830   2.158  -1.608
  534   HG23  VAL  65          HG23      VAL  65 109.140   3.849  -1.994
  535    H    SER  66           HN       SER  66 107.579   2.256   2.322
  536    HA   SER  66           HA       SER  66 107.973   4.104   4.523
  537    HB2  SER  66           HB2      SER  66 106.127   5.069   3.254
  538    HB3  SER  66           HB1      SER  66 105.270   3.539   3.278
  539    HG   SER  66           HG       SER  66 104.422   4.210   4.923
  540    H    VAL  67           HN       VAL  67 107.036   3.247   6.577
  541    HA   VAL  67           HA       VAL  67 106.569   0.383   6.605
  542    HB   VAL  67           HB       VAL  67 108.980   0.401   6.717
  543   HG11  VAL  67          HG11      VAL  67 108.745   2.372   8.974
  544   HG12  VAL  67          HG12      VAL  67 109.343   2.699   7.344
  545   HG13  VAL  67          HG13      VAL  67 110.231   1.600   8.409
  546   HG21  VAL  67          HG21      VAL  67 109.411  -0.595   8.913
  547   HG22  VAL  67          HG22      VAL  67 107.893  -1.178   8.229
  548   HG23  VAL  67          HG23      VAL  67 107.876   0.043   9.499
  549    H    ASN  68           HN       ASN  68 104.782   0.235   7.627
  550    HA   ASN  68           HA       ASN  68 103.316   0.061   9.373
  551    HB2  ASN  68           HB2      ASN  68 105.366  -0.270  10.761
  552    HB3  ASN  68           HB1      ASN  68 105.415   1.459  11.042
  553   HD21  ASN  68          HD21      ASN  68 104.015  -1.543  11.965
  554   HD22  ASN  68          HD22      ASN  68 103.022  -0.922  13.203
  555    H    ASP  69           HN       ASP  69 104.943   2.974   9.830
  556    HA   ASP  69           HA       ASP  69 102.663   4.717   9.349
  557    HB2  ASP  69           HB2      ASP  69 102.166   4.243  11.646
  558    HB3  ASP  69           HB1      ASP  69 103.858   4.380  12.108
  559    H    THR  70           HN       THR  70 105.968   4.266  10.455
  560    HA   THR  70           HA       THR  70 106.884   6.890  10.150
  561    HB   THR  70           HB       THR  70 108.456   4.322   9.977
  562    HG1  THR  70           HG1      THR  70 107.233   5.657  12.134
  563   HG21  THR  70          HG21      THR  70 109.108   7.056  11.106
  564   HG22  THR  70          HG22      THR  70 109.668   6.434   9.556
  565   HG23  THR  70          HG23      THR  70 110.198   5.670  11.054
  566    H    CYS  71           HN       CYS  71 107.418   7.943   8.426
  567    HA   CYS  71           HA       CYS  71 107.343   6.651   5.864
  568    HB2  CYS  71           HB2      CYS  71 106.312   8.892   6.427
  569    HB3  CYS  71           HB1      CYS  71 107.947   9.515   6.550
  570    HG   CYS  71           HG       CYS  71 106.399   8.374   3.736
  571    H    VAL  72           HN       VAL  72 109.104   5.367   5.960
  572    HA   VAL  72           HA       VAL  72 111.689   6.378   6.669
  573    HB   VAL  72           HB       VAL  72 110.875   4.067   7.122
  574   HG11  VAL  72          HG11      VAL  72 109.740   3.545   5.130
  575   HG12  VAL  72          HG12      VAL  72 111.039   2.376   5.359
  576   HG13  VAL  72          HG13      VAL  72 111.219   3.684   4.186
  577   HG21  VAL  72          HG21      VAL  72 113.430   4.269   5.570
  578   HG22  VAL  72          HG22      VAL  72 112.975   2.910   6.599
  579   HG23  VAL  72          HG23      VAL  72 113.214   4.512   7.302
  580    H    LEU  73           HN       LEU  73 109.851   6.895   4.150
  581    HA   LEU  73           HA       LEU  73 111.421   6.651   1.824
  582    HB2  LEU  73           HB2      LEU  73 108.953   7.032   2.158
  583    HB3  LEU  73           HB1      LEU  73 109.345   8.671   2.600
  584    HG   LEU  73           HG       LEU  73 110.080   9.152   0.356
  585   HD11  LEU  73          HD11      LEU  73 111.133   7.055  -0.210
  586   HD12  LEU  73          HD12      LEU  73 109.827   7.336  -1.375
  587   HD13  LEU  73          HD13      LEU  73 109.611   6.209  -0.025
  588   HD21  LEU  73          HD21      LEU  73 107.522   7.577   0.423
  589   HD22  LEU  73          HD22      LEU  73 107.978   8.781  -0.782
  590   HD23  LEU  73          HD23      LEU  73 107.711   9.267   0.891
  591    H    GLY  74           HN       GLY  74 113.349   7.527   1.731
  592    HA2  GLY  74           HA2      GLY  74 115.005   9.136   1.731
  593    HA3  GLY  74           HA1      GLY  74 113.724  10.308   2.027
  594    H    HIS  75           HN       HIS  75 114.406   7.551   4.064
  595    HA   HIS  75           HA       HIS  75 114.693   9.263   6.346
  596    HB2  HIS  75           HB2      HIS  75 113.933   6.540   5.888
  597    HB3  HIS  75           HB1      HIS  75 115.459   6.559   6.768
  598    HD1  HIS  75           HD1      HIS  75 112.031   8.270   7.175
  599    HD2  HIS  75           HD2      HIS  75 115.169   6.591   9.284
  600    HE1  HIS  75           HE1      HIS  75 111.349   8.364   9.567
  601    H    THR  76           HN       THR  76 116.611   9.418   7.498
  602    HA   THR  76           HA       THR  76 119.002   9.228   5.932
  603    HB   THR  76           HB       THR  76 118.521   9.907   8.826
  604    HG1  THR  76           HG1      THR  76 117.455  11.359   7.450
  605   HG21  THR  76          HG21      THR  76 120.905  10.461   7.067
  606   HG22  THR  76          HG22      THR  76 120.841   9.367   8.458
  607   HG23  THR  76          HG23      THR  76 120.670  11.102   8.694
  608    H    HIS  77           HN       HIS  77 120.634   7.567   6.188
  609    HA   HIS  77           HA       HIS  77 120.095   5.102   6.976
  610    HB2  HIS  77           HB2      HIS  77 122.129   5.592   5.785
  611    HB3  HIS  77           HB1      HIS  77 122.784   6.432   7.188
  612    HD1  HIS  77           HD1      HIS  77 121.652   2.793   6.392
  613    HD2  HIS  77           HD2      HIS  77 124.441   4.925   8.639
  614    HE1  HIS  77           HE1      HIS  77 123.118   1.093   7.476
  615    H    ALA  78           HN       ALA  78 121.595   7.400   9.112
  616    HA   ALA  78           HA       ALA  78 121.874   5.672  11.306
  617    HB1  ALA  78           HB1      ALA  78 123.062   7.789  11.149
  618    HB2  ALA  78           HB2      ALA  78 122.160   7.682  12.667
  619    HB3  ALA  78           HB3      ALA  78 121.541   8.656  11.332
  620    H    GLN  79           HN       GLN  79 119.165   7.589  10.177
  621    HA   GLN  79           HA       GLN  79 117.708   7.280  12.570
  622    HB2  GLN  79           HB2      GLN  79 116.869   8.139   9.837
  623    HB3  GLN  79           HB1      GLN  79 115.754   8.101  11.182
  624    HG2  GLN  79           HG2      GLN  79 118.118   9.892  10.739
  625    HG3  GLN  79           HG1      GLN  79 116.427  10.348  10.963
  626   HE21  GLN  79          HE21      GLN  79 119.419   9.763  12.406
  627   HE22  GLN  79          HE22      GLN  79 118.945  10.014  14.030
  628    H    VAL  80           HN       VAL  80 117.540   5.905   9.311
  629    HA   VAL  80           HA       VAL  80 115.367   4.204   9.826
  630    HB   VAL  80           HB       VAL  80 115.859   4.733   7.488
  631   HG11  VAL  80          HG11      VAL  80 118.267   4.949   7.684
  632   HG12  VAL  80          HG12      VAL  80 117.795   3.936   6.321
  633   HG13  VAL  80          HG13      VAL  80 118.421   3.198   7.802
  634   HG21  VAL  80          HG21      VAL  80 116.356   1.812   8.014
  635   HG22  VAL  80          HG22      VAL  80 115.692   2.528   6.535
  636   HG23  VAL  80          HG23      VAL  80 114.783   2.594   8.037
  637    H    VAL  81           HN       VAL  81 118.819   3.603   9.994
  638    HA   VAL  81           HA       VAL  81 118.480   0.857  10.611
  639    HB   VAL  81           HB       VAL  81 120.685   1.809   9.800
  640   HG11  VAL  81          HG11      VAL  81 120.882   3.743  11.206
  641   HG12  VAL  81          HG12      VAL  81 122.286   2.695  11.408
  642   HG13  VAL  81          HG13      VAL  81 121.017   2.719  12.636
  643   HG21  VAL  81          HG21      VAL  81 120.567  -0.460  10.676
  644   HG22  VAL  81          HG22      VAL  81 120.849   0.148  12.308
  645   HG23  VAL  81          HG23      VAL  81 122.107   0.296  11.080
  646    H    LYS  82           HN       LYS  82 118.588   3.697  12.606
  647    HA   LYS  82           HA       LYS  82 118.726   2.510  15.105
  648    HB2  LYS  82           HB2      LYS  82 118.959   4.863  14.732
  649    HB3  LYS  82           HB1      LYS  82 117.312   4.954  14.136
  650    HG2  LYS  82           HG2      LYS  82 116.430   4.498  16.319
  651    HG3  LYS  82           HG1      LYS  82 118.046   4.198  16.956
  652    HD2  LYS  82           HD2      LYS  82 117.275   6.418  17.585
  653    HD3  LYS  82           HD1      LYS  82 118.660   6.500  16.493
  654    HE2  LYS  82           HE2      LYS  82 117.164   6.992  14.615
  655    HE3  LYS  82           HE1      LYS  82 115.767   6.868  15.685
  656    HZ1  LYS  82           HZ1      LYS  82 116.533   8.786  16.886
  657    HZ2  LYS  82           HZ2      LYS  82 116.508   9.198  15.244
  658    HZ3  LYS  82           HZ3      LYS  82 117.954   8.856  15.999
  659    H    ILE  83           HN       ILE  83 115.893   3.139  13.047
  660    HA   ILE  83           HA       ILE  83 114.011   2.394  15.083
  661    HB   ILE  83           HB       ILE  83 113.682   2.929  12.119
  662   HG12  ILE  83          HG12      ILE  83 113.023   4.611  14.550
  663   HG13  ILE  83          HG11      ILE  83 114.381   4.864  13.464
  664   HG21  ILE  83          HG21      ILE  83 111.543   2.523  14.211
  665   HG22  ILE  83          HG22      ILE  83 111.897   1.440  12.865
  666   HG23  ILE  83          HG23      ILE  83 111.257   3.053  12.552
  667   HD11  ILE  83          HD11      ILE  83 112.584   6.425  13.024
  668   HD12  ILE  83          HD12      ILE  83 111.472   5.082  12.753
  669   HD13  ILE  83          HD13      ILE  83 112.824   5.346  11.648
  670    H    PHE  84           HN       PHE  84 115.175   1.061  12.112
  671    HA   PHE  84           HA       PHE  84 113.652  -1.246  12.043
  672    HB2  PHE  84           HB2      PHE  84 116.070  -0.221  10.721
  673    HB3  PHE  84           HB1      PHE  84 115.714  -1.920  10.549
  674    HD1  PHE  84           HD2      PHE  84 113.796   1.294  10.464
  675    HD2  PHE  84           HD1      PHE  84 114.586  -2.438   8.594
  676    HE1  PHE  84           HE2      PHE  84 112.186   1.836   8.707
  677    HE2  PHE  84           HE1      PHE  84 112.971  -1.908   6.834
  678    HZ   PHE  84           HZ       PHE  84 111.758   0.210   6.883
  679    H    GLN  85           HN       GLN  85 116.862  -0.668  13.421
  680    HA   GLN  85           HA       GLN  85 117.062  -3.453  14.083
  681    HB2  GLN  85           HB2      GLN  85 118.926  -1.129  14.551
  682    HB3  GLN  85           HB1      GLN  85 119.308  -2.791  15.030
  683    HG2  GLN  85           HG2      GLN  85 118.705  -1.856  12.233
  684    HG3  GLN  85           HG1      GLN  85 120.320  -2.060  12.898
  685   HE21  GLN  85          HE21      GLN  85 121.153  -4.071  13.110
  686   HE22  GLN  85          HE22      GLN  85 120.420  -5.480  12.423
  687    H    SER  86           HN       SER  86 115.753  -0.682  15.605
  688    HA   SER  86           HA       SER  86 115.960  -1.884  18.244
  689    HB2  SER  86           HB2      SER  86 114.583   0.679  17.389
  690    HB3  SER  86           HB1      SER  86 114.760   0.125  19.057
  691    HG   SER  86           HG       SER  86 116.661   1.055  17.242
  692    H    ILE  87           HN       ILE  87 114.018  -2.243  15.601
  693    HA   ILE  87           HA       ILE  87 111.520  -2.677  16.501
  694    HB   ILE  87           HB       ILE  87 113.217  -3.847  14.375
  695   HG12  ILE  87          HG12      ILE  87 110.702  -2.244  14.466
  696   HG13  ILE  87          HG11      ILE  87 112.242  -1.868  13.698
  697   HG21  ILE  87          HG21      ILE  87 112.112  -5.858  15.005
  698   HG22  ILE  87          HG22      ILE  87 111.443  -5.176  13.489
  699   HG23  ILE  87          HG23      ILE  87 110.557  -4.991  14.992
  700   HD11  ILE  87          HD11      ILE  87 111.750  -3.702  12.016
  701   HD12  ILE  87          HD12      ILE  87 110.604  -2.362  11.983
  702   HD13  ILE  87          HD13      ILE  87 110.177  -3.867  12.788
  703    HA   PRO  88           HA       PRO  88 111.956  -6.285  19.250
  704    HB2  PRO  88           HB2      PRO  88 109.423  -6.315  20.078
  705    HB3  PRO  88           HB1      PRO  88 110.496  -4.977  20.498
  706    HG2  PRO  88           HG2      PRO  88 108.203  -5.014  18.642
  707    HG3  PRO  88           HG1      PRO  88 108.976  -3.636  19.432
  708    HD2  PRO  88           HD2      PRO  88 109.415  -4.658  16.723
  709    HD3  PRO  88           HD1      PRO  88 110.015  -3.180  17.430
  710    H    ILE  89           HN       ILE  89 111.556  -8.386  19.328
  711    HA   ILE  89           HA       ILE  89 110.731  -9.831  17.045
  712    HB   ILE  89           HB       ILE  89 110.877 -10.893  19.871
  713   HG12  ILE  89          HG12      ILE  89 113.110 -10.526  17.884
  714   HG13  ILE  89          HG11      ILE  89 112.908  -9.610  19.360
  715   HG21  ILE  89          HG21      ILE  89 111.525 -12.982  18.759
  716   HG22  ILE  89          HG22      ILE  89 111.337 -12.183  17.192
  717   HG23  ILE  89          HG23      ILE  89 109.932 -12.417  18.236
  718   HD11  ILE  89          HD11      ILE  89 114.588 -11.268  19.583
  719   HD12  ILE  89          HD12      ILE  89 113.446 -12.541  19.142
  720   HD13  ILE  89          HD13      ILE  89 113.230 -11.620  20.657
  721    H    GLY  90           HN       GLY  90 108.712 -10.672  16.501
  722    HA2  GLY  90           HA2      GLY  90 106.650 -11.667  16.994
  723    HA3  GLY  90           HA1      GLY  90 106.732 -10.990  18.615
  724    H    ALA  91           HN       ALA  91 107.478  -8.891  16.095
  725    HA   ALA  91           HA       ALA  91 104.890  -7.559  16.677
  726    HB1  ALA  91           HB1      ALA  91 106.095  -5.343  16.254
  727    HB2  ALA  91           HB2      ALA  91 107.613  -6.263  16.291
  728    HB3  ALA  91           HB3      ALA  91 106.571  -6.232  17.681
  729    H    SER  92           HN       SER  92 104.972  -5.515  14.711
  730    HA   SER  92           HA       SER  92 104.954  -6.884  12.145
  731    HB2  SER  92           HB2      SER  92 103.002  -7.746  12.899
  732    HB3  SER  92           HB1      SER  92 102.446  -6.240  13.667
  733    HG   SER  92           HG       SER  92 101.737  -5.597  11.784
  734    H    VAL  93           HN       VAL  93 105.012  -5.612  10.460
  735    HA   VAL  93           HA       VAL  93 104.153  -2.849  10.617
  736    HB   VAL  93           HB       VAL  93 106.121  -1.921   9.542
  737   HG11  VAL  93          HG11      VAL  93 106.913  -3.199  12.131
  738   HG12  VAL  93          HG12      VAL  93 105.995  -1.711  11.910
  739   HG13  VAL  93          HG13      VAL  93 107.669  -1.793  11.353
  740   HG21  VAL  93          HG21      VAL  93 107.098  -3.619   8.382
  741   HG22  VAL  93          HG22      VAL  93 107.072  -4.674   9.764
  742   HG23  VAL  93          HG23      VAL  93 108.269  -3.345   9.698
  743    H    ASP  94           HN       ASP  94 103.916  -1.867   8.734
  744    HA   ASP  94           HA       ASP  94 103.368  -3.727   6.573
  745    HB2  ASP  94           HB2      ASP  94 102.226  -1.087   7.366
  746    HB3  ASP  94           HB1      ASP  94 101.918  -1.811   5.804
  747    H    LEU  95           HN       LEU  95 104.817  -3.645   5.127
  748    HA   LEU  95           HA       LEU  95 106.429  -1.249   4.747
  749    HB2  LEU  95           HB2      LEU  95 106.687  -3.959   3.427
  750    HB3  LEU  95           HB1      LEU  95 107.731  -2.597   3.116
  751    HG   LEU  95           HG       LEU  95 108.931  -4.065   4.487
  752   HD11  LEU  95          HD11      LEU  95 109.212  -1.765   5.155
  753   HD12  LEU  95          HD12      LEU  95 109.308  -2.851   6.550
  754   HD13  LEU  95          HD13      LEU  95 107.846  -1.925   6.263
  755   HD21  LEU  95          HD21      LEU  95 106.555  -4.164   6.316
  756   HD22  LEU  95          HD22      LEU  95 108.133  -4.897   6.622
  757   HD23  LEU  95          HD23      LEU  95 107.142  -5.450   5.256
  758    H    GLU  96           HN       GLU  96 105.859   0.136   3.402
  759    HA   GLU  96           HA       GLU  96 104.143  -0.573   1.148
  760    HB2  GLU  96           HB2      GLU  96 105.041   2.185   1.987
  761    HB3  GLU  96           HB1      GLU  96 103.645   1.765   1.009
  762    HG2  GLU  96           HG2      GLU  96 102.664   0.615   3.000
  763    HG3  GLU  96           HG1      GLU  96 103.968   1.298   3.959
  764    H    LEU  97           HN       LEU  97 105.287  -1.112  -0.570
  765    HA   LEU  97           HA       LEU  97 107.829   0.175  -1.016
  766    HB2  LEU  97           HB2      LEU  97 109.098  -1.861  -1.092
  767    HB3  LEU  97           HB1      LEU  97 108.331  -1.710   0.457
  768    HG   LEU  97           HG       LEU  97 107.859  -3.779  -1.703
  769   HD11  LEU  97          HD11      LEU  97 109.533  -4.253  -0.096
  770   HD12  LEU  97          HD12      LEU  97 108.129  -5.285   0.223
  771   HD13  LEU  97          HD13      LEU  97 108.440  -3.873   1.222
  772   HD21  LEU  97          HD21      LEU  97 106.035  -3.339   0.668
  773   HD22  LEU  97          HD22      LEU  97 105.940  -4.650  -0.515
  774   HD23  LEU  97          HD23      LEU  97 105.603  -2.986  -1.004
  775    H    CYS  98           HN       CYS  98 108.703  -0.242  -3.079
  776    HA   CYS  98           HA       CYS  98 106.586  -0.844  -4.995
  777    HB2  CYS  98           HB2      CYS  98 108.996   0.944  -5.332
  778    HB3  CYS  98           HB1      CYS  98 107.743   0.662  -6.538
  779    HG   CYS  98           HG       CYS  98 106.895   3.033  -5.713
  780    H    ARG  99           HN       ARG  99 106.819  -2.423  -6.269
  781    HA   ARG  99           HA       ARG  99 109.315  -3.991  -6.328
  782    HB2  ARG  99           HB2      ARG  99 107.252  -5.098  -5.559
  783    HB3  ARG  99           HB1      ARG  99 106.460  -4.687  -7.068
  784    HG2  ARG  99           HG2      ARG  99 107.066  -6.947  -7.221
  785    HG3  ARG  99           HG1      ARG  99 108.241  -6.071  -8.206
  786    HD2  ARG  99           HD2      ARG  99 109.373  -7.743  -6.815
  787    HD3  ARG  99           HD1      ARG  99 109.790  -6.089  -6.307
  788    HE   ARG  99           HE       ARG  99 108.667  -6.318  -4.408
  789   HH11  ARG  99          HH11      ARG  99 108.226  -9.283  -6.279
  790   HH12  ARG  99          HH12      ARG  99 107.512 -10.113  -4.978
  791   HH21  ARG  99          HH21      ARG  99 107.754  -7.339  -2.796
  792   HH22  ARG  99          HH22      ARG  99 107.211  -8.988  -2.904
  793    H    GLY 100           HN       GLY 100 110.057  -4.694  -8.451
  794    HA2  GLY 100           HA2      GLY 100 109.357  -4.772 -10.838
  795    HA3  GLY 100           HA1      GLY 100 108.902  -3.083 -10.631
  796    H    TYR 101           HN       TYR 101 111.450  -3.313  -8.760
  797    HA   TYR 101           HA       TYR 101 113.216  -2.362 -10.811
  798    HB2  TYR 101           HB2      TYR 101 113.250  -2.291  -7.813
  799    HB3  TYR 101           HB1      TYR 101 114.717  -1.925  -8.706
  800    HD1  TYR 101           HD2      TYR 101 111.219  -0.871  -8.134
  801    HD2  TYR 101           HD1      TYR 101 114.990   0.137  -9.817
  802    HE1  TYR 101           HE2      TYR 101 110.438   1.425  -8.510
  803    HE2  TYR 101           HE1      TYR 101 114.215   2.432 -10.205
  804    HH   TYR 101           HH       TYR 101 112.200   3.640 -10.467
  805    HA   PRO 102           HA       PRO 102 115.040  -6.465 -10.919
  806    HB2  PRO 102           HB2      PRO 102 116.713  -5.295 -13.019
  807    HB3  PRO 102           HB1      PRO 102 115.573  -6.632 -13.148
  808    HG2  PRO 102           HG2      PRO 102 115.106  -4.246 -14.300
  809    HG3  PRO 102           HG1      PRO 102 113.801  -5.246 -13.642
  810    HD2  PRO 102           HD2      PRO 102 115.127  -2.848 -12.444
  811    HD3  PRO 102           HD1      PRO 102 113.408  -3.311 -12.486
  812    H    LEU 103           HN       LEU 103 117.072  -7.204 -10.239
  813    HA   LEU 103           HA       LEU 103 118.752  -5.143  -9.029
  814    HB2  LEU 103           HB2      LEU 103 117.730  -7.477  -8.052
  815    HB3  LEU 103           HB1      LEU 103 119.288  -8.023  -8.635
  816    HG   LEU 103           HG       LEU 103 119.373  -7.550  -6.253
  817   HD11  LEU 103          HD11      LEU 103 121.248  -6.021  -6.178
  818   HD12  LEU 103          HD12      LEU 103 120.897  -5.506  -7.829
  819   HD13  LEU 103          HD13      LEU 103 121.392  -7.168  -7.509
  820   HD21  LEU 103          HD21      LEU 103 119.084  -5.274  -5.397
  821   HD22  LEU 103          HD22      LEU 103 117.597  -5.914  -6.097
  822   HD23  LEU 103          HD23      LEU 103 118.559  -4.741  -6.991
  823    HA   PRO 104           HA       PRO 104 121.143  -6.114 -12.766
  824    HB2  PRO 104           HB2      PRO 104 122.359  -3.763 -13.045
  825    HB3  PRO 104           HB1      PRO 104 120.628  -3.942 -13.355
  826    HG2  PRO 104           HG2      PRO 104 122.016  -2.734 -11.015
  827    HG3  PRO 104           HG1      PRO 104 120.486  -2.276 -11.773
  828    HD2  PRO 104           HD2      PRO 104 120.790  -3.833  -9.446
  829    HD3  PRO 104           HD1      PRO 104 119.303  -3.644 -10.391
  830    H    PHE 105           HN       PHE 105 122.171  -6.706  -9.971
  831    HA   PHE 105           HA       PHE 105 124.866  -7.179 -10.687
  832    HB2  PHE 105           HB2      PHE 105 125.917  -5.922  -8.825
  833    HB3  PHE 105           HB1      PHE 105 125.172  -4.860 -10.006
  834    HD1  PHE 105           HD1      PHE 105 123.228  -3.518  -9.385
  835    HD2  PHE 105           HD2      PHE 105 125.117  -6.074  -6.562
  836    HE1  PHE 105           HE1      PHE 105 122.095  -2.329  -7.556
  837    HE2  PHE 105           HE2      PHE 105 123.981  -4.900  -4.726
  838    HZ   PHE 105           HZ       PHE 105 122.467  -3.019  -5.220
  839    H    ASP 106           HN       ASP 106 126.007  -8.258  -8.808
  840    HA   ASP 106           HA       ASP 106 124.065  -9.917  -7.466
  841    HB2  ASP 106           HB2      ASP 106 125.953 -11.024  -8.500
  842    HB3  ASP 106           HB1      ASP 106 127.043 -10.044  -7.456
  843    HA   PRO 107           HA       PRO 107 124.768  -7.277  -4.086
  844    HB2  PRO 107           HB2      PRO 107 122.558  -8.269  -2.778
  845    HB3  PRO 107           HB1      PRO 107 122.511  -7.148  -4.148
  846    HG2  PRO 107           HG2      PRO 107 121.521  -9.845  -4.189
  847    HG3  PRO 107           HG1      PRO 107 121.775  -8.779  -5.592
  848    HD2  PRO 107           HD2      PRO 107 123.689 -10.723  -4.389
  849    HD3  PRO 107           HD1      PRO 107 123.293 -10.596  -6.033
  850    H    ASP 108           HN       ASP 108 125.531 -10.446  -4.115
  851    HA   ASP 108           HA       ASP 108 125.581 -10.752  -1.356
  852    HB2  ASP 108           HB2      ASP 108 125.093 -12.760  -2.645
  853    HB3  ASP 108           HB1      ASP 108 126.612 -12.609  -3.519
  854    H    ASP 109           HN       ASP 109 127.443 -10.356  -4.158
  855    HA   ASP 109           HA       ASP 109 130.092 -10.118  -3.397
  856    HB2  ASP 109           HB2      ASP 109 129.393 -10.120  -5.720
  857    HB3  ASP 109           HB1      ASP 109 128.469  -8.645  -5.484
  858    HA   PRO 110           HA       PRO 110 130.591  -6.773  -0.385
  859    HB2  PRO 110           HB2      PRO 110 132.394  -6.481  -2.660
  860    HB3  PRO 110           HB1      PRO 110 132.594  -5.883  -1.021
  861    HG2  PRO 110           HG2      PRO 110 133.620  -8.275  -1.602
  862    HG3  PRO 110           HG1      PRO 110 132.518  -8.231  -0.203
  863    HD2  PRO 110           HD2      PRO 110 131.991  -9.208  -2.972
  864    HD3  PRO 110           HD1      PRO 110 131.270  -9.747  -1.434
  865    H    ASN 111           HN       ASN 111 128.595  -5.439  -1.103
  866    HA   ASN 111           HA       ASN 111 129.700  -3.404  -2.700
  867    HB2  ASN 111           HB2      ASN 111 126.802  -4.216  -2.975
  868    HB3  ASN 111           HB1      ASN 111 127.575  -2.856  -3.790
  869   HD21  ASN 111          HD21      ASN 111 130.013  -4.447  -4.221
  870   HD22  ASN 111          HD22      ASN 111 129.719  -5.636  -5.418
  871    H    THR 112           HN       THR 112 130.190  -2.340  -0.920
  872    HA   THR 112           HA       THR 112 128.195  -1.409   0.923
  873    HB   THR 112           HB       THR 112 130.655  -1.734   1.548
  874    HG1  THR 112           HG1      THR 112 129.230  -0.429   2.791
  875   HG21  THR 112          HG21      THR 112 131.660  -0.726  -0.471
  876   HG22  THR 112          HG22      THR 112 132.233   0.083   0.988
  877   HG23  THR 112          HG23      THR 112 130.991   0.836  -0.009
  878    H    SER 113           HN       SER 113 128.468   1.229   1.220
  879    HA   SER 113           HA       SER 113 127.123   2.375  -0.964
  880    HB2  SER 113           HB2      SER 113 127.954   4.359   0.663
  881    HB3  SER 113           HB1      SER 113 126.472   3.445   0.901
  882    HG   SER 113           HG       SER 113 128.901   3.351   2.221
  883    H    LEU 114           HN       LEU 114 128.069   2.767  -2.798
  884    HA   LEU 114           HA       LEU 114 130.618   3.970  -2.869
  885    HB2  LEU 114           HB2      LEU 114 130.142   4.266  -5.296
  886    HB3  LEU 114           HB1      LEU 114 129.915   2.622  -4.786
  887    HG   LEU 114           HG       LEU 114 128.302   3.028  -6.386
  888   HD11  LEU 114          HD11      LEU 114 126.147   2.769  -5.473
  889   HD12  LEU 114          HD12      LEU 114 126.691   3.322  -3.909
  890   HD13  LEU 114          HD13      LEU 114 127.328   1.806  -4.581
  891   HD21  LEU 114          HD21      LEU 114 127.593   5.548  -4.997
  892   HD22  LEU 114          HD22      LEU 114 126.714   4.922  -6.403
  893   HD23  LEU 114          HD23      LEU 114 128.415   5.426  -6.552
  894    H    VAL 115           HN       VAL 115 130.920   6.050  -2.406
  895    HA   VAL 115           HA       VAL 115 128.415   7.412  -1.900
  896    HB   VAL 115           HB       VAL 115 129.401   6.658   0.159
  897   HG11  VAL 115          HG11      VAL 115 131.719   6.616  -0.398
  898   HG12  VAL 115          HG12      VAL 115 131.467   7.592   1.052
  899   HG13  VAL 115          HG13      VAL 115 131.758   8.374  -0.503
  900   HG21  VAL 115          HG21      VAL 115 129.399   8.777   1.426
  901   HG22  VAL 115          HG22      VAL 115 128.075   8.644   0.265
  902   HG23  VAL 115          HG23      VAL 115 129.465   9.663  -0.107
  903    H    THR 116           HN       THR 116 128.016   9.171  -2.905
  904    HA   THR 116           HA       THR 116 130.225  10.822  -3.790
  905    HB   THR 116           HB       THR 116 128.306  10.298  -5.410
  906    HG1  THR 116           HG1      THR 116 129.067  12.067  -6.204
  907   HG21  THR 116          HG21      THR 116 126.199  11.550  -5.127
  908   HG22  THR 116          HG22      THR 116 126.798  12.144  -3.572
  909   HG23  THR 116          HG23      THR 116 126.455  10.426  -3.778
  910    H    SER 117           HN       SER 117 130.366  12.945  -2.983
  911    HA   SER 117           HA       SER 117 128.552  13.709  -0.908
  912    HB2  SER 117           HB2      SER 117 131.478  13.229  -0.313
  913    HB3  SER 117           HB1      SER 117 130.359  14.047   0.775
  914    HG   SER 117           HG       SER 117 129.219  11.804   0.044
  915    H    VAL 118           HN       VAL 118 128.548  15.858  -0.577
  916    HA   VAL 118           HA       VAL 118 130.074  17.461  -2.472
  917    HB   VAL 118           HB       VAL 118 127.872  18.308  -0.539
  918   HG11  VAL 118          HG11      VAL 118 129.024  19.739  -2.931
  919   HG12  VAL 118          HG12      VAL 118 129.261  20.163  -1.236
  920   HG13  VAL 118          HG13      VAL 118 127.660  20.289  -1.959
  921   HG21  VAL 118          HG21      VAL 118 127.641  17.643  -3.472
  922   HG22  VAL 118          HG22      VAL 118 126.350  18.293  -2.459
  923   HG23  VAL 118          HG23      VAL 118 127.003  16.686  -2.136
  924    H    ALA 119           HN       ALA 119 132.088  17.780  -1.649
  925    HA   ALA 119           HA       ALA 119 132.487  17.889   1.191
  926    HB1  ALA 119           HB1      ALA 119 134.468  18.252  -1.053
  927    HB2  ALA 119           HB2      ALA 119 134.076  16.713  -0.294
  928    HB3  ALA 119           HB3      ALA 119 134.865  17.985   0.643
  929    H    ILE 120           HN       ILE 120 131.137  19.613   1.355
  930    HA   ILE 120           HA       ILE 120 132.491  22.229   1.377
  931    HB   ILE 120           HB       ILE 120 129.635  21.737   0.483
  932   HG12  ILE 120          HG12      ILE 120 131.178  21.144  -1.329
  933   HG13  ILE 120          HG11      ILE 120 130.256  22.578  -1.748
  934   HG21  ILE 120          HG21      ILE 120 129.536  24.160  -0.019
  935   HG22  ILE 120          HG22      ILE 120 131.142  24.339   0.695
  936   HG23  ILE 120          HG23      ILE 120 129.786  23.811   1.693
  937   HD11  ILE 120          HD11      ILE 120 132.566  22.760  -2.457
  938   HD12  ILE 120          HD12      ILE 120 133.103  22.488  -0.799
  939   HD13  ILE 120          HD13      ILE 120 132.198  23.952  -1.207
  940    H    LEU 121           HN       LEU 121 129.947  20.037   2.339
  941    HA   LEU 121           HA       LEU 121 129.173  21.510   4.710
  942    HB2  LEU 121           HB2      LEU 121 128.393  18.802   3.662
  943    HB3  LEU 121           HB1      LEU 121 127.642  19.635   5.003
  944    HG   LEU 121           HG       LEU 121 127.629  20.558   2.158
  945   HD11  LEU 121          HD11      LEU 121 125.477  19.311   3.863
  946   HD12  LEU 121          HD12      LEU 121 126.325  18.528   2.535
  947   HD13  LEU 121          HD13      LEU 121 125.259  19.904   2.210
  948   HD21  LEU 121          HD21      LEU 121 125.966  22.181   2.960
  949   HD22  LEU 121          HD22      LEU 121 127.541  22.392   3.728
  950   HD23  LEU 121          HD23      LEU 121 126.234  21.604   4.608
  951    H    ASP 122           HN       ASP 122 128.821  19.868   6.568
  952    HA   ASP 122           HA       ASP 122 131.395  18.841   7.328
  953    HB2  ASP 122           HB2      ASP 122 130.042  19.965   9.025
  954    HB3  ASP 122           HB1      ASP 122 128.743  18.798   8.800
  955    H    LYS 123           HN       LYS 123 131.738  17.377   5.980
  956    HA   LYS 123           HA       LYS 123 130.504  15.405   4.742
  957    HB2  LYS 123           HB2      LYS 123 133.179  15.041   6.087
  958    HB3  LYS 123           HB1      LYS 123 132.512  13.940   4.906
  959    HG2  LYS 123           HG2      LYS 123 134.063  15.219   3.727
  960    HG3  LYS 123           HG1      LYS 123 132.512  15.930   3.303
  961    HD2  LYS 123           HD2      LYS 123 132.892  17.808   4.708
  962    HD3  LYS 123           HD1      LYS 123 134.276  17.024   5.494
  963    HE2  LYS 123           HE2      LYS 123 134.083  17.919   2.621
  964    HE3  LYS 123           HE1      LYS 123 134.927  18.775   3.905
  965    HZ1  LYS 123           HZ1      LYS 123 135.629  16.094   2.824
  966    HZ2  LYS 123           HZ2      LYS 123 136.349  16.766   4.154
  967    HZ3  LYS 123           HZ3      LYS 123 136.535  17.503   2.662
  968    H    GLU 124           HN       GLU 124 129.164  14.045   5.277
  969    HA   GLU 124           HA       GLU 124 129.016  12.906   7.943
  970    HB2  GLU 124           HB2      GLU 124 127.022  13.748   6.616
  971    HB3  GLU 124           HB1      GLU 124 127.230  12.345   5.581
  972    HG2  GLU 124           HG2      GLU 124 125.523  11.919   7.153
  973    HG3  GLU 124           HG1      GLU 124 126.908  10.892   7.540
  974    HA   PRO 125           HA       PRO 125 131.491   9.480   6.320
  975    HB2  PRO 125           HB2      PRO 125 131.116   8.258   8.956
  976    HB3  PRO 125           HB1      PRO 125 132.602   8.823   8.193
  977    HG2  PRO 125           HG2      PRO 125 131.496  10.096  10.300
  978    HG3  PRO 125           HG1      PRO 125 132.381  10.952   9.027
  979    HD2  PRO 125           HD2      PRO 125 129.429  10.679   9.423
  980    HD3  PRO 125           HD1      PRO 125 130.404  12.095   8.953
  981    H1   ARG 151           HT1      ARG 151 116.434  13.902  -6.185
  982    H2   ARG 151           HT2      ARG 151 117.577  12.985  -5.287
  983    H3   ARG 151           HT3      ARG 151 117.629  13.028  -6.971
  984    HA   ARG 151           HA       ARG 151 117.880  15.468  -6.780
  985    HB2  ARG 151           HB2      ARG 151 118.659  14.651  -3.973
  986    HB3  ARG 151           HB1      ARG 151 119.104  16.187  -4.703
  987    HG2  ARG 151           HG2      ARG 151 116.756  16.780  -4.918
  988    HG3  ARG 151           HG1      ARG 151 116.292  15.222  -4.243
  989    HD2  ARG 151           HD2      ARG 151 117.281  15.786  -2.122
  990    HD3  ARG 151           HD1      ARG 151 117.961  17.274  -2.789
  991    HE   ARG 151           HE       ARG 151 115.410  17.663  -3.274
  992   HH11  ARG 151          HH11      ARG 151 116.822  16.453  -0.228
  993   HH12  ARG 151          HH12      ARG 151 115.648  17.194   0.747
  994   HH21  ARG 151          HH21      ARG 151 113.841  18.615  -1.948
  995   HH22  ARG 151          HH22      ARG 151 113.885  18.457  -0.248
  996    H    SER 152           HN       SER 152 120.264  13.441  -4.932
  997    HA   SER 152           HA       SER 152 121.797  13.257  -7.390
  998    HB2  SER 152           HB2      SER 152 122.899  14.870  -5.090
  999    HB3  SER 152           HB1      SER 152 123.772  14.433  -6.554
 1000    HG   SER 152           HG       SER 152 121.598  15.515  -7.400
 1001    H    SER 153           HN       SER 153 121.487  12.503  -3.949
 1002    HA   SER 153           HA       SER 153 123.901  10.994  -3.970
 1003    HB2  SER 153           HB2      SER 153 121.780  11.264  -1.867
 1004    HB3  SER 153           HB1      SER 153 123.410  10.625  -1.652
 1005    HG   SER 153           HG       SER 153 122.780  12.941  -1.174
 1006    H    ARG 154           HN       ARG 154 124.040   9.014  -4.623
 1007    HA   ARG 154           HA       ARG 154 121.915   7.143  -4.011
 1008    HB2  ARG 154           HB2      ARG 154 123.490   7.319  -6.599
 1009    HB3  ARG 154           HB1      ARG 154 122.581   5.897  -6.108
 1010    HG2  ARG 154           HG2      ARG 154 121.455   8.629  -6.660
 1011    HG3  ARG 154           HG1      ARG 154 121.298   7.199  -7.686
 1012    HD2  ARG 154           HD2      ARG 154 120.126   6.047  -5.844
 1013    HD3  ARG 154           HD1      ARG 154 120.218   7.520  -4.887
 1014    HE   ARG 154           HE       ARG 154 118.716   7.175  -7.359
 1015   HH11  ARG 154          HH11      ARG 154 119.327   9.053  -4.424
 1016   HH12  ARG 154          HH12      ARG 154 117.789   9.756  -4.358
 1017   HH21  ARG 154          HH21      ARG 154 116.627   8.142  -7.327
 1018   HH22  ARG 154          HH22      ARG 154 116.169   9.243  -6.129
 1019    H    THR 155           HN       THR 155 123.774   7.820  -2.393
 1020    HA   THR 155           HA       THR 155 126.265   6.567  -2.431
 1021    HB   THR 155           HB       THR 155 126.012   7.032   0.051
 1022    HG1  THR 155           HG1      THR 155 124.122   7.615   0.728
 1023   HG21  THR 155          HG21      THR 155 126.042   9.441  -0.258
 1024   HG22  THR 155          HG22      THR 155 125.347   9.255  -1.873
 1025   HG23  THR 155          HG23      THR 155 126.969   8.650  -1.532
 1026    H    ARG 156           HN       ARG 156 123.216   5.849  -0.936
 1027    HA   ARG 156           HA       ARG 156 122.310   4.136   0.051
 1028    HB2  ARG 156           HB2      ARG 156 122.206   2.011  -1.371
 1029    HB3  ARG 156           HB1      ARG 156 121.518   3.501  -1.968
 1030    HG2  ARG 156           HG2      ARG 156 123.639   3.812  -3.288
 1031    HG3  ARG 156           HG1      ARG 156 124.046   2.149  -2.843
 1032    HD2  ARG 156           HD2      ARG 156 122.855   2.413  -5.032
 1033    HD3  ARG 156           HD1      ARG 156 122.086   1.306  -3.884
 1034    HE   ARG 156           HE       ARG 156 121.145   4.045  -3.762
 1035   HH11  ARG 156          HH11      ARG 156 120.682   0.981  -5.421
 1036   HH12  ARG 156          HH12      ARG 156 118.979   1.106  -5.516
 1037   HH21  ARG 156          HH21      ARG 156 118.880   4.310  -3.920
 1038   HH22  ARG 156          HH22      ARG 156 117.900   3.150  -4.672
 1039    H    ARG 157           HN       ARG 157 122.844   3.676   1.903
 1040    HA   ARG 157           HA       ARG 157 125.328   2.300   2.515
 1041    HB2  ARG 157           HB2      ARG 157 123.034   3.026   4.339
 1042    HB3  ARG 157           HB1      ARG 157 124.680   2.645   4.809
 1043    HG2  ARG 157           HG2      ARG 157 123.860   5.063   3.218
 1044    HG3  ARG 157           HG1      ARG 157 124.122   5.038   4.959
 1045    HD2  ARG 157           HD2      ARG 157 126.451   4.447   4.612
 1046    HD3  ARG 157           HD1      ARG 157 126.194   4.382   2.868
 1047    HE   ARG 157           HE       ARG 157 125.459   6.766   3.127
 1048   HH11  ARG 157          HH11      ARG 157 127.951   5.331   5.212
 1049   HH12  ARG 157          HH12      ARG 157 128.761   6.784   5.515
 1050   HH21  ARG 157          HH21      ARG 157 126.620   8.783   3.508
 1051   HH22  ARG 157          HH22      ARG 157 128.024   8.771   4.502
 1052    H    GLU 158           HN       GLU 158 125.288   0.252   3.740
 1053    HA   GLU 158           HA       GLU 158 123.067  -1.344   2.828
 1054    HB2  GLU 158           HB2      GLU 158 124.483  -3.307   3.144
 1055    HB3  GLU 158           HB1      GLU 158 125.317  -2.122   2.166
 1056    HG2  GLU 158           HG2      GLU 158 125.842  -2.632   5.097
 1057    HG3  GLU 158           HG1      GLU 158 126.764  -3.320   3.776
 1058    H    THR 159           HN       THR 159 121.592  -0.672   4.349
 1059    HA   THR 159           HA       THR 159 122.089  -1.086   7.153
 1060    HB   THR 159           HB       THR 159 119.361  -0.801   5.825
 1061    HG1  THR 159           HG1      THR 159 120.009   1.116   5.208
 1062   HG21  THR 159          HG21      THR 159 118.736   0.278   7.989
 1063   HG22  THR 159          HG22      THR 159 120.380   0.076   8.557
 1064   HG23  THR 159          HG23      THR 159 119.388  -1.334   8.285
 1065    H    GLN 160           HN       GLN 160 122.375  -3.160   7.794
 1066    HA   GLN 160           HA       GLN 160 121.066  -5.238   6.275
 1067    HB2  GLN 160           HB2      GLN 160 123.180  -5.417   8.428
 1068    HB3  GLN 160           HB1      GLN 160 122.508  -6.805   7.574
 1069    HG2  GLN 160           HG2      GLN 160 123.312  -5.932   5.466
 1070    HG3  GLN 160           HG1      GLN 160 123.976  -4.513   6.273
 1071   HE21  GLN 160          HE21      GLN 160 124.918  -6.206   8.542
 1072   HE22  GLN 160          HE22      GLN 160 126.312  -7.012   7.934
 1073    H    VAL 161           HN       VAL 161 119.010  -5.306   6.782
 1074    HA   VAL 161           HA       VAL 161 118.328  -5.579   9.578
 1075    HB   VAL 161           HB       VAL 161 115.978  -4.838   8.773
 1076   HG11  VAL 161          HG11      VAL 161 118.309  -2.990   8.715
 1077   HG12  VAL 161          HG12      VAL 161 117.292  -3.450  10.120
 1078   HG13  VAL 161          HG13      VAL 161 116.615  -2.503   8.777
 1079   HG21  VAL 161          HG21      VAL 161 116.360  -5.044   6.365
 1080   HG22  VAL 161          HG22      VAL 161 117.623  -3.818   6.458
 1081   HG23  VAL 161          HG23      VAL 161 115.946  -3.384   6.801
  Start of MODEL    3
    1    H1   GLY  -3           HT1      GLY  -3 123.971  18.512 -17.354
    2    H2   GLY  -3           HT2      GLY  -3 124.680  19.175 -16.001
    3    H3   GLY  -3           HT3      GLY  -3 125.579  19.012 -17.423
    4    HA2  GLY  -3           HA1      GLY  -3 124.904  21.301 -17.125
    5    HA3  GLY  -3           HA2      GLY  -3 124.100  20.595 -18.524
    6    H    ALA  -2           HN       ALA  -2 121.900  19.647 -18.094
    7    HA   ALA  -2           HA       ALA  -2 120.555  20.827 -15.813
    8    HB1  ALA  -2           HB1      ALA  -2 118.764  21.710 -17.237
    9    HB2  ALA  -2           HB2      ALA  -2 119.665  21.227 -18.673
   10    HB3  ALA  -2           HB3      ALA  -2 120.307  22.478 -17.608
   11    H    MET  -1           HN       MET  -1 118.887  19.634 -15.123
   12    HA   MET  -1           HA       MET  -1 117.577  17.902 -14.737
   13    HB2  MET  -1           HB2      MET  -1 117.412  17.795 -17.736
   14    HB3  MET  -1           HB1      MET  -1 116.479  16.723 -16.697
   15    HG2  MET  -1           HG2      MET  -1 116.359  19.730 -16.746
   16    HG3  MET  -1           HG1      MET  -1 115.136  18.614 -17.356
   17    HE1  MET  -1           HE1      MET  -1 113.273  19.887 -15.886
   18    HE2  MET  -1           HE2      MET  -1 114.527  20.981 -15.309
   19    HE3  MET  -1           HE3      MET  -1 113.452  20.188 -14.155
   20    H    GLY   0           HN       GLY   0 120.302  17.438 -14.627
   21    HA2  GLY   0           HA2      GLY   0 120.530  14.638 -15.442
   22    HA3  GLY   0           HA1      GLY   0 121.835  15.655 -14.837
   23    H    LYS   1           HN       LYS   1 118.626  15.055 -13.549
   24    HA   LYS   1           HA       LYS   1 119.896  14.233 -11.029
   25    HB2  LYS   1           HB2      LYS   1 117.148  15.443 -11.400
   26    HB3  LYS   1           HB1      LYS   1 117.815  14.884  -9.891
   27    HG2  LYS   1           HG2      LYS   1 118.087  17.156  -9.726
   28    HG3  LYS   1           HG1      LYS   1 119.656  16.613 -10.323
   29    HD2  LYS   1           HD2      LYS   1 118.890  18.629 -11.490
   30    HD3  LYS   1           HD1      LYS   1 119.035  17.260 -12.591
   31    HE2  LYS   1           HE2      LYS   1 117.001  18.614 -12.982
   32    HE3  LYS   1           HE1      LYS   1 116.617  16.947 -12.585
   33    HZ1  LYS   1           HZ1      LYS   1 116.474  19.297 -10.766
   34    HZ2  LYS   1           HZ2      LYS   1 116.105  17.701 -10.327
   35    HZ3  LYS   1           HZ3      LYS   1 115.168  18.483 -11.459
   36    HA   PRO   2           HA       PRO   2 117.589  10.476 -11.609
   37    HB2  PRO   2           HB2      PRO   2 117.808   9.589  -9.009
   38    HB3  PRO   2           HB1      PRO   2 119.045   9.333 -10.237
   39    HG2  PRO   2           HG2      PRO   2 118.987  11.167  -7.953
   40    HG3  PRO   2           HG1      PRO   2 120.390  10.533  -8.828
   41    HD2  PRO   2           HD2      PRO   2 119.264  13.107  -9.035
   42    HD3  PRO   2           HD1      PRO   2 120.487  12.433 -10.114
   43    H    PHE   3           HN       PHE   3 115.462   9.855 -11.073
   44    HA   PHE   3           HA       PHE   3 113.948  12.067 -10.281
   45    HB2  PHE   3           HB2      PHE   3 111.974  10.714 -10.765
   46    HB3  PHE   3           HB1      PHE   3 113.146  10.633 -12.074
   47    HD1  PHE   3           HD2      PHE   3 114.536   8.548 -12.255
   48    HD2  PHE   3           HD1      PHE   3 111.200   8.922  -9.703
   49    HE1  PHE   3           HE2      PHE   3 114.387   6.080 -12.119
   50    HE2  PHE   3           HE1      PHE   3 111.004   6.523  -9.526
   51    HZ   PHE   3           HZ       PHE   3 112.614   5.050 -10.747
   52    H    PHE   4           HN       PHE   4 113.390  12.684  -8.476
   53    HA   PHE   4           HA       PHE   4 112.709  10.927  -6.331
   54    HB2  PHE   4           HB2      PHE   4 115.018  11.286  -5.651
   55    HB3  PHE   4           HB1      PHE   4 114.902  12.972  -6.166
   56    HD1  PHE   4           HD1      PHE   4 113.710  10.632  -3.538
   57    HD2  PHE   4           HD2      PHE   4 114.153  14.673  -4.777
   58    HE1  PHE   4           HE1      PHE   4 112.923  11.406  -1.341
   59    HE2  PHE   4           HE2      PHE   4 113.377  15.447  -2.635
   60    HZ   PHE   4           HZ       PHE   4 112.762  13.807  -0.868
   61    H    THR   5           HN       THR   5 110.979  11.720  -5.464
   62    HA   THR   5           HA       THR   5 110.841  14.335  -4.462
   63    HB   THR   5           HB       THR   5 110.264  14.885  -6.715
   64    HG1  THR   5           HG1      THR   5 108.075  14.980  -4.898
   65   HG21  THR   5          HG21      THR   5 107.941  12.961  -6.455
   66   HG22  THR   5          HG22      THR   5 109.381  12.682  -7.385
   67   HG23  THR   5          HG23      THR   5 108.262  13.974  -7.878
   68    H    ARG   6           HN       ARG   6 110.821  11.798  -3.389
   69    HA   ARG   6           HA       ARG   6 109.882  10.501  -1.707
   70    HB2  ARG   6           HB2      ARG   6 108.748  11.666  -0.041
   71    HB3  ARG   6           HB1      ARG   6 109.736  12.823  -0.919
   72    HG2  ARG   6           HG2      ARG   6 107.734  13.525  -2.182
   73    HG3  ARG   6           HG1      ARG   6 106.769  12.489  -1.124
   74    HD2  ARG   6           HD2      ARG   6 108.661  14.506  -0.280
   75    HD3  ARG   6           HD1      ARG   6 106.923  14.871  -0.494
   76    HE   ARG   6           HE       ARG   6 106.561  13.097   1.252
   77   HH11  ARG   6          HH11      ARG   6 109.608  14.948   1.293
   78   HH12  ARG   6          HH12      ARG   6 109.902  14.632   2.941
   79   HH21  ARG   6          HH21      ARG   6 107.023  12.695   3.503
   80   HH22  ARG   6          HH22      ARG   6 108.421  13.352   4.218
   81    H    ASN   7           HN       ASN   7 108.524  10.792  -4.292
   82    HA   ASN   7           HA       ASN   7 105.876   9.751  -3.653
   83    HB2  ASN   7           HB2      ASN   7 107.050  10.904  -6.079
   84    HB3  ASN   7           HB1      ASN   7 105.842   9.651  -6.338
   85   HD21  ASN   7          HD21      ASN   7 106.440  12.784  -4.939
   86   HD22  ASN   7          HD22      ASN   7 104.792  13.264  -4.861
   87    HA   PRO   8           HA       PRO   8 107.081   5.368  -4.175
   88    HB2  PRO   8           HB2      PRO   8 104.254   5.135  -4.194
   89    HB3  PRO   8           HB1      PRO   8 105.303   4.344  -3.102
   90    HG2  PRO   8           HG2      PRO   8 103.554   6.441  -2.660
   91    HG3  PRO   8           HG1      PRO   8 104.810   5.976  -1.496
   92    HD2  PRO   8           HD2      PRO   8 104.509   8.296  -3.034
   93    HD3  PRO   8           HD1      PRO   8 105.873   7.944  -1.950
   94    H    SER   9           HN       SER   9 104.640   7.351  -5.259
   95    HA   SER   9           HA       SER   9 103.634   5.822  -7.126
   96    HB2  SER   9           HB2      SER   9 102.483   7.541  -6.001
   97    HB3  SER   9           HB1      SER   9 103.450   8.795  -6.765
   98    HG   SER   9           HG       SER   9 102.013   6.969  -8.313
   99    H    GLU  10           HN       GLU  10 106.428   8.066  -7.119
  100    HA   GLU  10           HA       GLU  10 106.546   8.418  -9.972
  101    HB2  GLU  10           HB2      GLU  10 108.629   9.558  -9.645
  102    HB3  GLU  10           HB1      GLU  10 107.542  10.132  -8.375
  103    HG2  GLU  10           HG2      GLU  10 108.763   8.463  -6.877
  104    HG3  GLU  10           HG1      GLU  10 109.907   8.284  -8.204
  105    H    LEU  11           HN       LEU  11 107.797   6.381  -7.507
  106    HA   LEU  11           HA       LEU  11 109.633   4.952  -9.044
  107    HB2  LEU  11           HB2      LEU  11 107.941   4.030  -6.725
  108    HB3  LEU  11           HB1      LEU  11 109.319   3.163  -7.356
  109    HG   LEU  11           HG       LEU  11 109.384   5.848  -5.973
  110   HD11  LEU  11          HD11      LEU  11 108.962   3.992  -4.487
  111   HD12  LEU  11          HD12      LEU  11 110.595   4.630  -4.242
  112   HD13  LEU  11          HD13      LEU  11 110.350   3.136  -5.154
  113   HD21  LEU  11          HD21      LEU  11 111.644   4.176  -7.074
  114   HD22  LEU  11          HD22      LEU  11 111.829   5.607  -6.064
  115   HD23  LEU  11          HD23      LEU  11 111.127   5.755  -7.672
  116    H    LYS  12           HN       LYS  12 109.398   3.353 -10.344
  117    HA   LYS  12           HA       LYS  12 106.734   3.016 -11.513
  118    HB2  LYS  12           HB2      LYS  12 107.839   2.137 -13.493
  119    HB3  LYS  12           HB1      LYS  12 108.534   3.675 -13.014
  120    HG2  LYS  12           HG2      LYS  12 110.549   2.689 -13.125
  121    HG3  LYS  12           HG1      LYS  12 109.983   1.781 -11.699
  122    HD2  LYS  12           HD2      LYS  12 109.246  -0.041 -12.994
  123    HD3  LYS  12           HD1      LYS  12 109.446   0.849 -14.504
  124    HE2  LYS  12           HE2      LYS  12 111.864   0.905 -14.160
  125    HE3  LYS  12           HE1      LYS  12 111.674   0.049 -12.634
  126    HZ1  LYS  12           HZ1      LYS  12 112.347  -1.390 -14.467
  127    HZ2  LYS  12           HZ2      LYS  12 110.899  -1.070 -15.282
  128    HZ3  LYS  12           HZ3      LYS  12 110.885  -1.864 -13.799
  129    H    GLY  13           HN       GLY  13 106.422   0.810 -12.620
  130    HA2  GLY  13           HA2      GLY  13 106.584  -1.536 -12.465
  131    HA3  GLY  13           HA1      GLY  13 107.296  -1.308 -10.861
  132    H    LYS  14           HN       LYS  14 106.044  -1.841  -9.290
  133    HA   LYS  14           HA       LYS  14 103.178  -1.245  -9.316
  134    HB2  LYS  14           HB2      LYS  14 102.732  -3.459  -8.221
  135    HB3  LYS  14           HB1      LYS  14 103.195  -3.590  -9.916
  136    HG2  LYS  14           HG2      LYS  14 105.432  -3.689  -8.112
  137    HG3  LYS  14           HG1      LYS  14 104.304  -5.013  -7.817
  138    HD2  LYS  14           HD2      LYS  14 105.161  -4.371 -10.617
  139    HD3  LYS  14           HD1      LYS  14 106.275  -5.232  -9.563
  140    HE2  LYS  14           HE2      LYS  14 104.943  -6.754 -10.972
  141    HE3  LYS  14           HE1      LYS  14 104.679  -7.018  -9.253
  142    HZ1  LYS  14           HZ1      LYS  14 102.823  -5.521 -11.050
  143    HZ2  LYS  14           HZ2      LYS  14 102.550  -5.953  -9.420
  144    HZ3  LYS  14           HZ3      LYS  14 102.677  -7.137 -10.587
  145    H    PHE  15           HN       PHE  15 102.295  -1.254  -7.165
  146    HA   PHE  15           HA       PHE  15 104.290  -0.435  -5.237
  147    HB2  PHE  15           HB2      PHE  15 103.115   1.419  -6.393
  148    HB3  PHE  15           HB1      PHE  15 101.593   0.718  -5.880
  149    HD1  PHE  15           HD1      PHE  15 103.998   0.371  -3.333
  150    HD2  PHE  15           HD2      PHE  15 101.417   3.163  -5.161
  151    HE1  PHE  15           HE1      PHE  15 104.154   1.802  -1.318
  152    HE2  PHE  15           HE2      PHE  15 101.547   4.621  -3.184
  153    HZ   PHE  15           HZ       PHE  15 102.916   3.955  -1.264
  154    H    ILE  16           HN       ILE  16 104.137  -1.884  -3.642
  155    HA   ILE  16           HA       ILE  16 101.521  -2.972  -3.062
  156    HB   ILE  16           HB       ILE  16 102.675  -5.049  -2.223
  157   HG12  ILE  16          HG12      ILE  16 104.998  -4.055  -2.322
  158   HG13  ILE  16          HG11      ILE  16 104.842  -5.688  -2.937
  159   HG21  ILE  16          HG21      ILE  16 101.334  -5.093  -4.209
  160   HG22  ILE  16          HG22      ILE  16 102.741  -6.133  -4.422
  161   HG23  ILE  16          HG23      ILE  16 102.699  -4.543  -5.181
  162   HD11  ILE  16          HD11      ILE  16 104.951  -4.903  -5.218
  163   HD12  ILE  16          HD12      ILE  16 106.316  -4.204  -4.344
  164   HD13  ILE  16          HD13      ILE  16 104.880  -3.233  -4.702
  165    H    HIS  17           HN       HIS  17 101.146  -3.584  -0.933
  166    HA   HIS  17           HA       HIS  17 102.883  -2.274   1.015
  167    HB2  HIS  17           HB2      HIS  17 101.047  -0.777   0.360
  168    HB3  HIS  17           HB1      HIS  17  99.887  -2.037   0.787
  169    HD1  HIS  17           HD1      HIS  17  98.702  -0.818   2.664
  170    HD2  HIS  17           HD2      HIS  17 102.823  -0.818   3.064
  171    HE1  HIS  17           HE1      HIS  17  99.178   0.270   4.874
  172    H    THR  18           HN       THR  18 103.559  -4.015   1.949
  173    HA   THR  18           HA       THR  18 101.597  -6.025   2.776
  174    HB   THR  18           HB       THR  18 102.803  -6.846   0.809
  175    HG1  THR  18           HG1      THR  18 102.129  -8.355   2.325
  176   HG21  THR  18          HG21      THR  18 105.284  -6.681   2.536
  177   HG22  THR  18          HG22      THR  18 104.942  -5.687   1.123
  178   HG23  THR  18          HG23      THR  18 105.195  -7.423   0.938
  179    H    LYS  19           HN       LYS  19 101.886  -7.051   4.689
  180    HA   LYS  19           HA       LYS  19 103.440  -5.644   6.684
  181    HB2  LYS  19           HB2      LYS  19 101.107  -6.008   7.045
  182    HB3  LYS  19           HB1      LYS  19 101.256  -7.731   6.800
  183    HG2  LYS  19           HG2      LYS  19 102.407  -6.208   9.171
  184    HG3  LYS  19           HG1      LYS  19 100.840  -7.000   9.174
  185    HD2  LYS  19           HD2      LYS  19 102.199  -9.173   8.592
  186    HD3  LYS  19           HD1      LYS  19 103.588  -8.226   9.130
  187    HE2  LYS  19           HE2      LYS  19 102.840  -9.522  10.967
  188    HE3  LYS  19           HE1      LYS  19 102.463  -7.831  11.261
  189    HZ1  LYS  19           HZ1      LYS  19 100.179  -8.287  10.541
  190    HZ2  LYS  19           HZ2      LYS  19 100.624  -9.177  11.887
  191    HZ3  LYS  19           HZ3      LYS  19 100.571  -9.924  10.375
  192    H    LEU  20           HN       LEU  20 105.186  -6.367   7.656
  193    HA   LEU  20           HA       LEU  20 105.920  -9.195   7.359
  194    HB2  LEU  20           HB2      LEU  20 107.476  -6.817   6.890
  195    HB3  LEU  20           HB1      LEU  20 108.190  -7.725   8.212
  196    HG   LEU  20           HG       LEU  20 108.454  -9.664   6.835
  197   HD11  LEU  20          HD11      LEU  20 106.476  -9.465   5.436
  198   HD12  LEU  20          HD12      LEU  20 107.961  -9.703   4.534
  199   HD13  LEU  20          HD13      LEU  20 107.223  -8.092   4.595
  200   HD21  LEU  20          HD21      LEU  20 109.394  -7.188   5.445
  201   HD22  LEU  20          HD22      LEU  20 110.084  -8.815   5.322
  202   HD23  LEU  20          HD23      LEU  20 110.144  -7.942   6.850
  203    H    ARG  21           HN       ARG  21 105.983 -10.300   9.123
  204    HA   ARG  21           HA       ARG  21 105.400  -8.919  11.538
  205    HB2  ARG  21           HB2      ARG  21 104.229 -11.011  10.860
  206    HB3  ARG  21           HB1      ARG  21 105.751 -11.864  11.028
  207    HG2  ARG  21           HG2      ARG  21 105.823 -11.140  13.406
  208    HG3  ARG  21           HG1      ARG  21 104.194 -10.503  13.194
  209    HD2  ARG  21           HD2      ARG  21 103.412 -12.708  12.539
  210    HD3  ARG  21           HD1      ARG  21 105.038 -13.356  12.769
  211    HE   ARG  21           HE       ARG  21 103.276 -12.305  14.858
  212   HH11  ARG  21          HH11      ARG  21 106.141 -14.200  13.970
  213   HH12  ARG  21          HH12      ARG  21 106.324 -14.899  15.510
  214   HH21  ARG  21          HH21      ARG  21 103.539 -13.221  16.930
  215   HH22  ARG  21          HH22      ARG  21 104.792 -14.357  17.244
  216    H    LYS  22           HN       LYS  22 107.294  -7.974  12.343
  217    HA   LYS  22           HA       LYS  22 109.826  -8.582  12.240
  218    HB2  LYS  22           HB2      LYS  22 108.063  -7.485  14.238
  219    HB3  LYS  22           HB1      LYS  22 109.667  -7.959  14.787
  220    HG2  LYS  22           HG2      LYS  22 109.682  -5.772  14.194
  221    HG3  LYS  22           HG1      LYS  22 110.620  -6.719  13.013
  222    HD2  LYS  22           HD2      LYS  22 109.442  -5.165  11.719
  223    HD3  LYS  22           HD1      LYS  22 108.366  -6.562  11.739
  224    HE2  LYS  22           HE2      LYS  22 107.075  -4.594  12.191
  225    HE3  LYS  22           HE1      LYS  22 107.163  -5.583  13.628
  226    HZ1  LYS  22           HZ1      LYS  22 108.885  -4.087  14.523
  227    HZ2  LYS  22           HZ2      LYS  22 107.487  -3.253  14.164
  228    HZ3  LYS  22           HZ3      LYS  22 108.783  -3.114  13.151
  229    H    SER  23           HN       SER  23 110.931 -10.184  12.534
  230    HA   SER  23           HA       SER  23 110.155 -12.350  14.265
  231    HB2  SER  23           HB2      SER  23 110.832 -12.662  11.830
  232    HB3  SER  23           HB1      SER  23 112.430 -12.093  12.261
  233    HG   SER  23           HG       SER  23 111.712 -14.535  12.333
  234    H    SER  24           HN       SER  24 113.362 -12.726  14.283
  235    HA   SER  24           HA       SER  24 113.649 -11.842  16.926
  236    HB2  SER  24           HB2      SER  24 115.823 -12.637  15.013
  237    HB3  SER  24           HB1      SER  24 115.924 -12.606  16.771
  238    HG   SER  24           HG       SER  24 114.800 -14.437  15.108
  239    H    ARG  25           HN       ARG  25 113.100  -9.618  16.784
  240    HA   ARG  25           HA       ARG  25 113.521  -7.469  17.170
  241    HB2  ARG  25           HB2      ARG  25 116.474  -8.133  17.132
  242    HB3  ARG  25           HB1      ARG  25 115.771  -6.634  17.694
  243    HG2  ARG  25           HG2      ARG  25 116.119  -7.671  19.688
  244    HG3  ARG  25           HG1      ARG  25 114.495  -8.272  19.328
  245    HD2  ARG  25           HD2      ARG  25 115.928 -10.100  20.050
  246    HD3  ARG  25           HD1      ARG  25 115.461 -10.290  18.362
  247    HE   ARG  25           HE       ARG  25 117.747  -9.181  17.937
  248   HH11  ARG  25          HH11      ARG  25 117.096 -11.462  20.550
  249   HH12  ARG  25          HH12      ARG  25 118.684 -12.053  20.642
  250   HH21  ARG  25          HH21      ARG  25 119.933 -10.017  18.017
  251   HH22  ARG  25          HH22      ARG  25 120.325 -11.228  19.148
  252    H    GLY  26           HN       GLY  26 113.332  -8.438  14.469
  253    HA2  GLY  26           HA2      GLY  26 113.726  -6.088  13.095
  254    HA3  GLY  26           HA1      GLY  26 115.188  -7.042  12.882
  255    H    PHE  27           HN       PHE  27 115.066  -7.660  10.878
  256    HA   PHE  27           HA       PHE  27 112.557  -8.847   9.967
  257    HB2  PHE  27           HB2      PHE  27 114.368  -6.819   8.956
  258    HB3  PHE  27           HB1      PHE  27 113.399  -7.749   7.739
  259    HD1  PHE  27           HD1      PHE  27 110.823  -7.646   8.666
  260    HD2  PHE  27           HD2      PHE  27 113.957  -4.962   9.593
  261    HE1  PHE  27           HE1      PHE  27 109.189  -5.947   9.327
  262    HE2  PHE  27           HE2      PHE  27 112.365  -3.292  10.248
  263    HZ   PHE  27           HZ       PHE  27 110.002  -3.757  10.178
  264    H    GLY  28           HN       GLY  28 115.702  -8.486   8.335
  265    HA2  GLY  28           HA2      GLY  28 117.032 -10.561   8.082
  266    HA3  GLY  28           HA1      GLY  28 115.494 -11.381   7.835
  267    H    PHE  29           HN       PHE  29 116.841  -8.375   6.603
  268    HA   PHE  29           HA       PHE  29 117.423  -9.490   4.131
  269    HB2  PHE  29           HB2      PHE  29 115.946  -8.011   2.715
  270    HB3  PHE  29           HB1      PHE  29 115.104  -9.292   3.539
  271    HD1  PHE  29           HD1      PHE  29 115.676  -5.720   3.383
  272    HD2  PHE  29           HD2      PHE  29 113.394  -8.782   5.189
  273    HE1  PHE  29           HE1      PHE  29 114.055  -4.032   4.196
  274    HE2  PHE  29           HE2      PHE  29 111.798  -7.129   6.009
  275    HZ   PHE  29           HZ       PHE  29 112.113  -4.750   5.515
  276    H    THR  30           HN       THR  30 118.832  -8.117   2.991
  277    HA   THR  30           HA       THR  30 119.571  -5.862   4.647
  278    HB   THR  30           HB       THR  30 121.892  -6.166   3.692
  279    HG1  THR  30           HG1      THR  30 121.729  -8.740   3.089
  280   HG21  THR  30          HG21      THR  30 121.244  -7.024   5.921
  281   HG22  THR  30          HG22      THR  30 122.446  -8.052   5.146
  282   HG23  THR  30          HG23      THR  30 120.752  -8.538   5.174
  283    H    VAL  31           HN       VAL  31 119.999  -3.885   3.679
  284    HA   VAL  31           HA       VAL  31 118.737  -3.705   1.028
  285    HB   VAL  31           HB       VAL  31 117.411  -1.792   1.846
  286   HG11  VAL  31          HG11      VAL  31 115.963  -2.885   3.392
  287   HG12  VAL  31          HG12      VAL  31 117.188  -4.113   3.692
  288   HG13  VAL  31          HG13      VAL  31 116.444  -3.988   2.104
  289   HG21  VAL  31          HG21      VAL  31 118.789  -2.333   4.418
  290   HG22  VAL  31          HG22      VAL  31 117.370  -1.305   4.202
  291   HG23  VAL  31          HG23      VAL  31 118.918  -0.862   3.426
  292    H    VAL  32           HN       VAL  32 119.131  -1.725  -0.138
  293    HA   VAL  32           HA       VAL  32 121.594  -0.302   0.545
  294    HB   VAL  32           HB       VAL  32 121.812   0.250  -1.920
  295   HG11  VAL  32          HG11      VAL  32 123.283  -1.350  -0.859
  296   HG12  VAL  32          HG12      VAL  32 122.922  -1.811  -2.528
  297   HG13  VAL  32          HG13      VAL  32 122.103  -2.618  -1.194
  298   HG21  VAL  32          HG21      VAL  32 120.760  -1.363  -3.561
  299   HG22  VAL  32          HG22      VAL  32 119.626  -0.321  -2.771
  300   HG23  VAL  32          HG23      VAL  32 119.777  -1.987  -2.242
  301    H    GLY  33           HN       GLY  33 121.456   1.775   0.757
  302    HA2  GLY  33           HA2      GLY  33 120.610   3.840  -0.342
  303    HA3  GLY  33           HA1      GLY  33 119.045   3.044  -0.354
  304    H    GLY  34           HN       GLY  34 117.981   4.410   0.798
  305    HA2  GLY  34           HA2      GLY  34 117.330   5.800   2.441
  306    HA3  GLY  34           HA1      GLY  34 117.530   4.440   3.493
  307    H    ASP  35           HN       ASP  35 119.324   6.839   1.828
  308    HA   ASP  35           HA       ASP  35 121.166   6.890   4.099
  309    HB2  ASP  35           HB2      ASP  35 121.839   6.430   1.673
  310    HB3  ASP  35           HB1      ASP  35 121.658   8.153   1.442
  311    H    GLU  36           HN       GLU  36 118.876   8.776   2.245
  312    HA   GLU  36           HA       GLU  36 118.958  10.943   4.095
  313    HB2  GLU  36           HB2      GLU  36 119.929  12.519   2.318
  314    HB3  GLU  36           HB1      GLU  36 121.080  11.561   3.228
  315    HG2  GLU  36           HG2      GLU  36 121.033   9.967   1.392
  316    HG3  GLU  36           HG1      GLU  36 120.119  11.170   0.448
  317    HA   PRO  37           HA       PRO  37 115.163  11.686   2.691
  318    HB2  PRO  37           HB2      PRO  37 115.769  14.521   2.650
  319    HB3  PRO  37           HB1      PRO  37 114.622  13.629   3.736
  320    HG2  PRO  37           HG2      PRO  37 116.898  14.713   4.655
  321    HG3  PRO  37           HG1      PRO  37 116.483  13.049   5.139
  322    HD2  PRO  37           HD2      PRO  37 118.207  13.871   2.786
  323    HD3  PRO  37           HD1      PRO  37 118.700  12.817   4.071
  324    H    ASP  38           HN       ASP  38 116.364  11.026   0.785
  325    HA   ASP  38           HA       ASP  38 115.497  12.286  -1.606
  326    HB2  ASP  38           HB2      ASP  38 117.297  13.751  -1.122
  327    HB3  ASP  38           HB1      ASP  38 118.420  12.454  -0.791
  328    H    GLU  39           HN       GLU  39 117.885  10.173  -0.063
  329    HA   GLU  39           HA       GLU  39 117.525   8.159  -2.158
  330    HB2  GLU  39           HB2      GLU  39 119.829   8.734  -1.577
  331    HB3  GLU  39           HB1      GLU  39 119.513   8.362   0.108
  332    HG2  GLU  39           HG2      GLU  39 120.748   6.590  -0.904
  333    HG3  GLU  39           HG1      GLU  39 119.140   6.008  -0.487
  334    H    PHE  40           HN       PHE  40 116.155   6.673  -1.873
  335    HA   PHE  40           HA       PHE  40 114.758   6.004   0.641
  336    HB2  PHE  40           HB2      PHE  40 114.249   4.860  -2.131
  337    HB3  PHE  40           HB1      PHE  40 113.175   4.839  -0.758
  338    HD1  PHE  40           HD1      PHE  40 113.091   7.737  -0.025
  339    HD2  PHE  40           HD2      PHE  40 113.092   5.820  -3.826
  340    HE1  PHE  40           HE1      PHE  40 111.845   9.636  -0.992
  341    HE2  PHE  40           HE2      PHE  40 111.867   7.713  -4.801
  342    HZ   PHE  40           HZ       PHE  40 111.234   9.624  -3.416
  343    H    LEU  41           HN       LEU  41 114.265   3.505   0.896
  344    HA   LEU  41           HA       LEU  41 116.928   2.299   0.592
  345    HB2  LEU  41           HB2      LEU  41 114.691   1.246   2.353
  346    HB3  LEU  41           HB1      LEU  41 116.324   0.643   2.113
  347    HG   LEU  41           HG       LEU  41 117.172   2.719   3.073
  348   HD11  LEU  41          HD11      LEU  41 115.666   3.957   4.646
  349   HD12  LEU  41          HD12      LEU  41 114.309   3.032   4.016
  350   HD13  LEU  41          HD13      LEU  41 115.183   4.142   2.959
  351   HD21  LEU  41          HD21      LEU  41 115.574   0.870   4.814
  352   HD22  LEU  41          HD22      LEU  41 116.876   1.935   5.364
  353   HD23  LEU  41          HD23      LEU  41 117.223   0.650   4.226
  354    H    GLN  42           HN       GLN  42 117.168   0.344  -0.412
  355    HA   GLN  42           HA       GLN  42 114.791  -0.773  -1.684
  356    HB2  GLN  42           HB2      GLN  42 116.214   0.529  -3.191
  357    HB3  GLN  42           HB1      GLN  42 117.607  -0.474  -2.724
  358    HG2  GLN  42           HG2      GLN  42 115.998  -2.397  -3.675
  359    HG3  GLN  42           HG1      GLN  42 115.235  -1.057  -4.431
  360   HE21  GLN  42          HE21      GLN  42 115.836  -1.951  -6.460
  361   HE22  GLN  42          HE22      GLN  42 117.451  -1.666  -7.028
  362    H    ILE  43           HN       ILE  43 115.181  -3.104  -2.011
  363    HA   ILE  43           HA       ILE  43 116.765  -4.242   0.208
  364    HB   ILE  43           HB       ILE  43 115.161  -5.878  -1.769
  365   HG12  ILE  43          HG12      ILE  43 113.610  -4.185  -0.986
  366   HG13  ILE  43          HG11      ILE  43 113.186  -5.738  -0.282
  367   HG21  ILE  43          HG21      ILE  43 115.873  -6.372   1.115
  368   HG22  ILE  43          HG22      ILE  43 116.589  -7.145  -0.295
  369   HG23  ILE  43          HG23      ILE  43 114.898  -7.444   0.111
  370   HD11  ILE  43          HD11      ILE  43 114.604  -3.463   1.063
  371   HD12  ILE  43          HD12      ILE  43 114.253  -5.024   1.801
  372   HD13  ILE  43          HD13      ILE  43 112.931  -3.963   1.310
  373    H    LYS  44           HN       LYS  44 118.738  -5.222  -0.167
  374    HA   LYS  44           HA       LYS  44 119.453  -5.635  -2.981
  375    HB2  LYS  44           HB2      LYS  44 121.765  -5.197  -2.455
  376    HB3  LYS  44           HB1      LYS  44 120.745  -3.872  -1.945
  377    HG2  LYS  44           HG2      LYS  44 122.337  -4.091  -0.164
  378    HG3  LYS  44           HG1      LYS  44 120.917  -4.943   0.419
  379    HD2  LYS  44           HD2      LYS  44 121.913  -7.036  -0.019
  380    HD3  LYS  44           HD1      LYS  44 123.196  -6.313  -0.981
  381    HE2  LYS  44           HE2      LYS  44 124.033  -5.171   1.014
  382    HE3  LYS  44           HE1      LYS  44 122.754  -5.922   1.966
  383    HZ1  LYS  44           HZ1      LYS  44 124.837  -7.104   2.176
  384    HZ2  LYS  44           HZ2      LYS  44 124.920  -7.341   0.528
  385    HZ3  LYS  44           HZ3      LYS  44 123.711  -8.098   1.410
  386    H    SER  45           HN       SER  45 119.126  -7.259   0.006
  387    HA   SER  45           HA       SER  45 119.477  -9.713  -1.448
  388    HB2  SER  45           HB2      SER  45 121.161  -9.121   1.005
  389    HB3  SER  45           HB1      SER  45 120.995 -10.702   0.248
  390    HG   SER  45           HG       SER  45 121.663  -8.878  -1.589
  391    H    LEU  46           HN       LEU  46 117.823 -10.986  -0.872
  392    HA   LEU  46           HA       LEU  46 116.337 -10.485   1.446
  393    HB2  LEU  46           HB2      LEU  46 115.158 -11.057  -0.504
  394    HB3  LEU  46           HB1      LEU  46 116.216 -12.396  -0.856
  395    HG   LEU  46           HG       LEU  46 115.242 -13.695   0.935
  396   HD11  LEU  46          HD11      LEU  46 113.417 -12.860   2.235
  397   HD12  LEU  46          HD12      LEU  46 113.573 -11.258   1.449
  398   HD13  LEU  46          HD13      LEU  46 114.884 -11.899   2.456
  399   HD21  LEU  46          HD21      LEU  46 114.156 -13.724  -1.242
  400   HD22  LEU  46          HD22      LEU  46 113.157 -12.352  -0.754
  401   HD23  LEU  46          HD23      LEU  46 112.978 -13.908   0.063
  402    H    VAL  47           HN       VAL  47 116.978 -11.299   3.373
  403    HA   VAL  47           HA       VAL  47 118.870 -13.452   3.447
  404    HB   VAL  47           HB       VAL  47 117.604 -11.812   5.665
  405   HG11  VAL  47          HG11      VAL  47 119.384 -12.663   7.064
  406   HG12  VAL  47          HG12      VAL  47 119.988 -13.628   5.708
  407   HG13  VAL  47          HG13      VAL  47 118.395 -13.968   6.398
  408   HG21  VAL  47          HG21      VAL  47 119.628 -10.532   5.757
  409   HG22  VAL  47          HG22      VAL  47 119.021 -10.479   4.098
  410   HG23  VAL  47          HG23      VAL  47 120.367 -11.536   4.516
  411    H    LEU  48           HN       LEU  48 118.205 -15.460   3.689
  412    HA   LEU  48           HA       LEU  48 115.430 -16.050   3.939
  413    HB2  LEU  48           HB2      LEU  48 117.806 -17.879   4.062
  414    HB3  LEU  48           HB1      LEU  48 116.140 -18.354   3.798
  415    HG   LEU  48           HG       LEU  48 117.815 -16.695   1.952
  416   HD11  LEU  48          HD11      LEU  48 117.571 -18.588   0.391
  417   HD12  LEU  48          HD12      LEU  48 116.742 -19.497   1.658
  418   HD13  LEU  48          HD13      LEU  48 118.427 -19.025   1.869
  419   HD21  LEU  48          HD21      LEU  48 114.931 -17.547   1.662
  420   HD22  LEU  48          HD22      LEU  48 115.889 -16.825   0.375
  421   HD23  LEU  48          HD23      LEU  48 115.521 -15.891   1.818
  422    H    ASP  49           HN       ASP  49 114.410 -17.127   5.511
  423    HA   ASP  49           HA       ASP  49 113.752 -17.544   7.604
  424    HB2  ASP  49           HB2      ASP  49 115.990 -18.450   8.036
  425    HB3  ASP  49           HB1      ASP  49 116.580 -16.876   8.471
  426    H    GLY  50           HN       GLY  50 114.545 -14.790   6.247
  427    HA2  GLY  50           HA2      GLY  50 113.808 -12.842   8.282
  428    HA3  GLY  50           HA1      GLY  50 114.042 -12.721   6.510
  429    HA   PRO  51           HA       PRO  51 109.605 -13.509   7.555
  430    HB2  PRO  51           HB2      PRO  51 108.402 -11.037   8.085
  431    HB3  PRO  51           HB1      PRO  51 109.060 -12.120   9.255
  432    HG2  PRO  51           HG2      PRO  51 110.124  -9.574   8.475
  433    HG3  PRO  51           HG1      PRO  51 110.611 -10.618   9.812
  434    HD2  PRO  51           HD2      PRO  51 111.714 -10.317   7.118
  435    HD3  PRO  51           HD1      PRO  51 112.561 -10.903   8.517
  436    H    ALA  52           HN       ALA  52 111.051 -11.091   5.645
  437    HA   ALA  52           HA       ALA  52 109.195 -10.820   3.528
  438    HB1  ALA  52           HB1      ALA  52 111.063  -9.276   3.679
  439    HB2  ALA  52           HB2      ALA  52 111.321 -10.240   2.215
  440    HB3  ALA  52           HB3      ALA  52 112.206 -10.604   3.673
  441    H    ALA  53           HN       ALA  53 111.827 -13.049   4.180
  442    HA   ALA  53           HA       ALA  53 111.838 -14.539   1.773
  443    HB1  ALA  53           HB1      ALA  53 113.680 -14.526   3.448
  444    HB2  ALA  53           HB2      ALA  53 113.116 -16.153   3.055
  445    HB3  ALA  53           HB3      ALA  53 112.605 -15.389   4.558
  446    H    LEU  54           HN       LEU  54 110.401 -14.880   4.821
  447    HA   LEU  54           HA       LEU  54 109.443 -17.452   4.563
  448    HB2  LEU  54           HB2      LEU  54 108.886 -15.299   6.426
  449    HB3  LEU  54           HB1      LEU  54 108.495 -17.009   6.642
  450    HG   LEU  54           HG       LEU  54 111.313 -15.908   6.248
  451   HD11  LEU  54          HD11      LEU  54 110.283 -15.416   8.101
  452   HD12  LEU  54          HD12      LEU  54 111.618 -16.658   8.245
  453   HD13  LEU  54          HD13      LEU  54 109.824 -17.147   8.271
  454   HD21  LEU  54          HD21      LEU  54 110.308 -18.739   6.647
  455   HD22  LEU  54          HD22      LEU  54 111.979 -18.212   6.736
  456   HD23  LEU  54          HD23      LEU  54 111.130 -18.128   5.203
  457    H    ASP  55           HN       ASP  55 107.821 -14.269   4.526
  458    HA   ASP  55           HA       ASP  55 105.267 -15.464   3.901
  459    HB2  ASP  55           HB2      ASP  55 105.776 -13.146   5.107
  460    HB3  ASP  55           HB1      ASP  55 105.931 -12.570   3.471
  461    H    GLY  56           HN       GLY  56 108.017 -14.498   2.334
  462    HA2  GLY  56           HA2      GLY  56 108.747 -14.444   0.203
  463    HA3  GLY  56           HA1      GLY  56 107.440 -15.610  -0.149
  464    H    LYS  57           HN       LYS  57 107.040 -12.442   1.000
  465    HA   LYS  57           HA       LYS  57 105.492 -11.833  -1.400
  466    HB2  LYS  57           HB2      LYS  57 104.507 -11.873   0.846
  467    HB3  LYS  57           HB1      LYS  57 105.584 -10.557   1.274
  468    HG2  LYS  57           HG2      LYS  57 103.407  -9.610   0.783
  469    HG3  LYS  57           HG1      LYS  57 104.438  -9.237  -0.602
  470    HD2  LYS  57           HD2      LYS  57 103.524 -11.148  -1.813
  471    HD3  LYS  57           HD1      LYS  57 102.522 -11.561  -0.425
  472    HE2  LYS  57           HE2      LYS  57 101.143 -10.422  -2.003
  473    HE3  LYS  57           HE1      LYS  57 101.434  -9.342  -0.645
  474    HZ1  LYS  57           HZ1      LYS  57 102.900  -9.233  -3.229
  475    HZ2  LYS  57           HZ2      LYS  57 103.051  -8.129  -1.965
  476    HZ3  LYS  57           HZ3      LYS  57 101.605  -8.252  -2.808
  477    H    MET  58           HN       MET  58 108.438 -11.117   0.119
  478    HA   MET  58           HA       MET  58 108.778  -8.700  -1.503
  479    HB2  MET  58           HB2      MET  58 109.963  -9.259   1.245
  480    HB3  MET  58           HB1      MET  58 110.401  -7.919   0.202
  481    HG2  MET  58           HG2      MET  58 108.168  -7.011   0.451
  482    HG3  MET  58           HG1      MET  58 107.696  -8.429   1.361
  483    HE1  MET  58           HE1      MET  58 110.382  -5.530   1.365
  484    HE2  MET  58           HE2      MET  58 111.295  -6.957   1.862
  485    HE3  MET  58           HE3      MET  58 110.994  -5.656   3.013
  486    H    GLU  59           HN       GLU  59 110.850  -8.564  -2.478
  487    HA   GLU  59           HA       GLU  59 112.558 -10.931  -2.410
  488    HB2  GLU  59           HB2      GLU  59 111.100 -10.013  -4.884
  489    HB3  GLU  59           HB1      GLU  59 112.417 -11.166  -4.874
  490    HG2  GLU  59           HG2      GLU  59 111.082 -12.770  -3.684
  491    HG3  GLU  59           HG1      GLU  59 109.782 -11.593  -3.484
  492    H    THR  60           HN       THR  60 114.605 -10.435  -3.138
  493    HA   THR  60           HA       THR  60 115.690  -8.025  -2.659
  494    HB   THR  60           HB       THR  60 116.625  -9.969  -4.720
  495    HG1  THR  60           HG1      THR  60 116.548 -11.298  -3.076
  496   HG21  THR  60          HG21      THR  60 118.022  -8.147  -2.850
  497   HG22  THR  60          HG22      THR  60 117.880  -7.945  -4.610
  498   HG23  THR  60          HG23      THR  60 118.815  -9.294  -3.926
  499    H    GLY  61           HN       GLY  61 115.356  -6.148  -3.643
  500    HA2  GLY  61           HA2      GLY  61 115.815  -4.999  -5.827
  501    HA3  GLY  61           HA1      GLY  61 114.650  -6.140  -6.485
  502    H    ASP  62           HN       ASP  62 113.116  -5.903  -3.795
  503    HA   ASP  62           HA       ASP  62 111.171  -3.990  -4.568
  504    HB2  ASP  62           HB2      ASP  62 111.704  -4.493  -1.631
  505    HB3  ASP  62           HB1      ASP  62 110.206  -4.108  -2.428
  506    H    VAL  63           HN       VAL  63 110.938  -1.808  -3.949
  507    HA   VAL  63           HA       VAL  63 113.101  -0.864  -2.303
  508    HB   VAL  63           HB       VAL  63 113.750   0.172  -4.287
  509   HG11  VAL  63          HG11      VAL  63 110.882   0.753  -4.865
  510   HG12  VAL  63          HG12      VAL  63 111.970  -0.457  -5.597
  511   HG13  VAL  63          HG13      VAL  63 112.278   1.266  -5.843
  512   HG21  VAL  63          HG21      VAL  63 113.633   1.883  -2.553
  513   HG22  VAL  63          HG22      VAL  63 111.970   2.248  -3.009
  514   HG23  VAL  63          HG23      VAL  63 113.283   2.577  -4.139
  515    H    ILE  64           HN       ILE  64 112.750  -0.085  -0.521
  516    HA   ILE  64           HA       ILE  64 110.105   0.072   0.329
  517    HB   ILE  64           HB       ILE  64 112.666   0.365   1.897
  518   HG12  ILE  64          HG12      ILE  64 110.537  -1.782   1.783
  519   HG13  ILE  64          HG11      ILE  64 112.178  -1.891   1.158
  520   HG21  ILE  64          HG21      ILE  64 109.839   0.446   2.979
  521   HG22  ILE  64          HG22      ILE  64 110.992   1.779   2.984
  522   HG23  ILE  64          HG23      ILE  64 111.304   0.343   3.958
  523   HD11  ILE  64          HD11      ILE  64 113.059  -1.755   3.423
  524   HD12  ILE  64          HD12      ILE  64 111.904  -3.091   3.276
  525   HD13  ILE  64          HD13      ILE  64 111.416  -1.569   4.035
  526    H    VAL  65           HN       VAL  65 108.957   1.726   0.462
  527    HA   VAL  65           HA       VAL  65 109.936   4.447   0.054
  528    HB   VAL  65           HB       VAL  65 107.138   3.310  -0.071
  529   HG11  VAL  65          HG11      VAL  65 106.660   5.268  -1.448
  530   HG12  VAL  65          HG12      VAL  65 108.288   5.862  -1.134
  531   HG13  VAL  65          HG13      VAL  65 107.135   5.681   0.200
  532   HG21  VAL  65          HG21      VAL  65 108.482   2.160  -1.717
  533   HG22  VAL  65          HG22      VAL  65 109.080   3.697  -2.333
  534   HG23  VAL  65          HG23      VAL  65 107.376   3.277  -2.516
  535    H    SER  66           HN       SER  66 108.113   2.406   2.364
  536    HA   SER  66           HA       SER  66 108.601   4.205   4.471
  537    HB2  SER  66           HB2      SER  66 106.784   5.478   3.201
  538    HB3  SER  66           HB1      SER  66 105.693   4.144   3.572
  539    HG   SER  66           HG       SER  66 105.404   5.013   5.451
  540    H    VAL  67           HN       VAL  67 107.221   3.450   6.476
  541    HA   VAL  67           HA       VAL  67 106.251   0.769   6.269
  542    HB   VAL  67           HB       VAL  67 108.590   0.208   6.272
  543   HG11  VAL  67          HG11      VAL  67 108.795   1.855   8.771
  544   HG12  VAL  67          HG12      VAL  67 109.511   2.226   7.202
  545   HG13  VAL  67          HG13      VAL  67 110.068   0.824   8.125
  546   HG21  VAL  67          HG21      VAL  67 108.721  -1.172   8.249
  547   HG22  VAL  67          HG22      VAL  67 107.080  -1.184   7.583
  548   HG23  VAL  67          HG23      VAL  67 107.450  -0.219   9.008
  549    H    ASN  68           HN       ASN  68 104.608   0.729   7.353
  550    HA   ASN  68           HA       ASN  68 102.963   1.066   8.968
  551    HB2  ASN  68           HB2      ASN  68 104.544  -0.693   9.582
  552    HB3  ASN  68           HB1      ASN  68 105.225   0.433  10.748
  553   HD21  ASN  68          HD21      ASN  68 104.671  -0.500  12.481
  554   HD22  ASN  68          HD22      ASN  68 103.089  -0.887  13.066
  555    H    ASP  69           HN       ASP  69 103.014   3.268   8.707
  556    HA   ASP  69           HA       ASP  69 102.601   5.441   9.565
  557    HB2  ASP  69           HB2      ASP  69 101.626   4.451  11.526
  558    HB3  ASP  69           HB1      ASP  69 103.201   4.048  12.184
  559    H    THR  70           HN       THR  70 105.680   4.030   9.881
  560    HA   THR  70           HA       THR  70 106.960   6.493  10.760
  561    HB   THR  70           HB       THR  70 108.253   3.868  10.013
  562    HG1  THR  70           HG1      THR  70 106.443   4.071  11.748
  563   HG21  THR  70          HG21      THR  70 109.973   4.622  11.609
  564   HG22  THR  70          HG22      THR  70 109.031   6.073  11.946
  565   HG23  THR  70          HG23      THR  70 109.733   5.828  10.345
  566    H    CYS  71           HN       CYS  71 107.732   7.891   9.396
  567    HA   CYS  71           HA       CYS  71 107.376   7.401   6.595
  568    HB2  CYS  71           HB2      CYS  71 106.683   9.494   7.754
  569    HB3  CYS  71           HB1      CYS  71 108.374   9.871   8.012
  570    HG   CYS  71           HG       CYS  71 106.797   9.656   5.006
  571    H    VAL  72           HN       VAL  72 108.967   5.789   6.525
  572    HA   VAL  72           HA       VAL  72 111.723   6.517   6.827
  573    HB   VAL  72           HB       VAL  72 110.377   3.926   5.953
  574   HG11  VAL  72          HG11      VAL  72 112.535   2.814   6.126
  575   HG12  VAL  72          HG12      VAL  72 113.324   4.344   6.488
  576   HG13  VAL  72          HG13      VAL  72 112.624   4.071   4.890
  577   HG21  VAL  72          HG21      VAL  72 111.149   3.155   8.119
  578   HG22  VAL  72          HG22      VAL  72 110.113   4.576   8.264
  579   HG23  VAL  72          HG23      VAL  72 111.860   4.734   8.434
  580    H    LEU  73           HN       LEU  73 109.513   7.115   4.523
  581    HA   LEU  73           HA       LEU  73 110.788   7.081   2.083
  582    HB2  LEU  73           HB2      LEU  73 108.434   7.824   2.774
  583    HB3  LEU  73           HB1      LEU  73 109.191   9.297   3.321
  584    HG   LEU  73           HG       LEU  73 109.758   9.941   1.117
  585   HD11  LEU  73          HD11      LEU  73 108.984   8.585  -0.789
  586   HD12  LEU  73          HD12      LEU  73 108.514   7.314   0.354
  587   HD13  LEU  73          HD13      LEU  73 110.210   7.749   0.165
  588   HD21  LEU  73          HD21      LEU  73 107.449  10.154   0.280
  589   HD22  LEU  73          HD22      LEU  73 107.606  10.531   1.993
  590   HD23  LEU  73          HD23      LEU  73 106.932   8.982   1.492
  591    H    GLY  74           HN       GLY  74 112.862   7.756   1.879
  592    HA2  GLY  74           HA2      GLY  74 114.759   9.068   1.985
  593    HA3  GLY  74           HA1      GLY  74 113.652  10.392   2.334
  594    H    HIS  75           HN       HIS  75 114.333   7.475   4.210
  595    HA   HIS  75           HA       HIS  75 114.766   9.114   6.555
  596    HB2  HIS  75           HB2      HIS  75 113.778   6.455   6.108
  597    HB3  HIS  75           HB1      HIS  75 115.360   6.353   6.855
  598    HD1  HIS  75           HD1      HIS  75 112.211   8.428   7.652
  599    HD2  HIS  75           HD2      HIS  75 115.237   6.192   9.363
  600    HE1  HIS  75           HE1      HIS  75 111.760   8.456  10.112
  601    H    THR  76           HN       THR  76 116.740   9.311   7.473
  602    HA   THR  76           HA       THR  76 119.051   8.957   5.856
  603    HB   THR  76           HB       THR  76 118.772   9.582   8.781
  604    HG1  THR  76           HG1      THR  76 119.108  11.727   7.119
  605   HG21  THR  76          HG21      THR  76 120.847  10.864   8.511
  606   HG22  THR  76          HG22      THR  76 120.932  10.385   6.813
  607   HG23  THR  76          HG23      THR  76 121.093   9.170   8.088
  608    H    HIS  77           HN       HIS  77 120.640   7.257   6.056
  609    HA   HIS  77           HA       HIS  77 120.090   4.795   6.840
  610    HB2  HIS  77           HB2      HIS  77 122.090   5.223   5.601
  611    HB3  HIS  77           HB1      HIS  77 122.755   6.161   6.933
  612    HD1  HIS  77           HD1      HIS  77 121.766   2.429   6.395
  613    HD2  HIS  77           HD2      HIS  77 124.530   4.838   8.364
  614    HE1  HIS  77           HE1      HIS  77 123.386   0.880   7.492
  615    H    ALA  78           HN       ALA  78 121.576   7.106   8.986
  616    HA   ALA  78           HA       ALA  78 121.976   5.348  11.164
  617    HB1  ALA  78           HB1      ALA  78 121.640   8.340  11.182
  618    HB2  ALA  78           HB2      ALA  78 123.143   7.468  10.897
  619    HB3  ALA  78           HB3      ALA  78 122.346   7.363  12.475
  620    H    GLN  79           HN       GLN  79 119.253   7.212  10.093
  621    HA   GLN  79           HA       GLN  79 117.826   7.040  12.548
  622    HB2  GLN  79           HB2      GLN  79 116.973   7.844   9.784
  623    HB3  GLN  79           HB1      GLN  79 115.970   8.038  11.200
  624    HG2  GLN  79           HG2      GLN  79 118.612   9.372  10.636
  625    HG3  GLN  79           HG1      GLN  79 117.025  10.155  10.585
  626   HE21  GLN  79          HE21      GLN  79 119.394  10.858  12.044
  627   HE22  GLN  79          HE22      GLN  79 118.964  10.794  13.706
  628    H    VAL  80           HN       VAL  80 117.594   5.667   9.309
  629    HA   VAL  80           HA       VAL  80 115.417   3.991   9.907
  630    HB   VAL  80           HB       VAL  80 115.923   4.634   7.564
  631   HG11  VAL  80          HG11      VAL  80 118.330   4.526   7.670
  632   HG12  VAL  80          HG12      VAL  80 117.686   3.623   6.301
  633   HG13  VAL  80          HG13      VAL  80 118.264   2.765   7.738
  634   HG21  VAL  80          HG21      VAL  80 115.982   1.653   8.003
  635   HG22  VAL  80          HG22      VAL  80 115.395   2.501   6.562
  636   HG23  VAL  80          HG23      VAL  80 114.554   2.670   8.093
  637    H    VAL  81           HN       VAL  81 118.885   3.415  10.029
  638    HA   VAL  81           HA       VAL  81 118.627   0.656  10.566
  639    HB   VAL  81           HB       VAL  81 120.804   1.684   9.790
  640   HG11  VAL  81          HG11      VAL  81 122.371   2.590  11.415
  641   HG12  VAL  81          HG12      VAL  81 121.122   2.517  12.658
  642   HG13  VAL  81          HG13      VAL  81 120.919   3.588  11.273
  643   HG21  VAL  81          HG21      VAL  81 120.958  -0.045  12.255
  644   HG22  VAL  81          HG22      VAL  81 122.255   0.177  11.082
  645   HG23  VAL  81          HG23      VAL  81 120.752  -0.606  10.597
  646    H    LYS  82           HN       LYS  82 118.788   3.371  12.818
  647    HA   LYS  82           HA       LYS  82 118.887   1.446  14.862
  648    HB2  LYS  82           HB2      LYS  82 119.517   3.081  16.248
  649    HB3  LYS  82           HB1      LYS  82 119.632   3.963  14.739
  650    HG2  LYS  82           HG2      LYS  82 117.234   4.094  16.571
  651    HG3  LYS  82           HG1      LYS  82 118.573   5.237  16.628
  652    HD2  LYS  82           HD2      LYS  82 118.110   5.814  14.279
  653    HD3  LYS  82           HD1      LYS  82 116.724   4.728  14.316
  654    HE2  LYS  82           HE2      LYS  82 117.120   7.227  15.963
  655    HE3  LYS  82           HE1      LYS  82 115.990   6.976  14.632
  656    HZ1  LYS  82           HZ1      LYS  82 114.832   5.305  16.022
  657    HZ2  LYS  82           HZ2      LYS  82 114.843   6.816  16.703
  658    HZ3  LYS  82           HZ3      LYS  82 115.893   5.651  17.291
  659    H    ILE  83           HN       ILE  83 116.194   2.846  13.218
  660    HA   ILE  83           HA       ILE  83 114.321   2.184  15.313
  661    HB   ILE  83           HB       ILE  83 113.849   2.684  12.351
  662   HG12  ILE  83          HG12      ILE  83 113.427   4.464  14.762
  663   HG13  ILE  83          HG11      ILE  83 114.718   4.629  13.580
  664   HG21  ILE  83          HG21      ILE  83 111.468   2.937  12.939
  665   HG22  ILE  83          HG22      ILE  83 111.833   2.464  14.599
  666   HG23  ILE  83          HG23      ILE  83 112.051   1.308  13.288
  667   HD11  ILE  83          HD11      ILE  83 111.779   4.945  13.056
  668   HD12  ILE  83          HD12      ILE  83 113.062   5.105  11.853
  669   HD13  ILE  83          HD13      ILE  83 112.963   6.246  13.198
  670    H    PHE  84           HN       PHE  84 115.300   0.812  12.259
  671    HA   PHE  84           HA       PHE  84 113.708  -1.458  12.274
  672    HB2  PHE  84           HB2      PHE  84 116.068  -0.485  10.797
  673    HB3  PHE  84           HB1      PHE  84 115.692  -2.172  10.655
  674    HD1  PHE  84           HD2      PHE  84 113.844   1.086  10.613
  675    HD2  PHE  84           HD1      PHE  84 114.423  -2.712   8.811
  676    HE1  PHE  84           HE2      PHE  84 112.183   1.643   8.901
  677    HE2  PHE  84           HE1      PHE  84 112.767  -2.166   7.094
  678    HZ   PHE  84           HZ       PHE  84 111.644   0.000   7.125
  679    H    GLN  85           HN       GLN  85 116.970  -0.916  13.467
  680    HA   GLN  85           HA       GLN  85 117.200  -3.699  14.052
  681    HB2  GLN  85           HB2      GLN  85 119.140  -1.429  14.411
  682    HB3  GLN  85           HB1      GLN  85 119.509  -3.115  14.823
  683    HG2  GLN  85           HG2      GLN  85 118.741  -2.035  12.132
  684    HG3  GLN  85           HG1      GLN  85 120.359  -2.520  12.645
  685   HE21  GLN  85          HE21      GLN  85 120.837  -4.668  12.802
  686   HE22  GLN  85          HE22      GLN  85 119.809  -5.872  12.096
  687    H    SER  86           HN       SER  86 116.162  -0.930  15.839
  688    HA   SER  86           HA       SER  86 116.516  -2.475  18.281
  689    HB2  SER  86           HB2      SER  86 115.519   0.356  17.933
  690    HB3  SER  86           HB1      SER  86 115.772  -0.451  19.483
  691    HG   SER  86           HG       SER  86 117.929  -0.706  17.935
  692    H    ILE  87           HN       ILE  87 114.355  -2.411  15.894
  693    HA   ILE  87           HA       ILE  87 111.872  -2.549  16.816
  694    HB   ILE  87           HB       ILE  87 113.443  -4.057  14.817
  695   HG12  ILE  87          HG12      ILE  87 111.027  -2.294  14.701
  696   HG13  ILE  87          HG11      ILE  87 112.641  -1.990  14.064
  697   HG21  ILE  87          HG21      ILE  87 110.685  -4.898  15.503
  698   HG22  ILE  87          HG22      ILE  87 112.149  -5.894  15.564
  699   HG23  ILE  87          HG23      ILE  87 111.514  -5.278  14.024
  700   HD11  ILE  87          HD11      ILE  87 111.134  -2.516  12.229
  701   HD12  ILE  87          HD12      ILE  87 110.614  -3.974  13.039
  702   HD13  ILE  87          HD13      ILE  87 112.233  -3.893  12.394
  703    HA   PRO  88           HA       PRO  88 111.814  -6.156  19.655
  704    HB2  PRO  88           HB2      PRO  88 109.159  -6.089  20.168
  705    HB3  PRO  88           HB1      PRO  88 110.265  -4.881  20.821
  706    HG2  PRO  88           HG2      PRO  88 108.198  -4.577  18.777
  707    HG3  PRO  88           HG1      PRO  88 109.072  -3.324  19.665
  708    HD2  PRO  88           HD2      PRO  88 109.560  -4.393  16.989
  709    HD3  PRO  88           HD1      PRO  88 110.237  -2.944  17.673
  710    H    ILE  89           HN       ILE  89 111.250  -8.270  19.645
  711    HA   ILE  89           HA       ILE  89 110.641  -9.579  17.202
  712    HB   ILE  89           HB       ILE  89 110.481 -10.741  20.000
  713   HG12  ILE  89          HG12      ILE  89 112.965 -10.510  18.293
  714   HG13  ILE  89          HG11      ILE  89 112.613  -9.499  19.687
  715   HG21  ILE  89          HG21      ILE  89 111.154 -11.995  17.351
  716   HG22  ILE  89          HG22      ILE  89 109.658 -12.206  18.267
  717   HG23  ILE  89          HG23      ILE  89 111.185 -12.823  18.909
  718   HD11  ILE  89          HD11      ILE  89 112.997 -12.467  19.693
  719   HD12  ILE  89          HD12      ILE  89 112.674 -11.445  21.110
  720   HD13  ILE  89          HD13      ILE  89 114.173 -11.251  20.191
  721    H    GLY  90           HN       GLY  90 108.625 -10.532  16.560
  722    HA2  GLY  90           HA2      GLY  90 106.468 -11.357  16.872
  723    HA3  GLY  90           HA1      GLY  90 106.468 -10.695  18.502
  724    H    ALA  91           HN       ALA  91 107.537  -8.659  16.082
  725    HA   ALA  91           HA       ALA  91 105.180  -6.998  16.676
  726    HB1  ALA  91           HB1      ALA  91 106.523  -5.034  16.066
  727    HB2  ALA  91           HB2      ALA  91 107.872  -6.072  15.627
  728    HB3  ALA  91           HB3      ALA  91 107.335  -5.993  17.292
  729    H    SER  92           HN       SER  92 105.091  -5.206  14.678
  730    HA   SER  92           HA       SER  92 104.726  -6.682  12.166
  731    HB2  SER  92           HB2      SER  92 102.728  -7.241  13.239
  732    HB3  SER  92           HB1      SER  92 102.449  -5.582  13.820
  733    HG   SER  92           HG       SER  92 101.767  -5.045  11.881
  734    H    VAL  93           HN       VAL  93 104.730  -5.479  10.435
  735    HA   VAL  93           HA       VAL  93 104.205  -2.647  10.488
  736    HB   VAL  93           HB       VAL  93 106.211  -2.100   9.171
  737   HG11  VAL  93          HG11      VAL  93 107.784  -1.811  11.030
  738   HG12  VAL  93          HG12      VAL  93 106.655  -2.720  12.067
  739   HG13  VAL  93          HG13      VAL  93 106.153  -1.228  11.280
  740   HG21  VAL  93          HG21      VAL  93 106.926  -4.295   8.541
  741   HG22  VAL  93          HG22      VAL  93 107.309  -4.695  10.215
  742   HG23  VAL  93          HG23      VAL  93 108.225  -3.440   9.365
  743    H    ASP  94           HN       ASP  94 103.567  -1.872   8.704
  744    HA   ASP  94           HA       ASP  94 103.214  -3.651   6.449
  745    HB2  ASP  94           HB2      ASP  94 102.069  -1.033   7.311
  746    HB3  ASP  94           HB1      ASP  94 101.880  -1.589   5.663
  747    H    LEU  95           HN       LEU  95 104.687  -3.555   5.014
  748    HA   LEU  95           HA       LEU  95 106.467  -1.254   4.697
  749    HB2  LEU  95           HB2      LEU  95 106.449  -3.931   3.289
  750    HB3  LEU  95           HB1      LEU  95 107.546  -2.645   2.886
  751    HG   LEU  95           HG       LEU  95 108.785  -4.161   4.101
  752   HD11  LEU  95          HD11      LEU  95 107.976  -2.057   6.018
  753   HD12  LEU  95          HD12      LEU  95 109.261  -1.965   4.804
  754   HD13  LEU  95          HD13      LEU  95 109.396  -3.081   6.174
  755   HD21  LEU  95          HD21      LEU  95 106.619  -4.310   6.187
  756   HD22  LEU  95          HD22      LEU  95 108.214  -5.084   6.249
  757   HD23  LEU  95          HD23      LEU  95 107.065  -5.562   5.012
  758    H    GLU  96           HN       GLU  96 105.972   0.323   3.362
  759    HA   GLU  96           HA       GLU  96 104.295  -0.144   1.016
  760    HB2  GLU  96           HB2      GLU  96 105.589   2.347   2.167
  761    HB3  GLU  96           HB1      GLU  96 104.750   2.343   0.631
  762    HG2  GLU  96           HG2      GLU  96 102.686   1.687   1.808
  763    HG3  GLU  96           HG1      GLU  96 103.562   1.794   3.334
  764    H    LEU  97           HN       LEU  97 105.422  -1.058  -0.628
  765    HA   LEU  97           HA       LEU  97 107.984   0.112  -1.217
  766    HB2  LEU  97           HB2      LEU  97 109.228  -1.924  -1.283
  767    HB3  LEU  97           HB1      LEU  97 108.507  -1.766   0.288
  768    HG   LEU  97           HG       LEU  97 107.790  -3.788  -1.879
  769   HD11  LEU  97          HD11      LEU  97 108.727  -4.141   0.940
  770   HD12  LEU  97          HD12      LEU  97 109.783  -4.082  -0.449
  771   HD13  LEU  97          HD13      LEU  97 108.600  -5.371  -0.321
  772   HD21  LEU  97          HD21      LEU  97 106.480  -3.432   0.825
  773   HD22  LEU  97          HD22      LEU  97 106.120  -4.677  -0.375
  774   HD23  LEU  97          HD23      LEU  97 105.723  -2.985  -0.700
  775    H    CYS  98           HN       CYS  98 108.671  -0.134  -3.282
  776    HA   CYS  98           HA       CYS  98 106.530  -0.931  -5.093
  777    HB2  CYS  98           HB2      CYS  98 108.836   0.972  -5.564
  778    HB3  CYS  98           HB1      CYS  98 107.590   0.571  -6.743
  779    HG   CYS  98           HG       CYS  98 106.531   2.902  -6.028
  780    H    ARG  99           HN       ARG  99 106.873  -2.352  -6.632
  781    HA   ARG  99           HA       ARG  99 109.457  -3.762  -6.662
  782    HB2  ARG  99           HB2      ARG  99 107.631  -5.122  -5.735
  783    HB3  ARG  99           HB1      ARG  99 106.638  -4.822  -7.144
  784    HG2  ARG  99           HG2      ARG  99 107.456  -6.967  -7.421
  785    HG3  ARG  99           HG1      ARG  99 108.477  -5.968  -8.456
  786    HD2  ARG  99           HD2      ARG  99 109.995  -7.388  -7.310
  787    HD3  ARG  99           HD1      ARG  99 110.033  -5.817  -6.476
  788    HE   ARG  99           HE       ARG  99 109.131  -6.704  -4.636
  789   HH11  ARG  99          HH11      ARG  99 109.152  -9.201  -7.148
  790   HH12  ARG  99          HH12      ARG  99 108.674 -10.430  -6.075
  791   HH21  ARG  99          HH21      ARG  99 108.504  -8.257  -3.287
  792   HH22  ARG  99          HH22      ARG  99 108.226  -9.889  -3.775
  793    H    GLY 100           HN       GLY 100 110.158  -4.399  -8.778
  794    HA2  GLY 100           HA2      GLY 100 109.495  -4.472 -11.198
  795    HA3  GLY 100           HA1      GLY 100 108.888  -2.841 -10.941
  796    H    TYR 101           HN       TYR 101 111.529  -3.243  -9.064
  797    HA   TYR 101           HA       TYR 101 113.259  -1.942 -11.025
  798    HB2  TYR 101           HB2      TYR 101 113.127  -1.793  -8.036
  799    HB3  TYR 101           HB1      TYR 101 114.549  -1.272  -8.931
  800    HD1  TYR 101           HD1      TYR 101 114.412   0.597 -10.486
  801    HD2  TYR 101           HD2      TYR 101 111.154  -0.484  -7.997
  802    HE1  TYR 101           HE1      TYR 101 113.408   2.795 -10.869
  803    HE2  TYR 101           HE2      TYR 101 110.132   1.699  -8.378
  804    HH   TYR 101           HH       TYR 101 111.146   4.044  -8.987
  805    HA   PRO 102           HA       PRO 102 116.045  -5.361 -10.369
  806    HB2  PRO 102           HB2      PRO 102 117.935  -4.614 -12.090
  807    HB3  PRO 102           HB1      PRO 102 116.346  -5.097 -12.688
  808    HG2  PRO 102           HG2      PRO 102 117.497  -2.360 -12.384
  809    HG3  PRO 102           HG1      PRO 102 116.445  -2.998 -13.658
  810    HD2  PRO 102           HD2      PRO 102 115.629  -1.484 -11.445
  811    HD3  PRO 102           HD1      PRO 102 114.575  -2.436 -12.509
  812    H    LEU 103           HN       LEU 103 118.523  -5.393  -9.922
  813    HA   LEU 103           HA       LEU 103 119.165  -3.238  -8.023
  814    HB2  LEU 103           HB2      LEU 103 119.322  -6.046  -7.856
  815    HB3  LEU 103           HB1      LEU 103 120.981  -5.511  -8.062
  816    HG   LEU 103           HG       LEU 103 120.451  -5.838  -5.714
  817   HD11  LEU 103          HD11      LEU 103 121.098  -3.701  -4.785
  818   HD12  LEU 103          HD12      LEU 103 120.708  -2.896  -6.305
  819   HD13  LEU 103          HD13      LEU 103 122.036  -4.057  -6.231
  820   HD21  LEU 103          HD21      LEU 103 118.778  -4.449  -4.591
  821   HD22  LEU 103          HD22      LEU 103 118.070  -5.515  -5.800
  822   HD23  LEU 103          HD23      LEU 103 118.282  -3.800  -6.152
  823    HA   PRO 104           HA       PRO 104 121.903  -2.416 -11.636
  824    HB2  PRO 104           HB2      PRO 104 121.630   0.238 -11.707
  825    HB3  PRO 104           HB1      PRO 104 120.312  -0.828 -12.213
  826    HG2  PRO 104           HG2      PRO 104 120.603   0.753  -9.711
  827    HG3  PRO 104           HG1      PRO 104 119.140   0.343 -10.617
  828    HD2  PRO 104           HD2      PRO 104 120.148  -0.976  -8.316
  829    HD3  PRO 104           HD1      PRO 104 118.813  -1.519  -9.345
  830    H    PHE 105           HN       PHE 105 122.902  -2.964  -9.120
  831    HA   PHE 105           HA       PHE 105 125.318  -1.492  -8.909
  832    HB2  PHE 105           HB2      PHE 105 123.827   0.124  -7.861
  833    HB3  PHE 105           HB1      PHE 105 123.073  -1.140  -6.908
  834    HD1  PHE 105           HD1      PHE 105 126.267   0.669  -7.417
  835    HD2  PHE 105           HD2      PHE 105 123.810  -1.565  -4.764
  836    HE1  PHE 105           HE1      PHE 105 127.763   1.235  -5.550
  837    HE2  PHE 105           HE2      PHE 105 125.299  -1.008  -2.898
  838    HZ   PHE 105           HZ       PHE 105 127.273   0.395  -3.289
  839    H    ASP 106           HN       ASP 106 126.709  -2.832  -7.641
  840    HA   ASP 106           HA       ASP 106 125.355  -5.196  -6.568
  841    HB2  ASP 106           HB2      ASP 106 127.030  -5.680  -8.310
  842    HB3  ASP 106           HB1      ASP 106 128.273  -4.981  -7.213
  843    HA   PRO 107           HA       PRO 107 126.546  -3.425  -2.861
  844    HB2  PRO 107           HB2      PRO 107 124.830  -5.116  -1.454
  845    HB3  PRO 107           HB1      PRO 107 124.346  -3.720  -2.416
  846    HG2  PRO 107           HG2      PRO 107 123.709  -6.447  -3.032
  847    HG3  PRO 107           HG1      PRO 107 123.506  -5.036  -4.096
  848    HD2  PRO 107           HD2      PRO 107 125.870  -6.833  -3.852
  849    HD3  PRO 107           HD1      PRO 107 125.129  -6.413  -5.298
  850    H    ASP 108           HN       ASP 108 127.696  -6.299  -3.912
  851    HA   ASP 108           HA       ASP 108 128.558  -7.071  -1.374
  852    HB2  ASP 108           HB2      ASP 108 127.741  -8.924  -2.619
  853    HB3  ASP 108           HB1      ASP 108 128.790  -8.565  -3.990
  854    H    ASP 109           HN       ASP 109 129.439  -6.103  -4.469
  855    HA   ASP 109           HA       ASP 109 132.172  -5.958  -4.674
  856    HB2  ASP 109           HB2      ASP 109 130.665  -5.539  -6.497
  857    HB3  ASP 109           HB1      ASP 109 129.972  -4.159  -5.663
  858    HA   PRO 110           HA       PRO 110 134.136  -3.062  -1.795
  859    HB2  PRO 110           HB2      PRO 110 134.689  -2.097  -4.513
  860    HB3  PRO 110           HB1      PRO 110 135.710  -1.943  -3.093
  861    HG2  PRO 110           HG2      PRO 110 136.132  -4.001  -4.718
  862    HG3  PRO 110           HG1      PRO 110 135.953  -4.382  -2.992
  863    HD2  PRO 110           HD2      PRO 110 134.012  -4.818  -5.215
  864    HD3  PRO 110           HD1      PRO 110 134.197  -5.710  -3.691
  865    H    ASN 111           HN       ASN 111 132.149  -1.830  -4.429
  866    HA   ASN 111           HA       ASN 111 132.541   0.760  -3.580
  867    HB2  ASN 111           HB2      ASN 111 130.768  -0.320  -5.733
  868    HB3  ASN 111           HB1      ASN 111 130.642   1.338  -5.125
  869   HD21  ASN 111          HD21      ASN 111 133.744  -0.124  -5.222
  870   HD22  ASN 111          HD22      ASN 111 134.347   0.743  -6.581
  871    H    THR 112           HN       THR 112 131.862   0.423  -1.619
  872    HA   THR 112           HA       THR 112 129.155   0.132  -0.671
  873    HB   THR 112           HB       THR 112 131.059  -0.262   0.819
  874    HG1  THR 112           HG1      THR 112 129.362   0.298   2.014
  875   HG21  THR 112          HG21      THR 112 131.693   2.683   0.516
  876   HG22  THR 112          HG22      THR 112 132.676   1.337  -0.064
  877   HG23  THR 112          HG23      THR 112 132.469   1.597   1.669
  878    H    SER 113           HN       SER 113 129.667   2.809   0.880
  879    HA   SER 113           HA       SER 113 127.686   4.321  -0.238
  880    HB2  SER 113           HB2      SER 113 128.890   6.178   1.024
  881    HB3  SER 113           HB1      SER 113 128.274   4.809   1.947
  882    HG   SER 113           HG       SER 113 130.927   5.000   0.954
  883    H    LEU 114           HN       LEU 114 127.534   5.742  -1.792
  884    HA   LEU 114           HA       LEU 114 129.760   6.203  -3.580
  885    HB2  LEU 114           HB2      LEU 114 126.910   7.167  -3.774
  886    HB3  LEU 114           HB1      LEU 114 128.096   7.103  -5.062
  887    HG   LEU 114           HG       LEU 114 126.768   4.766  -3.720
  888   HD11  LEU 114          HD11      LEU 114 126.574   5.842  -6.514
  889   HD12  LEU 114          HD12      LEU 114 125.327   5.905  -5.271
  890   HD13  LEU 114          HD13      LEU 114 125.831   4.352  -5.938
  891   HD21  LEU 114          HD21      LEU 114 127.996   3.373  -5.322
  892   HD22  LEU 114          HD22      LEU 114 129.041   4.241  -4.188
  893   HD23  LEU 114          HD23      LEU 114 128.897   4.811  -5.853
  894    H    VAL 115           HN       VAL 115 131.034   7.731  -2.835
  895    HA   VAL 115           HA       VAL 115 129.832  10.280  -2.091
  896    HB   VAL 115           HB       VAL 115 132.391   9.094  -0.956
  897   HG11  VAL 115          HG11      VAL 115 132.544  11.533  -1.236
  898   HG12  VAL 115          HG12      VAL 115 132.469  11.086   0.468
  899   HG13  VAL 115          HG13      VAL 115 131.037  11.731  -0.336
  900   HG21  VAL 115          HG21      VAL 115 129.726   9.654   0.359
  901   HG22  VAL 115          HG22      VAL 115 131.171   9.078   1.195
  902   HG23  VAL 115          HG23      VAL 115 130.378   8.065  -0.016
  903    H    THR 116           HN       THR 116 130.115  11.500  -3.776
  904    HA   THR 116           HA       THR 116 132.312  11.147  -5.560
  905    HB   THR 116           HB       THR 116 130.013  11.761  -6.353
  906    HG1  THR 116           HG1      THR 116 130.761  13.405  -7.774
  907   HG21  THR 116          HG21      THR 116 129.256  14.096  -6.123
  908   HG22  THR 116          HG22      THR 116 130.655  14.423  -5.096
  909   HG23  THR 116          HG23      THR 116 129.401  13.317  -4.541
  910    H    SER 117           HN       SER 117 133.852  12.778  -5.993
  911    HA   SER 117           HA       SER 117 134.512  14.283  -3.606
  912    HB2  SER 117           HB2      SER 117 136.200  13.711  -6.051
  913    HB3  SER 117           HB1      SER 117 136.756  14.511  -4.581
  914    HG   SER 117           HG       SER 117 137.104  12.639  -3.787
  915    H    VAL 118           HN       VAL 118 133.556  16.077  -3.557
  916    HA   VAL 118           HA       VAL 118 133.911  17.948  -5.729
  917    HB   VAL 118           HB       VAL 118 131.623  17.098  -5.912
  918   HG11  VAL 118          HG11      VAL 118 131.215  17.912  -3.052
  919   HG12  VAL 118          HG12      VAL 118 131.404  16.277  -3.663
  920   HG13  VAL 118          HG13      VAL 118 129.985  17.233  -4.137
  921   HG21  VAL 118          HG21      VAL 118 131.735  19.882  -4.755
  922   HG22  VAL 118          HG22      VAL 118 130.332  19.213  -5.586
  923   HG23  VAL 118          HG23      VAL 118 131.850  19.428  -6.455
  924    H    ALA 119           HN       ALA 119 134.518  19.946  -4.959
  925    HA   ALA 119           HA       ALA 119 135.355  19.942  -2.216
  926    HB1  ALA 119           HB1      ALA 119 136.598  21.954  -2.756
  927    HB2  ALA 119           HB2      ALA 119 135.783  22.062  -4.318
  928    HB3  ALA 119           HB3      ALA 119 136.874  20.717  -3.983
  929    H    ILE 120           HN       ILE 120 133.253  19.920  -1.342
  930    HA   ILE 120           HA       ILE 120 132.174  22.648  -1.069
  931    HB   ILE 120           HB       ILE 120 130.776  19.997  -0.641
  932   HG12  ILE 120          HG12      ILE 120 131.013  20.426  -3.004
  933   HG13  ILE 120          HG11      ILE 120 129.328  20.633  -2.550
  934   HG21  ILE 120          HG21      ILE 120 128.720  21.312  -0.286
  935   HG22  ILE 120          HG22      ILE 120 129.671  22.795  -0.389
  936   HG23  ILE 120          HG23      ILE 120 129.956  21.653   0.926
  937   HD11  ILE 120          HD11      ILE 120 131.329  22.828  -3.060
  938   HD12  ILE 120          HD12      ILE 120 129.656  23.078  -2.556
  939   HD13  ILE 120          HD13      ILE 120 130.008  22.346  -4.125
  940    H    LEU 121           HN       LEU 121 132.484  19.538   0.561
  941    HA   LEU 121           HA       LEU 121 132.704  20.883   3.113
  942    HB2  LEU 121           HB2      LEU 121 132.250  18.103   2.233
  943    HB3  LEU 121           HB1      LEU 121 132.637  18.465   3.910
  944    HG   LEU 121           HG       LEU 121 130.301  19.554   2.385
  945   HD11  LEU 121          HD11      LEU 121 130.460  17.366   4.476
  946   HD12  LEU 121          HD12      LEU 121 130.106  17.123   2.766
  947   HD13  LEU 121          HD13      LEU 121 128.959  17.993   3.791
  948   HD21  LEU 121          HD21      LEU 121 130.976  21.041   4.153
  949   HD22  LEU 121          HD22      LEU 121 131.055  19.704   5.293
  950   HD23  LEU 121          HD23      LEU 121 129.493  20.215   4.641
  951    H    ASP 122           HN       ASP 122 134.360  20.803   4.303
  952    HA   ASP 122           HA       ASP 122 136.887  19.862   3.248
  953    HB2  ASP 122           HB2      ASP 122 136.899  21.999   4.425
  954    HB3  ASP 122           HB1      ASP 122 136.222  21.244   5.865
  955    H    LYS 123           HN       LYS 123 137.004  17.802   3.309
  956    HA   LYS 123           HA       LYS 123 135.559  16.126   4.950
  957    HB2  LYS 123           HB2      LYS 123 137.964  15.459   3.280
  958    HB3  LYS 123           HB1      LYS 123 136.809  14.311   3.938
  959    HG2  LYS 123           HG2      LYS 123 136.299  16.402   1.825
  960    HG3  LYS 123           HG1      LYS 123 136.299  14.650   1.625
  961    HD2  LYS 123           HD2      LYS 123 134.358  14.524   3.179
  962    HD3  LYS 123           HD1      LYS 123 134.344  16.283   3.244
  963    HE2  LYS 123           HE2      LYS 123 132.681  15.544   1.671
  964    HE3  LYS 123           HE1      LYS 123 133.993  16.354   0.820
  965    HZ1  LYS 123           HZ1      LYS 123 134.886  14.227   0.192
  966    HZ2  LYS 123           HZ2      LYS 123 133.278  14.332  -0.296
  967    HZ3  LYS 123           HZ3      LYS 123 133.688  13.420   1.071
  968    H    GLU 124           HN       GLU 124 135.918  15.138   6.558
  969    HA   GLU 124           HA       GLU 124 138.194  15.755   8.257
  970    HB2  GLU 124           HB2      GLU 124 136.801  14.773  10.090
  971    HB3  GLU 124           HB1      GLU 124 136.047  16.137   9.297
  972    HG2  GLU 124           HG2      GLU 124 135.352  13.263   8.716
  973    HG3  GLU 124           HG1      GLU 124 134.501  14.268   9.883
  974    HA   PRO 125           HA       PRO 125 139.969  11.807   7.563
  975    HB2  PRO 125           HB2      PRO 125 141.461  11.527   9.809
  976    HB3  PRO 125           HB1      PRO 125 141.880  12.660   8.519
  977    HG2  PRO 125           HG2      PRO 125 140.485  13.182  11.110
  978    HG3  PRO 125           HG1      PRO 125 141.774  14.115  10.330
  979    HD2  PRO 125           HD2      PRO 125 139.172  14.843  10.181
  980    HD3  PRO 125           HD1      PRO 125 140.325  15.143   8.867
  981    H1   ARG 151           HT1      ARG 151 122.477  14.579   0.230
  982    H2   ARG 151           HT2      ARG 151 121.918  16.142   0.472
  983    H3   ARG 151           HT3      ARG 151 122.649  15.703  -1.007
  984    HA   ARG 151           HA       ARG 151 120.512  14.102   0.005
  985    HB2  ARG 151           HB2      ARG 151 118.666  15.414  -1.027
  986    HB3  ARG 151           HB1      ARG 151 119.403  16.230   0.325
  987    HG2  ARG 151           HG2      ARG 151 119.963  16.899  -2.570
  988    HG3  ARG 151           HG1      ARG 151 118.736  17.682  -1.590
  989    HD2  ARG 151           HD2      ARG 151 120.420  18.492  -0.066
  990    HD3  ARG 151           HD1      ARG 151 121.680  17.639  -0.954
  991    HE   ARG 151           HE       ARG 151 120.377  19.287  -2.748
  992   HH11  ARG 151          HH11      ARG 151 122.319  19.690   0.198
  993   HH12  ARG 151          HH12      ARG 151 122.969  21.187  -0.278
  994   HH21  ARG 151          HH21      ARG 151 121.263  21.385  -3.346
  995   HH22  ARG 151          HH22      ARG 151 122.384  22.151  -2.312
  996    H    SER 152           HN       SER 152 121.139  15.788  -3.150
  997    HA   SER 152           HA       SER 152 120.154  13.429  -4.415
  998    HB2  SER 152           HB2      SER 152 121.270  15.967  -5.599
  999    HB3  SER 152           HB1      SER 152 120.303  14.748  -6.441
 1000    HG   SER 152           HG       SER 152 118.774  15.165  -4.586
 1001    H    SER 153           HN       SER 153 122.948  13.840  -3.031
 1002    HA   SER 153           HA       SER 153 124.782  12.891  -4.968
 1003    HB2  SER 153           HB2      SER 153 126.031  12.626  -2.686
 1004    HB3  SER 153           HB1      SER 153 125.681  14.246  -3.310
 1005    HG   SER 153           HG       SER 153 124.690  12.954  -1.100
 1006    H    ARG 154           HN       ARG 154 122.352  11.613  -2.912
 1007    HA   ARG 154           HA       ARG 154 121.471   9.608  -2.585
 1008    HB2  ARG 154           HB2      ARG 154 123.509   8.603  -4.558
 1009    HB3  ARG 154           HB1      ARG 154 122.266   7.598  -3.841
 1010    HG2  ARG 154           HG2      ARG 154 121.839   9.971  -5.644
 1011    HG3  ARG 154           HG1      ARG 154 121.654   8.274  -6.077
 1012    HD2  ARG 154           HD2      ARG 154 119.952   8.232  -4.111
 1013    HD3  ARG 154           HD1      ARG 154 119.929   9.983  -4.332
 1014    HE   ARG 154           HE       ARG 154 119.610   8.452  -6.727
 1015   HH11  ARG 154          HH11      ARG 154 117.921  10.362  -4.248
 1016   HH12  ARG 154          HH12      ARG 154 116.387  10.076  -4.907
 1017   HH21  ARG 154          HH21      ARG 154 117.474   8.148  -7.658
 1018   HH22  ARG 154          HH22      ARG 154 116.119   8.828  -6.866
 1019    H    THR 155           HN       THR 155 124.928   9.012  -2.819
 1020    HA   THR 155           HA       THR 155 126.471   8.016  -1.488
 1021    HB   THR 155           HB       THR 155 124.618   8.349   0.872
 1022    HG1  THR 155           HG1      THR 155 124.604  10.346   0.217
 1023   HG21  THR 155          HG21      THR 155 126.727   7.114   1.149
 1024   HG22  THR 155          HG22      THR 155 126.796   8.648   2.028
 1025   HG23  THR 155          HG23      THR 155 127.614   8.465   0.469
 1026    H    ARG 156           HN       ARG 156 123.453   6.869   0.036
 1027    HA   ARG 156           HA       ARG 156 122.443   4.855   0.067
 1028    HB2  ARG 156           HB2      ARG 156 122.594   4.905  -2.315
 1029    HB3  ARG 156           HB1      ARG 156 124.259   4.383  -2.284
 1030    HG2  ARG 156           HG2      ARG 156 123.638   2.181  -1.670
 1031    HG3  ARG 156           HG1      ARG 156 121.959   2.662  -1.388
 1032    HD2  ARG 156           HD2      ARG 156 123.413   2.744  -4.034
 1033    HD3  ARG 156           HD1      ARG 156 122.209   1.547  -3.559
 1034    HE   ARG 156           HE       ARG 156 121.351   4.343  -3.489
 1035   HH11  ARG 156          HH11      ARG 156 121.360   1.351  -5.363
 1036   HH12  ARG 156          HH12      ARG 156 120.008   1.806  -6.299
 1037   HH21  ARG 156          HH21      ARG 156 119.609   4.934  -4.686
 1038   HH22  ARG 156          HH22      ARG 156 118.938   3.921  -5.904
 1039    H    ARG 157           HN       ARG 157 122.750   3.741   1.919
 1040    HA   ARG 157           HA       ARG 157 125.333   2.373   2.206
 1041    HB2  ARG 157           HB2      ARG 157 123.416   3.211   4.377
 1042    HB3  ARG 157           HB1      ARG 157 124.871   2.267   4.630
 1043    HG2  ARG 157           HG2      ARG 157 124.655   5.114   3.733
 1044    HG3  ARG 157           HG1      ARG 157 125.321   4.505   5.245
 1045    HD2  ARG 157           HD2      ARG 157 126.446   4.138   2.478
 1046    HD3  ARG 157           HD1      ARG 157 127.100   5.161   3.749
 1047    HE   ARG 157           HE       ARG 157 127.018   2.203   3.924
 1048   HH11  ARG 157          HH11      ARG 157 128.766   5.264   4.455
 1049   HH12  ARG 157          HH12      ARG 157 130.185   4.515   4.980
 1050   HH21  ARG 157          HH21      ARG 157 128.972   1.200   4.662
 1051   HH22  ARG 157          HH22      ARG 157 130.297   2.150   5.130
 1052    H    GLU 158           HN       GLU 158 125.273   0.407   3.478
 1053    HA   GLU 158           HA       GLU 158 123.166  -1.324   2.497
 1054    HB2  GLU 158           HB2      GLU 158 125.595  -2.321   3.912
 1055    HB3  GLU 158           HB1      GLU 158 124.736  -3.017   2.550
 1056    HG2  GLU 158           HG2      GLU 158 126.662  -2.377   1.503
 1057    HG3  GLU 158           HG1      GLU 158 125.717  -0.905   1.295
 1058    H    THR 159           HN       THR 159 121.612  -0.751   4.094
 1059    HA   THR 159           HA       THR 159 122.255  -1.079   6.904
 1060    HB   THR 159           HB       THR 159 119.488  -0.754   5.673
 1061    HG1  THR 159           HG1      THR 159 120.007   1.229   5.230
 1062   HG21  THR 159          HG21      THR 159 120.544  -0.054   8.455
 1063   HG22  THR 159          HG22      THR 159 119.509  -1.412   8.108
 1064   HG23  THR 159          HG23      THR 159 118.902   0.230   7.911
 1065    H    GLN 160           HN       GLN 160 122.067  -2.986   7.970
 1066    HA   GLN 160           HA       GLN 160 120.819  -5.214   6.549
 1067    HB2  GLN 160           HB2      GLN 160 122.551  -5.186   9.035
 1068    HB3  GLN 160           HB1      GLN 160 121.902  -6.624   8.270
 1069    HG2  GLN 160           HG2      GLN 160 123.234  -6.128   6.271
 1070    HG3  GLN 160           HG1      GLN 160 123.904  -4.719   7.093
 1071   HE21  GLN 160          HE21      GLN 160 123.804  -8.165   6.979
 1072   HE22  GLN 160          HE22      GLN 160 125.154  -8.457   8.005
 1073    H    VAL 161           HN       VAL 161 118.785  -5.883   7.213
 1074    HA   VAL 161           HA       VAL 161 118.029  -5.057   9.864
 1075    HB   VAL 161           HB       VAL 161 115.809  -4.404   9.166
 1076   HG11  VAL 161          HG11      VAL 161 117.409  -2.630   8.994
 1077   HG12  VAL 161          HG12      VAL 161 116.170  -2.546   7.711
 1078   HG13  VAL 161          HG13      VAL 161 117.779  -3.135   7.325
 1079   HG21  VAL 161          HG21      VAL 161 115.061  -4.332   6.892
 1080   HG22  VAL 161          HG22      VAL 161 115.483  -5.996   7.330
 1081   HG23  VAL 161          HG23      VAL 161 116.576  -5.020   6.338
  Start of MODEL    4
    1    H1   GLY  -3           HT1      GLY  -3 124.744   9.616 -13.560
    2    H2   GLY  -3           HT2      GLY  -3 125.707   8.581 -14.482
    3    H3   GLY  -3           HT3      GLY  -3 124.794   9.776 -15.239
    4    HA2  GLY  -3           HA1      GLY  -3 127.073  10.260 -13.402
    5    HA3  GLY  -3           HA2      GLY  -3 127.113  10.417 -15.153
    6    H    ALA  -2           HN       ALA  -2 126.958  12.444 -15.829
    7    HA   ALA  -2           HA       ALA  -2 126.068  14.594 -14.179
    8    HB1  ALA  -2           HB1      ALA  -2 127.776  14.891 -15.916
    9    HB2  ALA  -2           HB2      ALA  -2 126.394  15.949 -16.213
   10    HB3  ALA  -2           HB3      ALA  -2 126.596  14.474 -17.158
   11    H    MET  -1           HN       MET  -1 124.792  12.628 -16.683
   12    HA   MET  -1           HA       MET  -1 122.124  13.736 -16.214
   13    HB2  MET  -1           HB2      MET  -1 121.560  13.227 -18.548
   14    HB3  MET  -1           HB1      MET  -1 122.884  14.377 -18.460
   15    HG2  MET  -1           HG2      MET  -1 124.463  12.530 -18.906
   16    HG3  MET  -1           HG1      MET  -1 123.096  11.429 -19.081
   17    HE1  MET  -1           HE1      MET  -1 123.388  15.203 -20.281
   18    HE2  MET  -1           HE2      MET  -1 124.045  14.969 -21.899
   19    HE3  MET  -1           HE3      MET  -1 124.996  14.511 -20.485
   20    H    GLY   0           HN       GLY   0 120.453  12.064 -16.842
   21    HA2  GLY   0           HA2      GLY   0 119.724   9.845 -16.880
   22    HA3  GLY   0           HA1      GLY   0 121.371   9.329 -16.506
   23    H    LYS   1           HN       LYS   1 119.673  11.804 -14.758
   24    HA   LYS   1           HA       LYS   1 120.100  10.302 -12.361
   25    HB2  LYS   1           HB2      LYS   1 118.814  13.015 -12.772
   26    HB3  LYS   1           HB1      LYS   1 118.862  12.184 -11.223
   27    HG2  LYS   1           HG2      LYS   1 120.662  13.724 -11.185
   28    HG3  LYS   1           HG1      LYS   1 121.355  12.124 -11.432
   29    HD2  LYS   1           HD2      LYS   1 122.510  13.616 -12.881
   30    HD3  LYS   1           HD1      LYS   1 121.433  12.648 -13.886
   31    HE2  LYS   1           HE2      LYS   1 121.354  14.967 -14.585
   32    HE3  LYS   1           HE1      LYS   1 119.806  14.501 -13.888
   33    HZ1  LYS   1           HZ1      LYS   1 121.916  15.987 -12.415
   34    HZ2  LYS   1           HZ2      LYS   1 120.338  15.682 -11.891
   35    HZ3  LYS   1           HZ3      LYS   1 120.614  16.687 -13.196
   36    HA   PRO   2           HA       PRO   2 116.269   8.182 -12.361
   37    HB2  PRO   2           HB2      PRO   2 116.199   7.556  -9.700
   38    HB3  PRO   2           HB1      PRO   2 117.202   6.691 -10.867
   39    HG2  PRO   2           HG2      PRO   2 117.964   8.810  -8.910
   40    HG3  PRO   2           HG1      PRO   2 118.865   7.367  -9.407
   41    HD2  PRO   2           HD2      PRO   2 119.393   9.868 -10.333
   42    HD3  PRO   2           HD1      PRO   2 119.720   8.412 -11.280
   43    H    PHE   3           HN       PHE   3 114.198   8.612 -11.864
   44    HA   PHE   3           HA       PHE   3 113.484  11.206 -11.254
   45    HB2  PHE   3           HB2      PHE   3 111.149  10.270 -11.280
   46    HB3  PHE   3           HB1      PHE   3 112.104   9.884 -12.709
   47    HD1  PHE   3           HD1      PHE   3 112.902   7.607 -13.053
   48    HD2  PHE   3           HD2      PHE   3 110.462   8.659  -9.798
   49    HE1  PHE   3           HE1      PHE   3 112.401   5.209 -12.672
   50    HE2  PHE   3           HE2      PHE   3 109.944   6.318  -9.395
   51    HZ   PHE   3           HZ       PHE   3 110.917   4.567 -10.836
   52    H    PHE   4           HN       PHE   4 112.789  12.101  -9.531
   53    HA   PHE   4           HA       PHE   4 112.496  10.661  -7.026
   54    HB2  PHE   4           HB2      PHE   4 114.844  11.107  -6.906
   55    HB3  PHE   4           HB1      PHE   4 114.576  12.707  -7.608
   56    HD1  PHE   4           HD1      PHE   4 114.307  10.743  -4.505
   57    HD2  PHE   4           HD2      PHE   4 113.949  14.575  -6.311
   58    HE1  PHE   4           HE1      PHE   4 114.147  11.791  -2.290
   59    HE2  PHE   4           HE2      PHE   4 113.771  15.620  -4.158
   60    HZ   PHE   4           HZ       PHE   4 113.888  14.236  -2.094
   61    H    THR   5           HN       THR   5 110.905  11.463  -5.985
   62    HA   THR   5           HA       THR   5 110.755  14.109  -5.120
   63    HB   THR   5           HB       THR   5 109.909  14.521  -7.353
   64    HG1  THR   5           HG1      THR   5 108.781  15.277  -5.153
   65   HG21  THR   5          HG21      THR   5 107.694  13.596  -8.101
   66   HG22  THR   5          HG22      THR   5 107.696  12.609  -6.620
   67   HG23  THR   5          HG23      THR   5 108.926  12.346  -7.822
   68    H    ARG   6           HN       ARG   6 110.871  11.587  -3.948
   69    HA   ARG   6           HA       ARG   6 110.101  10.320  -2.134
   70    HB2  ARG   6           HB2      ARG   6 109.293  11.580  -0.397
   71    HB3  ARG   6           HB1      ARG   6 110.060  12.739  -1.470
   72    HG2  ARG   6           HG2      ARG   6 107.867  13.325  -2.394
   73    HG3  ARG   6           HG1      ARG   6 107.116  12.263  -1.197
   74    HD2  ARG   6           HD2      ARG   6 108.297  13.472   0.517
   75    HD3  ARG   6           HD1      ARG   6 108.887  14.526  -0.799
   76    HE   ARG   6           HE       ARG   6 106.117  14.457  -0.927
   77   HH11  ARG   6          HH11      ARG   6 108.548  15.728   1.315
   78   HH12  ARG   6          HH12      ARG   6 107.589  17.024   1.851
   79   HH21  ARG   6          HH21      ARG   6 104.790  16.234  -0.187
   80   HH22  ARG   6          HH22      ARG   6 105.408  17.318   0.992
   81    H    ASN   7           HN       ASN   7 108.462  10.541  -4.559
   82    HA   ASN   7           HA       ASN   7 105.911   9.555  -3.519
   83    HB2  ASN   7           HB2      ASN   7 106.695  10.626  -6.128
   84    HB3  ASN   7           HB1      ASN   7 105.505   9.332  -6.180
   85   HD21  ASN   7          HD21      ASN   7 106.182  12.493  -5.085
   86   HD22  ASN   7          HD22      ASN   7 104.563  12.985  -4.725
   87    HA   PRO   8           HA       PRO   8 107.043   5.155  -3.943
   88    HB2  PRO   8           HB2      PRO   8 104.238   4.923  -3.690
   89    HB3  PRO   8           HB1      PRO   8 105.386   4.217  -2.645
   90    HG2  PRO   8           HG2      PRO   8 103.688   6.428  -2.293
   91    HG3  PRO   8           HG1      PRO   8 104.900   5.918  -1.105
   92    HD2  PRO   8           HD2      PRO   8 104.786   8.224  -2.547
   93    HD3  PRO   8           HD1      PRO   8 106.242   7.664  -1.703
   94    H    SER   9           HN       SER   9 104.490   7.098  -5.011
   95    HA   SER   9           HA       SER   9 103.412   5.324  -6.651
   96    HB2  SER   9           HB2      SER   9 102.206   7.016  -5.618
   97    HB3  SER   9           HB1      SER   9 103.096   8.286  -6.453
   98    HG   SER   9           HG       SER   9 101.429   6.344  -7.696
   99    H    GLU  10           HN       GLU  10 106.037   7.709  -7.036
  100    HA   GLU  10           HA       GLU  10 105.913   7.887  -9.890
  101    HB2  GLU  10           HB2      GLU  10 107.965   9.167  -9.753
  102    HB3  GLU  10           HB1      GLU  10 106.940   9.707  -8.430
  103    HG2  GLU  10           HG2      GLU  10 108.280   8.185  -6.939
  104    HG3  GLU  10           HG1      GLU  10 109.363   7.918  -8.291
  105    H    LEU  11           HN       LEU  11 107.512   6.041  -7.431
  106    HA   LEU  11           HA       LEU  11 109.355   4.618  -8.946
  107    HB2  LEU  11           HB2      LEU  11 107.793   3.771  -6.527
  108    HB3  LEU  11           HB1      LEU  11 109.127   2.859  -7.205
  109    HG   LEU  11           HG       LEU  11 109.339   5.664  -6.094
  110   HD11  LEU  11          HD11      LEU  11 110.557   4.625  -4.263
  111   HD12  LEU  11          HD12      LEU  11 110.258   3.035  -4.968
  112   HD13  LEU  11          HD13      LEU  11 108.909   3.998  -4.364
  113   HD21  LEU  11          HD21      LEU  11 111.767   5.275  -6.282
  114   HD22  LEU  11          HD22      LEU  11 110.970   5.264  -7.850
  115   HD23  LEU  11          HD23      LEU  11 111.441   3.743  -7.098
  116    H    LYS  12           HN       LYS  12 109.388   3.151 -10.184
  117    HA   LYS  12           HA       LYS  12 107.102   2.445 -11.736
  118    HB2  LYS  12           HB2      LYS  12 108.651   1.192 -13.123
  119    HB3  LYS  12           HB1      LYS  12 109.264   2.803 -12.752
  120    HG2  LYS  12           HG2      LYS  12 110.796   2.001 -11.210
  121    HG3  LYS  12           HG1      LYS  12 109.972   0.443 -11.152
  122    HD2  LYS  12           HD2      LYS  12 112.010   0.109 -12.408
  123    HD3  LYS  12           HD1      LYS  12 110.659   0.130 -13.538
  124    HE2  LYS  12           HE2      LYS  12 112.334   2.588 -13.006
  125    HE3  LYS  12           HE1      LYS  12 112.788   1.390 -14.209
  126    HZ1  LYS  12           HZ1      LYS  12 111.602   3.258 -15.181
  127    HZ2  LYS  12           HZ2      LYS  12 110.269   2.987 -14.230
  128    HZ3  LYS  12           HZ3      LYS  12 110.725   1.847 -15.384
  129    H    GLY  13           HN       GLY  13 106.832   0.180 -12.477
  130    HA2  GLY  13           HA2      GLY  13 106.433  -2.044 -12.060
  131    HA3  GLY  13           HA1      GLY  13 107.266  -1.875 -10.522
  132    H    LYS  14           HN       LYS  14 106.120  -1.809  -8.772
  133    HA   LYS  14           HA       LYS  14 103.315  -1.074  -8.803
  134    HB2  LYS  14           HB2      LYS  14 102.760  -3.234  -7.589
  135    HB3  LYS  14           HB1      LYS  14 103.030  -3.353  -9.332
  136    HG2  LYS  14           HG2      LYS  14 105.490  -3.690  -8.103
  137    HG3  LYS  14           HG1      LYS  14 104.382  -4.727  -7.187
  138    HD2  LYS  14           HD2      LYS  14 104.723  -4.698 -10.190
  139    HD3  LYS  14           HD1      LYS  14 105.476  -5.868  -9.108
  140    HE2  LYS  14           HE2      LYS  14 102.508  -5.441  -9.293
  141    HE3  LYS  14           HE1      LYS  14 103.367  -6.654 -10.253
  142    HZ1  LYS  14           HZ1      LYS  14 102.420  -7.635  -8.314
  143    HZ2  LYS  14           HZ2      LYS  14 103.161  -6.527  -7.287
  144    HZ3  LYS  14           HZ3      LYS  14 104.094  -7.640  -8.134
  145    H    PHE  15           HN       PHE  15 102.538  -0.544  -6.812
  146    HA   PHE  15           HA       PHE  15 104.511  -0.122  -4.714
  147    HB2  PHE  15           HB2      PHE  15 103.669   1.910  -5.791
  148    HB3  PHE  15           HB1      PHE  15 102.036   1.295  -5.612
  149    HD1  PHE  15           HD2      PHE  15 104.193   0.938  -2.718
  150    HD2  PHE  15           HD1      PHE  15 101.496   3.478  -4.767
  151    HE1  PHE  15           HE2      PHE  15 103.903   2.286  -0.657
  152    HE2  PHE  15           HE1      PHE  15 101.197   4.845  -2.744
  153    HZ   PHE  15           HZ       PHE  15 102.406   4.280  -0.701
  154    H    ILE  16           HN       ILE  16 104.162  -1.577  -3.194
  155    HA   ILE  16           HA       ILE  16 101.422  -2.297  -2.601
  156    HB   ILE  16           HB       ILE  16 102.233  -4.564  -1.883
  157   HG12  ILE  16          HG12      ILE  16 104.695  -4.011  -2.055
  158   HG13  ILE  16          HG11      ILE  16 104.218  -5.546  -2.750
  159   HG21  ILE  16          HG21      ILE  16 100.799  -4.308  -3.775
  160   HG22  ILE  16          HG22      ILE  16 101.998  -5.551  -4.123
  161   HG23  ILE  16          HG23      ILE  16 102.173  -3.941  -4.819
  162   HD11  ILE  16          HD11      ILE  16 104.720  -3.024  -4.367
  163   HD12  ILE  16          HD12      ILE  16 104.349  -4.612  -5.005
  164   HD13  ILE  16          HD13      ILE  16 105.873  -4.346  -4.156
  165    H    HIS  17           HN       HIS  17 100.914  -2.833  -0.616
  166    HA   HIS  17           HA       HIS  17 102.653  -1.847   1.552
  167    HB2  HIS  17           HB2      HIS  17 100.781  -0.431   0.921
  168    HB3  HIS  17           HB1      HIS  17  99.694  -1.811   1.051
  169    HD1  HIS  17           HD1      HIS  17 100.785   1.147   2.845
  170    HD2  HIS  17           HD2      HIS  17  99.380  -2.623   3.872
  171    HE1  HIS  17           HE1      HIS  17  99.820   1.374   5.146
  172    H    THR  18           HN       THR  18 103.382  -3.778   2.237
  173    HA   THR  18           HA       THR  18 101.374  -5.815   2.898
  174    HB   THR  18           HB       THR  18 102.555  -6.433   0.785
  175    HG1  THR  18           HG1      THR  18 102.212  -8.366   1.351
  176   HG21  THR  18          HG21      THR  18 104.804  -5.558   1.280
  177   HG22  THR  18          HG22      THR  18 104.882  -7.275   0.899
  178   HG23  THR  18          HG23      THR  18 104.988  -6.741   2.573
  179    H    LYS  19           HN       LYS  19 101.589  -6.865   4.744
  180    HA   LYS  19           HA       LYS  19 103.126  -5.672   6.806
  181    HB2  LYS  19           HB2      LYS  19 100.848  -6.370   7.107
  182    HB3  LYS  19           HB1      LYS  19 101.242  -8.029   6.731
  183    HG2  LYS  19           HG2      LYS  19 102.214  -6.546   9.190
  184    HG3  LYS  19           HG1      LYS  19 100.753  -7.516   9.155
  185    HD2  LYS  19           HD2      LYS  19 102.511  -9.372   8.277
  186    HD3  LYS  19           HD1      LYS  19 103.614  -8.358   9.194
  187    HE2  LYS  19           HE2      LYS  19 102.786 -10.126  10.591
  188    HE3  LYS  19           HE1      LYS  19 102.215  -8.569  11.172
  189    HZ1  LYS  19           HZ1      LYS  19 100.047  -9.001  10.204
  190    HZ2  LYS  19           HZ2      LYS  19 100.476 -10.347  11.131
  191    HZ3  LYS  19           HZ3      LYS  19 100.606 -10.404   9.461
  192    H    LEU  20           HN       LEU  20 104.955  -6.286   7.724
  193    HA   LEU  20           HA       LEU  20 105.882  -8.999   7.232
  194    HB2  LEU  20           HB2      LEU  20 107.246  -6.621   6.441
  195    HB3  LEU  20           HB1      LEU  20 108.081  -7.271   7.854
  196    HG   LEU  20           HG       LEU  20 108.393  -9.394   6.782
  197   HD11  LEU  20          HD11      LEU  20 107.931  -9.718   4.453
  198   HD12  LEU  20          HD12      LEU  20 107.089  -8.167   4.365
  199   HD13  LEU  20          HD13      LEU  20 106.441  -9.485   5.353
  200   HD21  LEU  20          HD21      LEU  20 109.269  -7.126   5.032
  201   HD22  LEU  20          HD22      LEU  20 110.046  -8.711   5.224
  202   HD23  LEU  20          HD23      LEU  20 109.994  -7.578   6.570
  203    H    ARG  21           HN       ARG  21 106.466 -10.047   8.972
  204    HA   ARG  21           HA       ARG  21 105.777  -8.750  11.402
  205    HB2  ARG  21           HB2      ARG  21 104.787 -10.907  10.841
  206    HB3  ARG  21           HB1      ARG  21 106.384 -11.636  10.801
  207    HG2  ARG  21           HG2      ARG  21 106.633 -11.006  13.212
  208    HG3  ARG  21           HG1      ARG  21 104.947 -10.516  13.181
  209    HD2  ARG  21           HD2      ARG  21 104.267 -12.741  12.542
  210    HD3  ARG  21           HD1      ARG  21 105.952 -13.258  12.488
  211    HE   ARG  21           HE       ARG  21 104.527 -12.396  14.910
  212   HH11  ARG  21          HH11      ARG  21 107.045 -14.356  13.349
  213   HH12  ARG  21          HH12      ARG  21 107.497 -15.209  14.731
  214   HH21  ARG  21          HH21      ARG  21 105.155 -13.556  16.893
  215   HH22  ARG  21          HH22      ARG  21 106.392 -14.718  16.843
  216    H    LYS  22           HN       LYS  22 107.508  -7.750  12.384
  217    HA   LYS  22           HA       LYS  22 110.208  -8.056  12.514
  218    HB2  LYS  22           HB2      LYS  22 108.117  -7.424  14.501
  219    HB3  LYS  22           HB1      LYS  22 109.712  -7.812  15.100
  220    HG2  LYS  22           HG2      LYS  22 109.478  -5.459  14.877
  221    HG3  LYS  22           HG1      LYS  22 110.666  -6.158  13.767
  222    HD2  LYS  22           HD2      LYS  22 109.474  -4.514  12.494
  223    HD3  LYS  22           HD1      LYS  22 108.815  -6.065  12.006
  224    HE2  LYS  22           HE2      LYS  22 106.962  -4.621  12.296
  225    HE3  LYS  22           HE1      LYS  22 106.980  -5.681  13.690
  226    HZ1  LYS  22           HZ1      LYS  22 107.920  -3.862  15.025
  227    HZ2  LYS  22           HZ2      LYS  22 106.552  -3.297  14.236
  228    HZ3  LYS  22           HZ3      LYS  22 108.050  -2.916  13.651
  229    H    SER  23           HN       SER  23 111.012  -9.933  12.239
  230    HA   SER  23           HA       SER  23 110.609 -11.976  14.286
  231    HB2  SER  23           HB2      SER  23 111.289 -12.254  11.328
  232    HB3  SER  23           HB1      SER  23 111.207 -13.614  12.470
  233    HG   SER  23           HG       SER  23 109.171 -11.841  11.639
  234    H    SER  24           HN       SER  24 112.397 -12.444  15.423
  235    HA   SER  24           HA       SER  24 114.399 -12.128  16.390
  236    HB2  SER  24           HB2      SER  24 115.371 -12.198  13.543
  237    HB3  SER  24           HB1      SER  24 116.369 -12.514  14.968
  238    HG   SER  24           HG       SER  24 114.042 -13.954  14.246
  239    H    ARG  25           HN       ARG  25 113.010  -9.882  16.240
  240    HA   ARG  25           HA       ARG  25 113.213  -7.833  16.967
  241    HB2  ARG  25           HB2      ARG  25 116.114  -7.957  16.157
  242    HB3  ARG  25           HB1      ARG  25 115.357  -6.439  16.589
  243    HG2  ARG  25           HG2      ARG  25 116.401  -7.119  18.549
  244    HG3  ARG  25           HG1      ARG  25 114.717  -7.599  18.763
  245    HD2  ARG  25           HD2      ARG  25 115.303  -9.875  18.087
  246    HD3  ARG  25           HD1      ARG  25 116.988  -9.381  17.929
  247    HE   ARG  25           HE       ARG  25 115.561  -9.091  20.464
  248   HH11  ARG  25          HH11      ARG  25 118.297 -10.436  18.637
  249   HH12  ARG  25          HH12      ARG  25 119.068 -11.084  20.009
  250   HH21  ARG  25          HH21      ARG  25 116.662  -9.948  22.320
  251   HH22  ARG  25          HH22      ARG  25 118.113 -10.820  22.157
  252    H    GLY  26           HN       GLY  26 114.928  -8.151  13.951
  253    HA2  GLY  26           HA2      GLY  26 113.450  -5.798  13.020
  254    HA3  GLY  26           HA1      GLY  26 114.939  -6.439  12.339
  255    H    PHE  27           HN       PHE  27 114.776  -7.514  10.637
  256    HA   PHE  27           HA       PHE  27 112.193  -8.711   9.976
  257    HB2  PHE  27           HB2      PHE  27 113.925  -6.810   8.583
  258    HB3  PHE  27           HB1      PHE  27 112.789  -7.785   7.625
  259    HD1  PHE  27           HD2      PHE  27 110.271  -7.496   8.584
  260    HD2  PHE  27           HD1      PHE  27 113.488  -4.854   9.416
  261    HE1  PHE  27           HE2      PHE  27 108.668  -5.732   9.276
  262    HE2  PHE  27           HE1      PHE  27 111.927  -3.145  10.117
  263    HZ   PHE  27           HZ       PHE  27 109.527  -3.557  10.061
  264    H    GLY  28           HN       GLY  28 115.282  -8.407   8.209
  265    HA2  GLY  28           HA2      GLY  28 116.610 -10.519   8.086
  266    HA3  GLY  28           HA1      GLY  28 115.073 -11.321   7.797
  267    H    PHE  29           HN       PHE  29 116.596  -8.394   6.549
  268    HA   PHE  29           HA       PHE  29 117.177  -9.479   4.029
  269    HB2  PHE  29           HB2      PHE  29 115.767  -7.960   2.646
  270    HB3  PHE  29           HB1      PHE  29 114.852  -9.197   3.476
  271    HD1  PHE  29           HD1      PHE  29 115.658  -5.696   3.313
  272    HD2  PHE  29           HD2      PHE  29 113.194  -8.610   5.052
  273    HE1  PHE  29           HE1      PHE  29 114.107  -3.897   4.070
  274    HE2  PHE  29           HE2      PHE  29 111.641  -6.858   5.837
  275    HZ   PHE  29           HZ       PHE  29 112.094  -4.503   5.340
  276    H    THR  30           HN       THR  30 118.662  -8.135   2.927
  277    HA   THR  30           HA       THR  30 119.418  -5.965   4.691
  278    HB   THR  30           HB       THR  30 121.733  -6.156   3.807
  279    HG1  THR  30           HG1      THR  30 121.531  -8.629   2.745
  280   HG21  THR  30          HG21      THR  30 122.282  -8.197   5.007
  281   HG22  THR  30          HG22      THR  30 120.636  -8.786   4.773
  282   HG23  THR  30          HG23      THR  30 120.913  -7.397   5.804
  283    H    VAL  31           HN       VAL  31 119.703  -3.966   3.977
  284    HA   VAL  31           HA       VAL  31 118.582  -3.565   1.312
  285    HB   VAL  31           HB       VAL  31 117.195  -1.928   2.123
  286   HG11  VAL  31          HG11      VAL  31 117.545  -3.545   4.593
  287   HG12  VAL  31          HG12      VAL  31 116.476  -3.870   3.230
  288   HG13  VAL  31          HG13      VAL  31 116.200  -2.457   4.248
  289   HG21  VAL  31          HG21      VAL  31 119.252  -1.415   4.180
  290   HG22  VAL  31          HG22      VAL  31 117.622  -0.727   4.285
  291   HG23  VAL  31          HG23      VAL  31 118.668  -0.349   2.884
  292    H    VAL  32           HN       VAL  32 119.205  -1.511   0.322
  293    HA   VAL  32           HA       VAL  32 121.587  -0.251   1.347
  294    HB   VAL  32           HB       VAL  32 122.510  -0.031  -0.991
  295   HG11  VAL  32          HG11      VAL  32 122.474  -2.785   0.188
  296   HG12  VAL  32          HG12      VAL  32 123.572  -1.471   0.604
  297   HG13  VAL  32          HG13      VAL  32 123.636  -2.197  -1.003
  298   HG21  VAL  32          HG21      VAL  32 120.605  -2.307  -1.579
  299   HG22  VAL  32          HG22      VAL  32 121.895  -1.777  -2.653
  300   HG23  VAL  32          HG23      VAL  32 120.553  -0.697  -2.290
  301    H    GLY  33           HN       GLY  33 121.473   1.842   1.270
  302    HA2  GLY  33           HA2      GLY  33 120.729   3.744  -0.344
  303    HA3  GLY  33           HA1      GLY  33 119.177   2.959  -0.132
  304    H    GLY  34           HN       GLY  34 118.366   4.691   0.739
  305    HA2  GLY  34           HA2      GLY  34 117.732   6.192   2.283
  306    HA3  GLY  34           HA1      GLY  34 117.740   4.886   3.408
  307    H    ASP  35           HN       ASP  35 119.793   7.071   1.774
  308    HA   ASP  35           HA       ASP  35 121.415   7.337   4.216
  309    HB2  ASP  35           HB2      ASP  35 122.299   6.597   1.947
  310    HB3  ASP  35           HB1      ASP  35 122.099   8.258   1.468
  311    H    GLU  36           HN       GLU  36 119.154   8.898   2.162
  312    HA   GLU  36           HA       GLU  36 119.180  11.310   3.733
  313    HB2  GLU  36           HB2      GLU  36 119.808  12.608   1.607
  314    HB3  GLU  36           HB1      GLU  36 121.111  11.976   2.596
  315    HG2  GLU  36           HG2      GLU  36 121.316  10.110   1.141
  316    HG3  GLU  36           HG1      GLU  36 120.008  10.744   0.117
  317    HA   PRO  37           HA       PRO  37 115.166  11.744   2.381
  318    HB2  PRO  37           HB2      PRO  37 116.002  14.439   1.521
  319    HB3  PRO  37           HB1      PRO  37 114.646  14.067   2.650
  320    HG2  PRO  37           HG2      PRO  37 116.837  15.105   3.612
  321    HG3  PRO  37           HG1      PRO  37 116.323  13.561   4.342
  322    HD2  PRO  37           HD2      PRO  37 118.258  13.957   2.080
  323    HD3  PRO  37           HD1      PRO  37 118.632  13.168   3.591
  324    H    ASP  38           HN       ASP  38 117.747  12.415   0.458
  325    HA   ASP  38           HA       ASP  38 116.346  12.704  -2.025
  326    HB2  ASP  38           HB2      ASP  38 118.111  14.177  -1.534
  327    HB3  ASP  38           HB1      ASP  38 119.218  12.867  -1.182
  328    H    GLU  39           HN       GLU  39 118.025  10.269  -0.161
  329    HA   GLU  39           HA       GLU  39 117.844   8.449  -2.452
  330    HB2  GLU  39           HB2      GLU  39 120.219   8.993  -1.916
  331    HB3  GLU  39           HB1      GLU  39 119.962   8.411  -0.280
  332    HG2  GLU  39           HG2      GLU  39 119.559   6.162  -1.126
  333    HG3  GLU  39           HG1      GLU  39 119.744   6.739  -2.778
  334    H    PHE  40           HN       PHE  40 116.455   6.993  -2.144
  335    HA   PHE  40           HA       PHE  40 115.099   6.379   0.387
  336    HB2  PHE  40           HB2      PHE  40 114.594   5.123  -2.329
  337    HB3  PHE  40           HB1      PHE  40 113.500   5.188  -0.969
  338    HD1  PHE  40           HD1      PHE  40 113.267   8.035  -0.344
  339    HD2  PHE  40           HD2      PHE  40 113.677   6.116  -4.130
  340    HE1  PHE  40           HE1      PHE  40 112.085   9.912  -1.431
  341    HE2  PHE  40           HE2      PHE  40 112.513   7.990  -5.222
  342    HZ   PHE  40           HZ       PHE  40 111.700   9.885  -3.902
  343    H    LEU  41           HN       LEU  41 114.568   3.894   0.770
  344    HA   LEU  41           HA       LEU  41 117.230   2.699   0.616
  345    HB2  LEU  41           HB2      LEU  41 114.871   1.736   2.256
  346    HB3  LEU  41           HB1      LEU  41 116.496   1.067   2.135
  347    HG   LEU  41           HG       LEU  41 117.335   3.147   3.096
  348   HD11  LEU  41          HD11      LEU  41 114.416   3.565   3.772
  349   HD12  LEU  41          HD12      LEU  41 115.429   4.642   2.804
  350   HD13  LEU  41          HD13      LEU  41 115.738   4.446   4.534
  351   HD21  LEU  41          HD21      LEU  41 117.245   1.137   4.300
  352   HD22  LEU  41          HD22      LEU  41 115.550   1.387   4.728
  353   HD23  LEU  41          HD23      LEU  41 116.807   2.456   5.370
  354    H    GLN  42           HN       GLN  42 117.534   0.704  -0.302
  355    HA   GLN  42           HA       GLN  42 115.272  -0.320  -1.821
  356    HB2  GLN  42           HB2      GLN  42 117.066   0.972  -3.032
  357    HB3  GLN  42           HB1      GLN  42 118.196  -0.287  -2.525
  358    HG2  GLN  42           HG2      GLN  42 116.345  -1.792  -3.770
  359    HG3  GLN  42           HG1      GLN  42 116.039  -0.273  -4.555
  360   HE21  GLN  42          HE21      GLN  42 117.305  -2.759  -5.591
  361   HE22  GLN  42          HE22      GLN  42 118.772  -2.208  -6.301
  362    H    ILE  43           HN       ILE  43 115.890  -2.708  -2.316
  363    HA   ILE  43           HA       ILE  43 117.252  -3.857   0.041
  364    HB   ILE  43           HB       ILE  43 115.349  -5.309  -1.807
  365   HG12  ILE  43          HG12      ILE  43 114.151  -3.458  -0.762
  366   HG13  ILE  43          HG11      ILE  43 113.614  -4.976  -0.064
  367   HG21  ILE  43          HG21      ILE  43 116.895  -6.726  -0.494
  368   HG22  ILE  43          HG22      ILE  43 115.226  -6.989  -0.062
  369   HG23  ILE  43          HG23      ILE  43 116.261  -6.045   1.004
  370   HD11  ILE  43          HD11      ILE  43 113.846  -3.345   1.639
  371   HD12  ILE  43          HD12      ILE  43 115.499  -2.996   1.137
  372   HD13  ILE  43          HD13      ILE  43 115.095  -4.571   1.828
  373    H    LYS  44           HN       LYS  44 118.987  -5.283  -0.355
  374    HA   LYS  44           HA       LYS  44 119.583  -5.821  -3.204
  375    HB2  LYS  44           HB2      LYS  44 121.925  -5.833  -2.731
  376    HB3  LYS  44           HB1      LYS  44 121.223  -4.312  -2.194
  377    HG2  LYS  44           HG2      LYS  44 121.378  -4.933   0.086
  378    HG3  LYS  44           HG1      LYS  44 121.684  -6.622  -0.321
  379    HD2  LYS  44           HD2      LYS  44 123.830  -6.038  -1.258
  380    HD3  LYS  44           HD1      LYS  44 123.532  -4.328  -0.955
  381    HE2  LYS  44           HE2      LYS  44 124.972  -5.196   0.765
  382    HE3  LYS  44           HE1      LYS  44 123.400  -4.821   1.455
  383    HZ1  LYS  44           HZ1      LYS  44 122.861  -7.212   1.454
  384    HZ2  LYS  44           HZ2      LYS  44 124.317  -6.904   2.243
  385    HZ3  LYS  44           HZ3      LYS  44 124.356  -7.539   0.714
  386    H    SER  45           HN       SER  45 118.918  -7.305  -0.203
  387    HA   SER  45           HA       SER  45 119.193  -9.868  -1.506
  388    HB2  SER  45           HB2      SER  45 120.727  -9.308   1.053
  389    HB3  SER  45           HB1      SER  45 120.661 -10.835   0.180
  390    HG   SER  45           HG       SER  45 121.456  -9.103  -1.557
  391    H    LEU  46           HN       LEU  46 117.345 -10.973  -0.824
  392    HA   LEU  46           HA       LEU  46 116.294 -10.106   1.651
  393    HB2  LEU  46           HB2      LEU  46 114.333 -11.516   1.200
  394    HB3  LEU  46           HB1      LEU  46 114.656 -10.369  -0.071
  395    HG   LEU  46           HG       LEU  46 115.834 -12.542  -1.141
  396   HD11  LEU  46          HD11      LEU  46 115.187 -13.991   0.786
  397   HD12  LEU  46          HD12      LEU  46 114.449 -14.454  -0.769
  398   HD13  LEU  46          HD13      LEU  46 113.501 -13.560   0.410
  399   HD21  LEU  46          HD21      LEU  46 112.944 -11.896  -1.125
  400   HD22  LEU  46          HD22      LEU  46 113.815 -12.795  -2.391
  401   HD23  LEU  46          HD23      LEU  46 114.204 -11.089  -2.047
  402    H    VAL  47           HN       VAL  47 116.744 -11.150   3.481
  403    HA   VAL  47           HA       VAL  47 118.625 -13.270   3.353
  404    HB   VAL  47           HB       VAL  47 117.333 -11.890   5.734
  405   HG11  VAL  47          HG11      VAL  47 119.680 -13.756   5.657
  406   HG12  VAL  47          HG12      VAL  47 118.068 -14.120   6.282
  407   HG13  VAL  47          HG13      VAL  47 119.071 -12.904   7.086
  408   HG21  VAL  47          HG21      VAL  47 120.094 -11.537   4.546
  409   HG22  VAL  47          HG22      VAL  47 119.476 -10.716   5.979
  410   HG23  VAL  47          HG23      VAL  47 118.770 -10.389   4.409
  411    H    LEU  48           HN       LEU  48 118.200 -15.323   3.450
  412    HA   LEU  48           HA       LEU  48 115.586 -16.425   3.595
  413    HB2  LEU  48           HB2      LEU  48 118.280 -17.737   3.979
  414    HB3  LEU  48           HB1      LEU  48 116.766 -18.573   3.707
  415    HG   LEU  48           HG       LEU  48 118.087 -16.720   1.728
  416   HD11  LEU  48          HD11      LEU  48 119.387 -18.755   2.024
  417   HD12  LEU  48          HD12      LEU  48 118.580 -18.757   0.457
  418   HD13  LEU  48          HD13      LEU  48 117.940 -19.732   1.779
  419   HD21  LEU  48          HD21      LEU  48 115.681 -18.526   1.471
  420   HD22  LEU  48          HD22      LEU  48 116.431 -17.638   0.146
  421   HD23  LEU  48          HD23      LEU  48 115.670 -16.762   1.473
  422    H    ASP  49           HN       ASP  49 114.493 -17.228   5.159
  423    HA   ASP  49           HA       ASP  49 113.752 -17.706   7.222
  424    HB2  ASP  49           HB2      ASP  49 115.964 -18.597   7.815
  425    HB3  ASP  49           HB1      ASP  49 116.520 -16.999   8.234
  426    H    GLY  50           HN       GLY  50 114.538 -14.934   5.939
  427    HA2  GLY  50           HA2      GLY  50 113.760 -12.999   7.965
  428    HA3  GLY  50           HA1      GLY  50 113.965 -12.868   6.194
  429    HA   PRO  51           HA       PRO  51 109.496 -13.594   7.391
  430    HB2  PRO  51           HB2      PRO  51 108.361 -11.102   7.855
  431    HB3  PRO  51           HB1      PRO  51 109.114 -12.082   9.082
  432    HG2  PRO  51           HG2      PRO  51 110.091  -9.638   7.845
  433    HG3  PRO  51           HG1      PRO  51 110.524 -10.371   9.388
  434    HD2  PRO  51           HD2      PRO  51 111.829 -10.483   6.830
  435    HD3  PRO  51           HD1      PRO  51 112.477 -11.059   8.342
  436    H    ALA  52           HN       ALA  52 110.954 -11.254   5.424
  437    HA   ALA  52           HA       ALA  52 109.004 -10.967   3.376
  438    HB1  ALA  52           HB1      ALA  52 112.016 -10.705   3.346
  439    HB2  ALA  52           HB2      ALA  52 110.867  -9.402   3.616
  440    HB3  ALA  52           HB3      ALA  52 110.949 -10.198   2.052
  441    H    ALA  53           HN       ALA  53 111.749 -13.086   3.919
  442    HA   ALA  53           HA       ALA  53 111.775 -14.509   1.486
  443    HB1  ALA  53           HB1      ALA  53 113.184 -16.068   2.723
  444    HB2  ALA  53           HB2      ALA  53 112.645 -15.350   4.238
  445    HB3  ALA  53           HB3      ALA  53 113.644 -14.400   3.124
  446    H    LEU  54           HN       LEU  54 110.487 -15.036   4.594
  447    HA   LEU  54           HA       LEU  54 109.585 -17.614   4.259
  448    HB2  LEU  54           HB2      LEU  54 109.117 -15.520   6.177
  449    HB3  LEU  54           HB1      LEU  54 108.634 -17.194   6.395
  450    HG   LEU  54           HG       LEU  54 111.483 -16.233   5.930
  451   HD11  LEU  54          HD11      LEU  54 110.533 -15.644   7.706
  452   HD12  LEU  54          HD12      LEU  54 111.749 -16.987   7.997
  453   HD13  LEU  54          HD13      LEU  54 109.911 -17.296   8.013
  454   HD21  LEU  54          HD21      LEU  54 112.066 -18.577   6.432
  455   HD22  LEU  54          HD22      LEU  54 111.172 -18.468   4.934
  456   HD23  LEU  54          HD23      LEU  54 110.360 -19.015   6.404
  457    H    ASP  55           HN       ASP  55 107.957 -14.455   4.253
  458    HA   ASP  55           HA       ASP  55 105.372 -15.686   3.928
  459    HB2  ASP  55           HB2      ASP  55 105.824 -13.456   5.145
  460    HB3  ASP  55           HB1      ASP  55 106.043 -12.778   3.555
  461    H    GLY  56           HN       GLY  56 107.919 -14.748   2.066
  462    HA2  GLY  56           HA2      GLY  56 108.382 -14.666  -0.176
  463    HA3  GLY  56           HA1      GLY  56 107.078 -15.858  -0.326
  464    H    LYS  57           HN       LYS  57 107.134 -12.478   0.545
  465    HA   LYS  57           HA       LYS  57 105.249 -11.992  -1.660
  466    HB2  LYS  57           HB2      LYS  57 104.085 -12.203   0.448
  467    HB3  LYS  57           HB1      LYS  57 105.150 -11.033   1.186
  468    HG2  LYS  57           HG2      LYS  57 103.147  -9.858   0.857
  469    HG3  LYS  57           HG1      LYS  57 104.118  -9.368  -0.522
  470    HD2  LYS  57           HD2      LYS  57 101.958 -11.495  -0.555
  471    HD3  LYS  57           HD1      LYS  57 101.747  -9.839  -1.094
  472    HE2  LYS  57           HE2      LYS  57 103.523 -10.280  -2.826
  473    HE3  LYS  57           HE1      LYS  57 103.497 -11.966  -2.306
  474    HZ1  LYS  57           HZ1      LYS  57 101.183 -12.110  -2.910
  475    HZ2  LYS  57           HZ2      LYS  57 102.092 -11.606  -4.235
  476    HZ3  LYS  57           HZ3      LYS  57 101.181 -10.497  -3.368
  477    H    MET  58           HN       MET  58 108.241 -11.379  -0.811
  478    HA   MET  58           HA       MET  58 108.384  -8.734  -1.960
  479    HB2  MET  58           HB2      MET  58 108.107  -8.143   0.336
  480    HB3  MET  58           HB1      MET  58 109.129  -9.455   0.877
  481    HG2  MET  58           HG2      MET  58 110.216  -7.214  -0.742
  482    HG3  MET  58           HG1      MET  58 109.945  -7.041   0.997
  483    HE1  MET  58           HE1      MET  58 113.699  -7.467   1.012
  484    HE2  MET  58           HE2      MET  58 112.277  -6.462   1.361
  485    HE3  MET  58           HE3      MET  58 112.810  -6.709  -0.310
  486    H    GLU  59           HN       GLU  59 110.656  -8.332  -2.777
  487    HA   GLU  59           HA       GLU  59 112.269 -10.772  -2.777
  488    HB2  GLU  59           HB2      GLU  59 112.404 -10.783  -5.183
  489    HB3  GLU  59           HB1      GLU  59 110.715 -10.636  -4.776
  490    HG2  GLU  59           HG2      GLU  59 110.829  -8.254  -5.178
  491    HG3  GLU  59           HG1      GLU  59 112.526  -8.414  -5.625
  492    H    THR  60           HN       THR  60 114.432 -10.333  -3.723
  493    HA   THR  60           HA       THR  60 115.730  -8.088  -2.679
  494    HB   THR  60           HB       THR  60 116.468 -10.057  -4.796
  495    HG1  THR  60           HG1      THR  60 117.100 -11.395  -3.133
  496   HG21  THR  60          HG21      THR  60 117.932  -8.166  -4.651
  497   HG22  THR  60          HG22      THR  60 118.723  -9.654  -4.080
  498   HG23  THR  60          HG23      THR  60 118.106  -8.473  -2.918
  499    H    GLY  61           HN       GLY  61 115.713  -6.107  -3.646
  500    HA2  GLY  61           HA2      GLY  61 116.259  -4.991  -5.812
  501    HA3  GLY  61           HA1      GLY  61 114.986  -5.999  -6.489
  502    H    ASP  62           HN       ASP  62 113.372  -5.705  -3.970
  503    HA   ASP  62           HA       ASP  62 111.689  -3.617  -4.710
  504    HB2  ASP  62           HB2      ASP  62 112.092  -5.002  -2.079
  505    HB3  ASP  62           HB1      ASP  62 111.028  -3.613  -2.221
  506    H    VAL  63           HN       VAL  63 111.349  -1.577  -3.919
  507    HA   VAL  63           HA       VAL  63 113.542  -0.575  -2.361
  508    HB   VAL  63           HB       VAL  63 113.980   0.588  -4.324
  509   HG11  VAL  63          HG11      VAL  63 112.205  -0.160  -5.602
  510   HG12  VAL  63          HG12      VAL  63 112.299   1.604  -5.770
  511   HG13  VAL  63          HG13      VAL  63 111.036   0.867  -4.754
  512   HG21  VAL  63          HG21      VAL  63 112.074   2.454  -2.910
  513   HG22  VAL  63          HG22      VAL  63 113.283   2.939  -4.098
  514   HG23  VAL  63          HG23      VAL  63 113.788   2.252  -2.555
  515    H    ILE  64           HN       ILE  64 113.260   0.247  -0.558
  516    HA   ILE  64           HA       ILE  64 110.699   0.029   0.567
  517    HB   ILE  64           HB       ILE  64 113.341   0.754   1.811
  518   HG12  ILE  64          HG12      ILE  64 113.149  -1.534   1.048
  519   HG13  ILE  64          HG11      ILE  64 113.251  -1.472   2.805
  520   HG21  ILE  64          HG21      ILE  64 112.293   0.469   4.028
  521   HG22  ILE  64          HG22      ILE  64 110.721   0.300   3.249
  522   HG23  ILE  64          HG23      ILE  64 111.598   1.824   3.136
  523   HD11  ILE  64          HD11      ILE  64 110.788  -1.793   2.889
  524   HD12  ILE  64          HD12      ILE  64 111.652  -3.133   2.142
  525   HD13  ILE  64          HD13      ILE  64 110.791  -1.978   1.132
  526    H    VAL  65           HN       VAL  65 109.362   1.610   0.757
  527    HA   VAL  65           HA       VAL  65 110.088   4.394   0.294
  528    HB   VAL  65           HB       VAL  65 107.401   3.000   0.261
  529   HG11  VAL  65          HG11      VAL  65 107.231   5.389   0.684
  530   HG12  VAL  65          HG12      VAL  65 106.621   4.960  -0.923
  531   HG13  VAL  65          HG13      VAL  65 108.205   5.700  -0.760
  532   HG21  VAL  65          HG21      VAL  65 109.178   3.753  -2.049
  533   HG22  VAL  65          HG22      VAL  65 107.541   3.111  -2.180
  534   HG23  VAL  65          HG23      VAL  65 108.829   2.118  -1.495
  535    H    SER  66           HN       SER  66 107.994   2.386   2.433
  536    HA   SER  66           HA       SER  66 108.659   3.966   4.685
  537    HB2  SER  66           HB2      SER  66 106.282   4.823   5.065
  538    HB3  SER  66           HB1      SER  66 107.221   5.641   3.821
  539    HG   SER  66           HG       SER  66 104.997   3.971   3.599
  540    H    VAL  67           HN       VAL  67 107.021   3.413   6.587
  541    HA   VAL  67           HA       VAL  67 106.021   0.692   6.370
  542    HB   VAL  67           HB       VAL  67 108.465   0.614   7.053
  543   HG11  VAL  67          HG11      VAL  67 109.083   1.239   9.294
  544   HG12  VAL  67          HG12      VAL  67 107.496   1.981   9.535
  545   HG13  VAL  67          HG13      VAL  67 108.607   2.639   8.327
  546   HG21  VAL  67          HG21      VAL  67 106.951  -1.184   7.626
  547   HG22  VAL  67          HG22      VAL  67 106.483  -0.321   9.093
  548   HG23  VAL  67          HG23      VAL  67 108.132  -0.918   8.911
  549    H    ASN  68           HN       ASN  68 104.495   0.276   7.846
  550    HA   ASN  68           HA       ASN  68 102.597   1.734   8.838
  551    HB2  ASN  68           HB2      ASN  68 102.504  -0.466   9.348
  552    HB3  ASN  68           HB1      ASN  68 104.082  -0.501  10.133
  553   HD21  ASN  68          HD21      ASN  68 104.133  -0.049  12.330
  554   HD22  ASN  68          HD22      ASN  68 102.706  -0.085  13.274
  555    H    ASP  69           HN       ASP  69 102.630   3.700   9.468
  556    HA   ASP  69           HA       ASP  69 102.641   5.468  10.841
  557    HB2  ASP  69           HB2      ASP  69 102.738   4.283  12.905
  558    HB3  ASP  69           HB1      ASP  69 104.417   3.832  12.617
  559    H    THR  70           HN       THR  70 105.856   4.140  10.293
  560    HA   THR  70           HA       THR  70 106.822   6.876  10.500
  561    HB   THR  70           HB       THR  70 108.411   4.318  10.476
  562    HG1  THR  70           HG1      THR  70 106.923   5.584  12.409
  563   HG21  THR  70          HG21      THR  70 109.185   7.154  11.232
  564   HG22  THR  70          HG22      THR  70 109.717   6.298   9.785
  565   HG23  THR  70          HG23      THR  70 110.226   5.737  11.376
  566    H    CYS  71           HN       CYS  71 107.454   8.023   8.952
  567    HA   CYS  71           HA       CYS  71 107.313   7.102   6.232
  568    HB2  CYS  71           HB2      CYS  71 106.410   9.289   7.040
  569    HB3  CYS  71           HB1      CYS  71 108.052   9.799   7.375
  570    HG   CYS  71           HG       CYS  71 106.479   9.515   4.402
  571    H    VAL  72           HN       VAL  72 108.975   5.684   6.127
  572    HA   VAL  72           HA       VAL  72 111.686   6.458   6.764
  573    HB   VAL  72           HB       VAL  72 110.654   3.922   5.411
  574   HG11  VAL  72          HG11      VAL  72 112.705   2.866   6.173
  575   HG12  VAL  72          HG12      VAL  72 113.237   4.388   6.887
  576   HG13  VAL  72          HG13      VAL  72 113.066   4.248   5.137
  577   HG21  VAL  72          HG21      VAL  72 109.611   4.280   7.569
  578   HG22  VAL  72          HG22      VAL  72 111.202   4.433   8.321
  579   HG23  VAL  72          HG23      VAL  72 110.706   2.898   7.599
  580    H    LEU  73           HN       LEU  73 109.799   7.454   4.477
  581    HA   LEU  73           HA       LEU  73 110.979   7.037   1.971
  582    HB2  LEU  73           HB2      LEU  73 108.733   8.072   2.701
  583    HB3  LEU  73           HB1      LEU  73 109.672   9.503   3.027
  584    HG   LEU  73           HG       LEU  73 110.160   9.841   0.755
  585   HD11  LEU  73          HD11      LEU  73 110.339   7.499   0.032
  586   HD12  LEU  73          HD12      LEU  73 109.141   8.359  -0.948
  587   HD13  LEU  73          HD13      LEU  73 108.624   7.290   0.365
  588   HD21  LEU  73          HD21      LEU  73 108.122  10.710   1.704
  589   HD22  LEU  73          HD22      LEU  73 107.298   9.189   1.379
  590   HD23  LEU  73          HD23      LEU  73 107.830  10.196   0.039
  591    H    GLY  74           HN       GLY  74 113.074   7.445   1.680
  592    HA2  GLY  74           HA2      GLY  74 115.138   8.467   1.714
  593    HA3  GLY  74           HA1      GLY  74 114.222   9.966   1.823
  594    H    HIS  75           HN       HIS  75 114.345   7.320   4.148
  595    HA   HIS  75           HA       HIS  75 114.762   9.138   6.311
  596    HB2  HIS  75           HB2      HIS  75 113.869   6.431   6.045
  597    HB3  HIS  75           HB1      HIS  75 115.410   6.411   6.878
  598    HD1  HIS  75           HD1      HIS  75 112.358   8.693   7.366
  599    HD2  HIS  75           HD2      HIS  75 114.988   6.220   9.382
  600    HE1  HIS  75           HE1      HIS  75 111.647   8.773   9.767
  601    H    THR  76           HN       THR  76 116.633   9.203   7.547
  602    HA   THR  76           HA       THR  76 119.066   9.019   6.042
  603    HB   THR  76           HB       THR  76 118.472   9.662   8.923
  604    HG1  THR  76           HG1      THR  76 117.480  11.082   7.431
  605   HG21  THR  76          HG21      THR  76 120.946  10.347   7.318
  606   HG22  THR  76          HG22      THR  76 120.839   9.096   8.567
  607   HG23  THR  76          HG23      THR  76 120.620  10.786   9.003
  608    H    HIS  77           HN       HIS  77 120.684   7.372   6.332
  609    HA   HIS  77           HA       HIS  77 120.099   4.866   7.035
  610    HB2  HIS  77           HB2      HIS  77 122.154   5.424   5.878
  611    HB3  HIS  77           HB1      HIS  77 122.768   6.228   7.316
  612    HD1  HIS  77           HD1      HIS  77 121.549   2.603   6.643
  613    HD2  HIS  77           HD2      HIS  77 124.645   4.718   8.461
  614    HE1  HIS  77           HE1      HIS  77 123.130   0.898   7.532
  615    H    ALA  78           HN       ALA  78 121.559   7.153   9.196
  616    HA   ALA  78           HA       ALA  78 121.835   5.476  11.446
  617    HB1  ALA  78           HB1      ALA  78 122.988   7.606  11.284
  618    HB2  ALA  78           HB2      ALA  78 122.033   7.534  12.766
  619    HB3  ALA  78           HB3      ALA  78 121.453   8.463  11.381
  620    H    GLN  79           HN       GLN  79 119.140   7.346  10.256
  621    HA   GLN  79           HA       GLN  79 117.694   7.111  12.673
  622    HB2  GLN  79           HB2      GLN  79 116.901   7.995   9.940
  623    HB3  GLN  79           HB1      GLN  79 115.783   8.052  11.281
  624    HG2  GLN  79           HG2      GLN  79 118.349   9.605  10.922
  625    HG3  GLN  79           HG1      GLN  79 116.706  10.249  11.003
  626   HE21  GLN  79          HE21      GLN  79 119.002  10.977  12.534
  627   HE22  GLN  79          HE22      GLN  79 118.645  10.629  14.195
  628    H    VAL  80           HN       VAL  80 117.463   5.726   9.434
  629    HA   VAL  80           HA       VAL  80 115.266   4.102  10.003
  630    HB   VAL  80           HB       VAL  80 115.767   4.620   7.661
  631   HG11  VAL  80          HG11      VAL  80 118.221   2.897   7.888
  632   HG12  VAL  80          HG12      VAL  80 118.222   4.648   7.910
  633   HG13  VAL  80          HG13      VAL  80 117.673   3.805   6.468
  634   HG21  VAL  80          HG21      VAL  80 116.082   1.655   8.149
  635   HG22  VAL  80          HG22      VAL  80 115.403   2.423   6.707
  636   HG23  VAL  80          HG23      VAL  80 114.567   2.531   8.243
  637    H    VAL  81           HN       VAL  81 118.737   3.420  10.117
  638    HA   VAL  81           HA       VAL  81 118.381   0.676  10.739
  639    HB   VAL  81           HB       VAL  81 120.559   1.543   9.882
  640   HG11  VAL  81          HG11      VAL  81 120.803   3.548  11.222
  641   HG12  VAL  81          HG12      VAL  81 122.212   2.507  11.422
  642   HG13  VAL  81          HG13      VAL  81 120.981   2.578  12.685
  643   HG21  VAL  81          HG21      VAL  81 120.756  -0.003  12.460
  644   HG22  VAL  81          HG22      VAL  81 122.019   0.089  11.235
  645   HG23  VAL  81          HG23      VAL  81 120.475  -0.675  10.856
  646    H    LYS  82           HN       LYS  82 118.569   3.503  12.735
  647    HA   LYS  82           HA       LYS  82 118.727   2.196  15.167
  648    HB2  LYS  82           HB2      LYS  82 119.201   4.482  15.039
  649    HB3  LYS  82           HB1      LYS  82 117.677   4.842  14.276
  650    HG2  LYS  82           HG2      LYS  82 117.663   3.812  17.083
  651    HG3  LYS  82           HG1      LYS  82 118.175   5.476  16.807
  652    HD2  LYS  82           HD2      LYS  82 115.537   4.275  15.934
  653    HD3  LYS  82           HD1      LYS  82 115.766   5.304  17.344
  654    HE2  LYS  82           HE2      LYS  82 116.232   6.129  14.451
  655    HE3  LYS  82           HE1      LYS  82 114.858   6.559  15.444
  656    HZ1  LYS  82           HZ1      LYS  82 116.264   7.850  16.875
  657    HZ2  LYS  82           HZ2      LYS  82 116.551   8.317  15.276
  658    HZ3  LYS  82           HZ3      LYS  82 117.665   7.360  16.062
  659    H    ILE  83           HN       ILE  83 115.850   2.949  13.201
  660    HA   ILE  83           HA       ILE  83 114.053   2.166  15.319
  661    HB   ILE  83           HB       ILE  83 113.491   2.674  12.373
  662   HG12  ILE  83          HG12      ILE  83 113.067   4.431  14.805
  663   HG13  ILE  83          HG11      ILE  83 114.337   4.636  13.608
  664   HG21  ILE  83          HG21      ILE  83 111.776   1.229  13.371
  665   HG22  ILE  83          HG22      ILE  83 111.123   2.836  13.051
  666   HG23  ILE  83          HG23      ILE  83 111.568   2.376  14.694
  667   HD11  ILE  83          HD11      ILE  83 112.518   6.203  13.267
  668   HD12  ILE  83          HD12      ILE  83 111.387   4.855  13.111
  669   HD13  ILE  83          HD13      ILE  83 112.657   5.087  11.906
  670    H    PHE  84           HN       PHE  84 115.113   0.916  12.260
  671    HA   PHE  84           HA       PHE  84 113.647  -1.445  12.321
  672    HB2  PHE  84           HB2      PHE  84 115.894  -0.384  10.684
  673    HB3  PHE  84           HB1      PHE  84 115.411  -2.041  10.508
  674    HD1  PHE  84           HD2      PHE  84 113.784   1.329  10.724
  675    HD2  PHE  84           HD1      PHE  84 113.876  -2.463   8.807
  676    HE1  PHE  84           HE2      PHE  84 111.974   2.047   9.227
  677    HE2  PHE  84           HE1      PHE  84 112.068  -1.752   7.305
  678    HZ   PHE  84           HZ       PHE  84 111.114   0.505   7.510
  679    H    GLN  85           HN       GLN  85 116.832  -0.708  13.587
  680    HA   GLN  85           HA       GLN  85 117.134  -3.481  14.228
  681    HB2  GLN  85           HB2      GLN  85 118.939  -1.134  14.596
  682    HB3  GLN  85           HB1      GLN  85 119.289  -2.692  15.367
  683    HG2  GLN  85           HG2      GLN  85 118.876  -2.243  12.425
  684    HG3  GLN  85           HG1      GLN  85 120.445  -2.307  13.221
  685   HE21  GLN  85          HE21      GLN  85 121.045  -4.043  11.980
  686   HE22  GLN  85          HE22      GLN  85 120.444  -5.637  12.232
  687    H    SER  86           HN       SER  86 115.663  -0.832  15.814
  688    HA   SER  86           HA       SER  86 116.092  -2.124  18.377
  689    HB2  SER  86           HB2      SER  86 114.991  -0.131  19.376
  690    HB3  SER  86           HB1      SER  86 116.435   0.246  18.438
  691    HG   SER  86           HG       SER  86 115.277   1.108  16.906
  692    H    ILE  87           HN       ILE  87 113.806  -2.391  15.944
  693    HA   ILE  87           HA       ILE  87 111.545  -2.670  17.425
  694    HB   ILE  87           HB       ILE  87 111.335  -4.664  15.524
  695   HG12  ILE  87          HG12      ILE  87 112.911  -2.389  14.364
  696   HG13  ILE  87          HG11      ILE  87 113.437  -4.065  14.522
  697   HG21  ILE  87          HG21      ILE  87 109.533  -3.327  15.892
  698   HG22  ILE  87          HG22      ILE  87 109.968  -3.094  14.233
  699   HG23  ILE  87          HG23      ILE  87 110.367  -1.827  15.429
  700   HD11  ILE  87          HD11      ILE  87 111.238  -2.983  12.838
  701   HD12  ILE  87          HD12      ILE  87 111.507  -4.675  13.100
  702   HD13  ILE  87          HD13      ILE  87 112.738  -3.735  12.238
  703    HA   PRO  88           HA       PRO  88 112.210  -6.661  19.456
  704    HB2  PRO  88           HB2      PRO  88 109.665  -6.801  20.391
  705    HB3  PRO  88           HB1      PRO  88 110.842  -5.636  21.005
  706    HG2  PRO  88           HG2      PRO  88 108.422  -5.096  19.522
  707    HG3  PRO  88           HG1      PRO  88 109.596  -3.927  20.149
  708    HD2  PRO  88           HD2      PRO  88 109.432  -5.140  17.402
  709    HD3  PRO  88           HD1      PRO  88 110.029  -3.570  17.812
  710    H    ILE  89           HN       ILE  89 111.771  -8.790  19.387
  711    HA   ILE  89           HA       ILE  89 110.826  -9.947  17.010
  712    HB   ILE  89           HB       ILE  89 111.145 -11.285  19.721
  713   HG12  ILE  89          HG12      ILE  89 113.144 -11.079  17.496
  714   HG13  ILE  89          HG11      ILE  89 113.178 -10.030  18.908
  715   HG21  ILE  89          HG21      ILE  89 111.524 -13.320  18.380
  716   HG22  ILE  89          HG22      ILE  89 111.188 -12.385  16.918
  717   HG23  ILE  89          HG23      ILE  89 109.917 -12.631  18.119
  718   HD11  ILE  89          HD11      ILE  89 113.522 -12.023  20.281
  719   HD12  ILE  89          HD12      ILE  89 114.774 -11.759  19.052
  720   HD13  ILE  89          HD13      ILE  89 113.545 -13.003  18.793
  721    H    GLY  90           HN       GLY  90 108.795 -10.451  16.428
  722    HA2  GLY  90           HA2      GLY  90 106.747 -11.566  16.884
  723    HA3  GLY  90           HA1      GLY  90 106.804 -10.912  18.514
  724    H    ALA  91           HN       ALA  91 107.688  -8.603  16.102
  725    HA   ALA  91           HA       ALA  91 105.061  -7.431  16.683
  726    HB1  ALA  91           HB1      ALA  91 106.045  -5.246  16.269
  727    HB2  ALA  91           HB2      ALA  91 107.576  -5.992  15.816
  728    HB3  ALA  91           HB3      ALA  91 106.984  -6.128  17.469
  729    H    SER  92           HN       SER  92 104.470  -5.692  14.811
  730    HA   SER  92           HA       SER  92 104.682  -6.987  12.201
  731    HB2  SER  92           HB2      SER  92 102.714  -7.892  13.228
  732    HB3  SER  92           HB1      SER  92 102.191  -6.294  13.760
  733    HG   SER  92           HG       SER  92 101.170  -6.268  11.949
  734    H    VAL  93           HN       VAL  93 104.369  -5.618  10.526
  735    HA   VAL  93           HA       VAL  93 103.496  -2.895  10.820
  736    HB   VAL  93           HB       VAL  93 105.427  -2.070   9.438
  737   HG11  VAL  93          HG11      VAL  93 106.134  -2.726  12.276
  738   HG12  VAL  93          HG12      VAL  93 105.107  -1.402  11.717
  739   HG13  VAL  93          HG13      VAL  93 106.795  -1.452  11.228
  740   HG21  VAL  93          HG21      VAL  93 106.461  -4.044   8.787
  741   HG22  VAL  93          HG22      VAL  93 106.648  -4.574  10.450
  742   HG23  VAL  93          HG23      VAL  93 107.585  -3.179   9.853
  743    H    ASP  94           HN       ASP  94 103.437  -1.867   8.835
  744    HA   ASP  94           HA       ASP  94 102.758  -3.664   6.648
  745    HB2  ASP  94           HB2      ASP  94 101.932  -0.897   7.443
  746    HB3  ASP  94           HB1      ASP  94 101.534  -1.561   5.887
  747    H    LEU  95           HN       LEU  95 104.486  -3.731   5.408
  748    HA   LEU  95           HA       LEU  95 106.316  -1.496   5.309
  749    HB2  LEU  95           HB2      LEU  95 106.792  -4.047   5.550
  750    HB3  LEU  95           HB1      LEU  95 106.556  -4.062   3.819
  751    HG   LEU  95           HG       LEU  95 108.386  -2.380   3.615
  752   HD11  LEU  95          HD11      LEU  95 109.875  -2.135   5.603
  753   HD12  LEU  95          HD12      LEU  95 108.644  -2.983   6.559
  754   HD13  LEU  95          HD13      LEU  95 108.283  -1.422   5.860
  755   HD21  LEU  95          HD21      LEU  95 110.155  -4.018   4.019
  756   HD22  LEU  95          HD22      LEU  95 108.727  -4.769   3.286
  757   HD23  LEU  95          HD23      LEU  95 109.034  -4.954   5.013
  758    H    GLU  96           HN       GLU  96 106.170  -0.060   3.730
  759    HA   GLU  96           HA       GLU  96 104.524  -0.641   1.390
  760    HB2  GLU  96           HB2      GLU  96 105.475   1.971   2.565
  761    HB3  GLU  96           HB1      GLU  96 104.398   1.799   1.190
  762    HG2  GLU  96           HG2      GLU  96 102.697   0.828   2.562
  763    HG3  GLU  96           HG1      GLU  96 103.787   0.787   3.945
  764    H    LEU  97           HN       LEU  97 105.688  -1.242  -0.264
  765    HA   LEU  97           HA       LEU  97 108.179   0.107  -0.789
  766    HB2  LEU  97           HB2      LEU  97 109.489  -1.871  -0.999
  767    HB3  LEU  97           HB1      LEU  97 108.751  -1.866   0.577
  768    HG   LEU  97           HG       LEU  97 108.042  -3.702  -1.755
  769   HD11  LEU  97          HD11      LEU  97 110.102  -4.114  -0.556
  770   HD12  LEU  97          HD12      LEU  97 108.916  -5.402  -0.423
  771   HD13  LEU  97          HD13      LEU  97 109.181  -4.284   0.938
  772   HD21  LEU  97          HD21      LEU  97 106.843  -3.640   1.021
  773   HD22  LEU  97          HD22      LEU  97 106.509  -4.815  -0.260
  774   HD23  LEU  97          HD23      LEU  97 106.007  -3.133  -0.451
  775    H    CYS  98           HN       CYS  98 108.923  -0.239  -2.929
  776    HA   CYS  98           HA       CYS  98 106.715  -0.940  -4.691
  777    HB2  CYS  98           HB2      CYS  98 108.945   1.039  -5.161
  778    HB3  CYS  98           HB1      CYS  98 107.694   0.623  -6.325
  779    HG   CYS  98           HG       CYS  98 106.356   2.708  -5.600
  780    H    ARG  99           HN       ARG  99 106.951  -2.460  -6.009
  781    HA   ARG  99           HA       ARG  99 109.479  -3.934  -6.180
  782    HB2  ARG  99           HB2      ARG  99 107.324  -5.048  -5.503
  783    HB3  ARG  99           HB1      ARG  99 106.685  -4.683  -7.091
  784    HG2  ARG  99           HG2      ARG  99 107.359  -6.863  -7.224
  785    HG3  ARG  99           HG1      ARG  99 108.692  -5.976  -7.977
  786    HD2  ARG  99           HD2      ARG  99 110.017  -7.037  -6.562
  787    HD3  ARG  99           HD1      ARG  99 109.342  -6.005  -5.293
  788    HE   ARG  99           HE       ARG  99 108.840  -8.763  -5.847
  789   HH11  ARG  99          HH11      ARG  99 108.207  -6.087  -3.720
  790   HH12  ARG  99          HH12      ARG  99 106.994  -6.858  -2.800
  791   HH21  ARG  99          HH21      ARG  99 107.194  -9.893  -4.669
  792   HH22  ARG  99          HH22      ARG  99 106.436  -9.127  -3.331
  793    H    GLY 100           HN       GLY 100 110.337  -4.344  -8.308
  794    HA2  GLY 100           HA2      GLY 100 109.549  -4.116 -10.754
  795    HA3  GLY 100           HA1      GLY 100 109.338  -2.428 -10.298
  796    H    TYR 101           HN       TYR 101 111.666  -2.806  -8.449
  797    HA   TYR 101           HA       TYR 101 113.659  -2.234 -10.437
  798    HB2  TYR 101           HB2      TYR 101 113.443  -1.743  -7.510
  799    HB3  TYR 101           HB1      TYR 101 115.053  -1.811  -8.208
  800    HD1  TYR 101           HD2      TYR 101 111.864   0.030  -8.175
  801    HD2  TYR 101           HD1      TYR 101 115.834  -0.113  -9.688
  802    HE1  TYR 101           HE2      TYR 101 111.653   2.354  -8.957
  803    HE2  TYR 101           HE1      TYR 101 115.632   2.198 -10.472
  804    HH   TYR 101           HH       TYR 101 113.938   3.782 -11.071
  805    HA   PRO 102           HA       PRO 102 115.383  -6.276  -9.915
  806    HB2  PRO 102           HB2      PRO 102 117.098  -6.186 -11.944
  807    HB3  PRO 102           HB1      PRO 102 115.357  -6.201 -12.254
  808    HG2  PRO 102           HG2      PRO 102 117.277  -3.917 -12.351
  809    HG3  PRO 102           HG1      PRO 102 115.895  -4.267 -13.402
  810    HD2  PRO 102           HD2      PRO 102 115.897  -2.488 -11.239
  811    HD3  PRO 102           HD1      PRO 102 114.461  -3.158 -12.036
  812    H    LEU 103           HN       LEU 103 117.746  -7.079  -9.861
  813    HA   LEU 103           HA       LEU 103 119.387  -5.065  -8.485
  814    HB2  LEU 103           HB2      LEU 103 118.246  -7.250  -7.305
  815    HB3  LEU 103           HB1      LEU 103 119.782  -7.900  -7.850
  816    HG   LEU 103           HG       LEU 103 119.894  -7.217  -5.501
  817   HD11  LEU 103          HD11      LEU 103 121.942  -7.064  -6.786
  818   HD12  LEU 103          HD12      LEU 103 121.837  -5.772  -5.579
  819   HD13  LEU 103          HD13      LEU 103 121.489  -5.426  -7.273
  820   HD21  LEU 103          HD21      LEU 103 118.250  -5.496  -5.447
  821   HD22  LEU 103          HD22      LEU 103 119.182  -4.494  -6.553
  822   HD23  LEU 103          HD23      LEU 103 119.791  -4.809  -4.934
  823    HA   PRO 104           HA       PRO 104 122.032  -6.749 -11.876
  824    HB2  PRO 104           HB2      PRO 104 122.471  -4.194 -12.970
  825    HB3  PRO 104           HB1      PRO 104 121.324  -5.383 -13.587
  826    HG2  PRO 104           HG2      PRO 104 120.701  -2.892 -12.422
  827    HG3  PRO 104           HG1      PRO 104 119.566  -4.195 -12.797
  828    HD2  PRO 104           HD2      PRO 104 120.846  -3.495 -10.186
  829    HD3  PRO 104           HD1      PRO 104 119.243  -4.182 -10.521
  830    H    PHE 105           HN       PHE 105 122.921  -6.660  -9.520
  831    HA   PHE 105           HA       PHE 105 125.510  -5.439  -9.524
  832    HB2  PHE 105           HB2      PHE 105 123.979  -3.635  -8.609
  833    HB3  PHE 105           HB1      PHE 105 123.411  -4.770  -7.406
  834    HD1  PHE 105           HD2      PHE 105 126.405  -2.921  -8.554
  835    HD2  PHE 105           HD1      PHE 105 124.521  -4.988  -5.355
  836    HE1  PHE 105           HE2      PHE 105 128.158  -2.136  -7.016
  837    HE2  PHE 105           HE1      PHE 105 126.264  -4.204  -3.810
  838    HZ   PHE 105           HZ       PHE 105 128.091  -2.778  -4.641
  839    H    ASP 106           HN       ASP 106 126.673  -6.534  -7.678
  840    HA   ASP 106           HA       ASP 106 125.614  -9.198  -7.392
  841    HB2  ASP 106           HB2      ASP 106 128.033  -8.027  -6.172
  842    HB3  ASP 106           HB1      ASP 106 127.639  -9.714  -6.134
  843    HA   PRO 107           HA       PRO 107 124.182  -8.128  -3.288
  844    HB2  PRO 107           HB2      PRO 107 122.825 -10.676  -3.248
  845    HB3  PRO 107           HB1      PRO 107 122.117  -9.118  -3.689
  846    HG2  PRO 107           HG2      PRO 107 122.398 -11.124  -5.569
  847    HG3  PRO 107           HG1      PRO 107 122.582  -9.378  -5.947
  848    HD2  PRO 107           HD2      PRO 107 124.725 -11.242  -5.138
  849    HD3  PRO 107           HD1      PRO 107 124.627 -10.475  -6.680
  850    H    ASP 108           HN       ASP 108 126.431  -9.911  -4.316
  851    HA   ASP 108           HA       ASP 108 126.803 -11.726  -2.166
  852    HB2  ASP 108           HB2      ASP 108 126.816 -12.677  -4.374
  853    HB3  ASP 108           HB1      ASP 108 128.065 -11.559  -4.893
  854    H    ASP 109           HN       ASP 109 127.646  -8.703  -3.300
  855    HA   ASP 109           HA       ASP 109 130.471  -8.717  -2.565
  856    HB2  ASP 109           HB2      ASP 109 129.843  -7.912  -4.805
  857    HB3  ASP 109           HB1      ASP 109 128.839  -6.668  -4.070
  858    HA   PRO 110           HA       PRO 110 129.070  -6.453   1.222
  859    HB2  PRO 110           HB2      PRO 110 131.775  -7.249   1.995
  860    HB3  PRO 110           HB1      PRO 110 130.301  -7.600   2.853
  861    HG2  PRO 110           HG2      PRO 110 131.598  -9.541   1.623
  862    HG3  PRO 110           HG1      PRO 110 129.841  -9.447   1.369
  863    HD2  PRO 110           HD2      PRO 110 132.032  -8.370  -0.394
  864    HD3  PRO 110           HD1      PRO 110 130.688  -9.470  -0.808
  865    H    ASN 111           HN       ASN 111 131.331  -5.590   2.725
  866    HA   ASN 111           HA       ASN 111 133.174  -4.683   2.888
  867    HB2  ASN 111           HB2      ASN 111 132.993  -3.449   0.157
  868    HB3  ASN 111           HB1      ASN 111 134.276  -3.200   1.343
  869   HD21  ASN 111          HD21      ASN 111 134.193  -6.073   2.189
  870   HD22  ASN 111          HD22      ASN 111 134.960  -6.917   0.904
  871    H    THR 112           HN       THR 112 131.162  -2.443   1.160
  872    HA   THR 112           HA       THR 112 130.480  -0.896   3.408
  873    HB   THR 112           HB       THR 112 133.052  -0.532   3.335
  874    HG1  THR 112           HG1      THR 112 131.752   0.929   4.445
  875   HG21  THR 112          HG21      THR 112 133.296  -0.321   0.892
  876   HG22  THR 112          HG22      THR 112 133.866   1.147   1.700
  877   HG23  THR 112          HG23      THR 112 132.275   1.118   0.930
  878    H    SER 113           HN       SER 113 129.709   1.370   2.597
  879    HA   SER 113           HA       SER 113 128.554   1.090  -0.028
  880    HB2  SER 113           HB2      SER 113 128.171   3.048   2.207
  881    HB3  SER 113           HB1      SER 113 127.291   3.000   0.678
  882    HG   SER 113           HG       SER 113 126.282   1.226   1.255
  883    H    LEU 114           HN       LEU 114 129.810   1.720  -1.543
  884    HA   LEU 114           HA       LEU 114 131.786   3.686  -1.233
  885    HB2  LEU 114           HB2      LEU 114 132.171   3.315  -3.639
  886    HB3  LEU 114           HB1      LEU 114 132.199   1.846  -2.715
  887    HG   LEU 114           HG       LEU 114 131.245   1.357  -4.805
  888   HD11  LEU 114          HD11      LEU 114 129.128   0.408  -4.458
  889   HD12  LEU 114          HD12      LEU 114 128.839   1.400  -3.060
  890   HD13  LEU 114          HD13      LEU 114 130.129   0.175  -3.023
  891   HD21  LEU 114          HD21      LEU 114 130.611   3.549  -5.601
  892   HD22  LEU 114          HD22      LEU 114 129.279   3.583  -4.438
  893   HD23  LEU 114          HD23      LEU 114 129.250   2.428  -5.771
  894    H    VAL 115           HN       VAL 115 131.691   5.786  -1.827
  895    HA   VAL 115           HA       VAL 115 129.032   6.671  -2.574
  896    HB   VAL 115           HB       VAL 115 131.342   8.413  -1.681
  897   HG11  VAL 115          HG11      VAL 115 129.717   9.567  -3.163
  898   HG12  VAL 115          HG12      VAL 115 129.645  10.176  -1.512
  899   HG13  VAL 115          HG13      VAL 115 128.414   9.065  -2.092
  900   HG21  VAL 115          HG21      VAL 115 130.126   8.664   0.428
  901   HG22  VAL 115          HG22      VAL 115 130.529   6.967   0.146
  902   HG23  VAL 115          HG23      VAL 115 128.888   7.551  -0.149
  903    H    THR 116           HN       THR 116 128.829   6.618  -4.638
  904    HA   THR 116           HA       THR 116 131.003   7.681  -6.232
  905    HB   THR 116           HB       THR 116 129.997   5.528  -7.048
  906    HG1  THR 116           HG1      THR 116 130.286   6.119  -8.991
  907   HG21  THR 116          HG21      THR 116 127.746   5.542  -8.042
  908   HG22  THR 116          HG22      THR 116 127.540   7.201  -7.466
  909   HG23  THR 116          HG23      THR 116 127.698   5.877  -6.302
  910    H    SER 117           HN       SER 117 130.511   9.419  -7.624
  911    HA   SER 117           HA       SER 117 128.170  10.992  -6.930
  912    HB2  SER 117           HB2      SER 117 129.643  12.929  -6.378
  913    HB3  SER 117           HB1      SER 117 129.755  11.614  -5.210
  914    HG   SER 117           HG       SER 117 131.581  11.025  -6.897
  915    H    VAL 118           HN       VAL 118 128.275  12.977  -8.273
  916    HA   VAL 118           HA       VAL 118 129.273  12.287 -10.901
  917    HB   VAL 118           HB       VAL 118 126.966  12.874 -10.971
  918   HG11  VAL 118          HG11      VAL 118 126.027  14.934 -10.016
  919   HG12  VAL 118          HG12      VAL 118 127.625  15.333  -9.366
  920   HG13  VAL 118          HG13      VAL 118 126.786  13.885  -8.809
  921   HG21  VAL 118          HG21      VAL 118 128.222  13.871 -12.794
  922   HG22  VAL 118          HG22      VAL 118 128.547  15.302 -11.811
  923   HG23  VAL 118          HG23      VAL 118 126.896  14.938 -12.318
  924    H    ALA 119           HN       ALA 119 131.318  12.797 -11.056
  925    HA   ALA 119           HA       ALA 119 132.148  15.514 -10.507
  926    HB1  ALA 119           HB1      ALA 119 133.523  13.099  -9.353
  927    HB2  ALA 119           HB2      ALA 119 132.468  14.175  -8.455
  928    HB3  ALA 119           HB3      ALA 119 133.980  14.792  -9.127
  929    H    ILE 120           HN       ILE 120 132.097  15.391 -12.847
  930    HA   ILE 120           HA       ILE 120 134.567  14.166 -13.901
  931    HB   ILE 120           HB       ILE 120 132.062  15.080 -15.346
  932   HG12  ILE 120          HG12      ILE 120 131.988  12.608 -16.123
  933   HG13  ILE 120          HG11      ILE 120 133.136  12.300 -14.834
  934   HG21  ILE 120          HG21      ILE 120 133.980  15.532 -16.756
  935   HG22  ILE 120          HG22      ILE 120 133.065  14.182 -17.429
  936   HG23  ILE 120          HG23      ILE 120 134.560  13.879 -16.544
  937   HD11  ILE 120          HD11      ILE 120 130.876  11.742 -14.151
  938   HD12  ILE 120          HD12      ILE 120 130.340  13.384 -14.511
  939   HD13  ILE 120          HD13      ILE 120 131.485  13.098 -13.202
  940    H    LEU 121           HN       LEU 121 132.744  16.912 -13.382
  941    HA   LEU 121           HA       LEU 121 134.481  18.699 -14.895
  942    HB2  LEU 121           HB2      LEU 121 132.715  20.269 -14.966
  943    HB3  LEU 121           HB1      LEU 121 132.077  18.681 -15.316
  944    HG   LEU 121           HG       LEU 121 130.424  19.706 -14.136
  945   HD11  LEU 121          HD11      LEU 121 131.787  18.102 -12.017
  946   HD12  LEU 121          HD12      LEU 121 130.676  17.514 -13.246
  947   HD13  LEU 121          HD13      LEU 121 130.101  18.616 -11.992
  948   HD21  LEU 121          HD21      LEU 121 132.415  20.783 -12.174
  949   HD22  LEU 121          HD22      LEU 121 130.673  20.898 -11.968
  950   HD23  LEU 121          HD23      LEU 121 131.446  21.687 -13.341
  951    H    ASP 122           HN       ASP 122 133.805  17.703 -11.872
  952    HA   ASP 122           HA       ASP 122 135.633  19.522 -10.588
  953    HB2  ASP 122           HB2      ASP 122 133.552  20.759 -10.444
  954    HB3  ASP 122           HB1      ASP 122 132.729  19.381  -9.704
  955    H    LYS 123           HN       LYS 123 136.814  17.832 -10.079
  956    HA   LYS 123           HA       LYS 123 135.591  15.812  -8.406
  957    HB2  LYS 123           HB2      LYS 123 137.107  14.169  -9.644
  958    HB3  LYS 123           HB1      LYS 123 135.581  14.637 -10.378
  959    HG2  LYS 123           HG2      LYS 123 136.856  16.297 -11.744
  960    HG3  LYS 123           HG1      LYS 123 138.341  15.594 -11.098
  961    HD2  LYS 123           HD2      LYS 123 137.765  13.440 -12.007
  962    HD3  LYS 123           HD1      LYS 123 136.196  14.054 -12.516
  963    HE2  LYS 123           HE2      LYS 123 137.645  13.930 -14.415
  964    HE3  LYS 123           HE1      LYS 123 137.263  15.600 -14.003
  965    HZ1  LYS 123           HZ1      LYS 123 139.800  14.239 -13.193
  966    HZ2  LYS 123           HZ2      LYS 123 139.474  15.898 -13.086
  967    HZ3  LYS 123           HZ3      LYS 123 139.658  15.153 -14.586
  968    H    GLU 124           HN       GLU 124 136.604  15.329  -6.711
  969    HA   GLU 124           HA       GLU 124 139.274  16.343  -6.380
  970    HB2  GLU 124           HB2      GLU 124 138.871  16.010  -3.934
  971    HB3  GLU 124           HB1      GLU 124 137.745  17.129  -4.665
  972    HG2  GLU 124           HG2      GLU 124 137.143  14.256  -3.947
  973    HG3  GLU 124           HG1      GLU 124 136.692  15.660  -2.991
  974    HA   PRO 125           HA       PRO 125 140.563  12.191  -7.123
  975    HB2  PRO 125           HB2      PRO 125 143.209  12.579  -6.682
  976    HB3  PRO 125           HB1      PRO 125 142.393  13.120  -8.154
  977    HG2  PRO 125           HG2      PRO 125 143.152  14.676  -5.721
  978    HG3  PRO 125           HG1      PRO 125 143.278  15.135  -7.431
  979    HD2  PRO 125           HD2      PRO 125 141.294  15.994  -5.805
  980    HD3  PRO 125           HD1      PRO 125 141.080  15.754  -7.552
  981    H1   ARG 151           HT1      ARG 151 122.959  14.633  -2.215
  982    H2   ARG 151           HT2      ARG 151 121.600  13.650  -2.151
  983    H3   ARG 151           HT3      ARG 151 121.445  15.332  -2.071
  984    HA   ARG 151           HA       ARG 151 121.368  13.782  -4.333
  985    HB2  ARG 151           HB2      ARG 151 120.139  15.858  -4.063
  986    HB3  ARG 151           HB1      ARG 151 121.618  16.772  -3.889
  987    HG2  ARG 151           HG2      ARG 151 120.468  17.128  -6.047
  988    HG3  ARG 151           HG1      ARG 151 122.113  16.536  -6.223
  989    HD2  ARG 151           HD2      ARG 151 120.471  15.514  -7.801
  990    HD3  ARG 151           HD1      ARG 151 121.323  14.341  -6.821
  991    HE   ARG 151           HE       ARG 151 119.123  14.530  -5.401
  992   HH11  ARG 151          HH11      ARG 151 119.287  14.569  -8.957
  993   HH12  ARG 151          HH12      ARG 151 117.784  13.783  -9.101
  994   HH21  ARG 151          HH21      ARG 151 117.247  13.476  -5.640
  995   HH22  ARG 151          HH22      ARG 151 116.582  13.108  -7.194
  996    H    SER 152           HN       SER 152 122.685  13.625  -6.152
  997    HA   SER 152           HA       SER 152 124.439  13.817  -7.535
  998    HB2  SER 152           HB2      SER 152 125.852  15.444  -5.401
  999    HB3  SER 152           HB1      SER 152 126.370  15.260  -7.079
 1000    HG   SER 152           HG       SER 152 124.659  16.990  -6.020
 1001    H    SER 153           HN       SER 153 125.258  13.294  -4.174
 1002    HA   SER 153           HA       SER 153 127.162  11.254  -4.824
 1003    HB2  SER 153           HB2      SER 153 126.031  12.186  -2.191
 1004    HB3  SER 153           HB1      SER 153 127.495  11.220  -2.423
 1005    HG   SER 153           HG       SER 153 128.489  13.026  -2.583
 1006    H    ARG 154           HN       ARG 154 126.715   9.152  -4.810
 1007    HA   ARG 154           HA       ARG 154 124.071   8.187  -3.955
 1008    HB2  ARG 154           HB2      ARG 154 124.556   8.021  -6.399
 1009    HB3  ARG 154           HB1      ARG 154 126.003   7.106  -6.024
 1010    HG2  ARG 154           HG2      ARG 154 124.251   5.627  -6.775
 1011    HG3  ARG 154           HG1      ARG 154 124.601   5.321  -5.072
 1012    HD2  ARG 154           HD2      ARG 154 122.187   5.354  -5.552
 1013    HD3  ARG 154           HD1      ARG 154 122.664   6.605  -4.408
 1014    HE   ARG 154           HE       ARG 154 122.351   7.176  -7.261
 1015   HH11  ARG 154          HH11      ARG 154 121.587   7.951  -3.865
 1016   HH12  ARG 154          HH12      ARG 154 120.592   9.280  -4.269
 1017   HH21  ARG 154          HH21      ARG 154 121.030   9.054  -7.779
 1018   HH22  ARG 154          HH22      ARG 154 120.265   9.908  -6.513
 1019    H    THR 155           HN       THR 155 124.234   6.864  -2.196
 1020    HA   THR 155           HA       THR 155 126.964   5.929  -1.535
 1021    HB   THR 155           HB       THR 155 124.732   6.570   0.390
 1022    HG1  THR 155           HG1      THR 155 125.754   8.262  -1.014
 1023   HG21  THR 155          HG21      THR 155 126.581   6.585   2.028
 1024   HG22  THR 155          HG22      THR 155 127.707   6.109   0.748
 1025   HG23  THR 155          HG23      THR 155 126.426   5.014   1.246
 1026    H    ARG 156           HN       ARG 156 123.489   5.114  -0.996
 1027    HA   ARG 156           HA       ARG 156 122.427   3.205  -0.773
 1028    HB2  ARG 156           HB2      ARG 156 124.720   1.929  -2.301
 1029    HB3  ARG 156           HB1      ARG 156 123.093   1.287  -2.156
 1030    HG2  ARG 156           HG2      ARG 156 122.223   3.211  -3.388
 1031    HG3  ARG 156           HG1      ARG 156 123.865   3.825  -3.560
 1032    HD2  ARG 156           HD2      ARG 156 123.436   2.736  -5.587
 1033    HD3  ARG 156           HD1      ARG 156 124.393   1.591  -4.655
 1034    HE   ARG 156           HE       ARG 156 121.593   1.189  -4.324
 1035   HH11  ARG 156          HH11      ARG 156 124.398   0.363  -6.308
 1036   HH12  ARG 156          HH12      ARG 156 123.640  -0.827  -7.222
 1037   HH21  ARG 156          HH21      ARG 156 120.462  -0.489  -5.573
 1038   HH22  ARG 156          HH22      ARG 156 121.297  -1.360  -6.765
 1039    H    ARG 157           HN       ARG 157 122.870   3.510   1.512
 1040    HA   ARG 157           HA       ARG 157 125.040   2.079   2.693
 1041    HB2  ARG 157           HB2      ARG 157 122.971   3.949   3.605
 1042    HB3  ARG 157           HB1      ARG 157 123.501   2.772   4.795
 1043    HG2  ARG 157           HG2      ARG 157 125.503   4.384   3.260
 1044    HG3  ARG 157           HG1      ARG 157 124.679   5.066   4.660
 1045    HD2  ARG 157           HD2      ARG 157 126.839   4.089   5.290
 1046    HD3  ARG 157           HD1      ARG 157 125.502   3.247   6.060
 1047    HE   ARG 157           HE       ARG 157 126.677   2.137   3.607
 1048   HH11  ARG 157          HH11      ARG 157 126.178   1.827   7.117
 1049   HH12  ARG 157          HH12      ARG 157 126.733   0.231   7.183
 1050   HH21  ARG 157          HH21      ARG 157 127.441  -0.077   3.702
 1051   HH22  ARG 157          HH22      ARG 157 127.511  -0.881   5.182
 1052    H    GLU 158           HN       GLU 158 125.109   0.141   3.426
 1053    HA   GLU 158           HA       GLU 158 122.896  -1.597   3.143
 1054    HB2  GLU 158           HB2      GLU 158 125.165  -2.407   2.770
 1055    HB3  GLU 158           HB1      GLU 158 125.586  -2.059   4.444
 1056    HG2  GLU 158           HG2      GLU 158 123.888  -3.708   5.166
 1057    HG3  GLU 158           HG1      GLU 158 123.587  -4.097   3.475
 1058    H    THR 159           HN       THR 159 121.317  -1.505   4.441
 1059    HA   THR 159           HA       THR 159 121.837  -1.365   7.321
 1060    HB   THR 159           HB       THR 159 119.197  -0.733   5.945
 1061    HG1  THR 159           HG1      THR 159 120.794   0.763   5.273
 1062   HG21  THR 159          HG21      THR 159 120.273  -0.096   8.708
 1063   HG22  THR 159          HG22      THR 159 119.066  -1.310   8.348
 1064   HG23  THR 159          HG23      THR 159 118.696   0.394   8.100
 1065    H    GLN 160           HN       GLN 160 122.084  -3.544   7.698
 1066    HA   GLN 160           HA       GLN 160 120.335  -5.395   6.434
 1067    HB2  GLN 160           HB2      GLN 160 121.527  -7.147   7.604
 1068    HB3  GLN 160           HB1      GLN 160 122.709  -6.001   7.007
 1069    HG2  GLN 160           HG2      GLN 160 121.743  -6.388   9.824
 1070    HG3  GLN 160           HG1      GLN 160 123.286  -6.891   9.163
 1071   HE21  GLN 160          HE21      GLN 160 122.775  -5.241  11.438
 1072   HE22  GLN 160          HE22      GLN 160 123.526  -3.723  11.182
 1073    H    VAL 161           HN       VAL 161 118.364  -5.930   7.096
 1074    HA   VAL 161           HA       VAL 161 117.836  -5.288   9.834
 1075    HB   VAL 161           HB       VAL 161 115.500  -4.726   9.292
 1076   HG11  VAL 161          HG11      VAL 161 117.099  -2.887   9.266
 1077   HG12  VAL 161          HG12      VAL 161 115.768  -2.720   8.091
 1078   HG13  VAL 161          HG13      VAL 161 117.361  -3.195   7.527
 1079   HG21  VAL 161          HG21      VAL 161 116.288  -5.024   6.430
 1080   HG22  VAL 161          HG22      VAL 161 114.743  -4.443   7.047
 1081   HG23  VAL 161          HG23      VAL 161 115.233  -6.128   7.311
  Start of MODEL    5
    1    H1   GLY  -3           HT1      GLY  -3 125.728  15.986 -10.326
    2    H2   GLY  -3           HT2      GLY  -3 126.151  14.424 -10.839
    3    H3   GLY  -3           HT3      GLY  -3 124.714  14.683  -9.971
    4    HA2  GLY  -3           HA1      GLY  -3 125.328  15.699 -12.659
    5    HA3  GLY  -3           HA2      GLY  -3 124.257  14.353 -12.285
    6    H    ALA  -2           HN       ALA  -2 124.016  17.245 -13.403
    7    HA   ALA  -2           HA       ALA  -2 122.120  18.437 -11.576
    8    HB1  ALA  -2           HB1      ALA  -2 123.652  19.845 -12.897
    9    HB2  ALA  -2           HB2      ALA  -2 121.964  20.216 -13.242
   10    HB3  ALA  -2           HB3      ALA  -2 122.904  19.255 -14.380
   11    H    MET  -1           HN       MET  -1 122.117  16.990 -14.790
   12    HA   MET  -1           HA       MET  -1 119.298  16.326 -14.464
   13    HB2  MET  -1           HB2      MET  -1 119.520  18.261 -16.020
   14    HB3  MET  -1           HB1      MET  -1 120.681  17.348 -16.966
   15    HG2  MET  -1           HG2      MET  -1 118.940  15.732 -17.549
   16    HG3  MET  -1           HG1      MET  -1 117.778  16.634 -16.583
   17    HE1  MET  -1           HE1      MET  -1 119.750  18.326 -20.402
   18    HE2  MET  -1           HE2      MET  -1 120.091  16.713 -19.780
   19    HE3  MET  -1           HE3      MET  -1 120.602  18.136 -18.873
   20    H    GLY   0           HN       GLY   0 118.805  14.298 -15.554
   21    HA2  GLY   0           HA2      GLY   0 119.586  12.489 -16.902
   22    HA3  GLY   0           HA1      GLY   0 121.213  12.812 -16.337
   23    H    LYS   1           HN       LYS   1 118.784  13.053 -14.046
   24    HA   LYS   1           HA       LYS   1 119.647  10.548 -12.871
   25    HB2  LYS   1           HB2      LYS   1 118.191  12.850 -11.600
   26    HB3  LYS   1           HB1      LYS   1 118.721  11.394 -10.770
   27    HG2  LYS   1           HG2      LYS   1 120.470  12.700 -10.237
   28    HG3  LYS   1           HG1      LYS   1 121.044  12.158 -11.806
   29    HD2  LYS   1           HD2      LYS   1 121.367  14.515 -11.716
   30    HD3  LYS   1           HD1      LYS   1 120.006  14.220 -12.799
   31    HE2  LYS   1           HE2      LYS   1 119.438  14.502  -9.998
   32    HE3  LYS   1           HE1      LYS   1 119.928  16.033 -10.784
   33    HZ1  LYS   1           HZ1      LYS   1 117.952  15.470 -12.348
   34    HZ2  LYS   1           HZ2      LYS   1 117.583  15.915 -10.786
   35    HZ3  LYS   1           HZ3      LYS   1 117.485  14.324 -11.187
   36    HA   PRO   2           HA       PRO   2 115.434   8.949 -13.541
   37    HB2  PRO   2           HB2      PRO   2 115.517   7.859 -10.804
   38    HB3  PRO   2           HB1      PRO   2 115.323   7.005 -12.337
   39    HG2  PRO   2           HG2      PRO   2 117.533   6.840 -10.914
   40    HG3  PRO   2           HG1      PRO   2 117.596   6.841 -12.689
   41    HD2  PRO   2           HD2      PRO   2 118.209   9.048 -10.755
   42    HD3  PRO   2           HD1      PRO   2 119.021   8.630 -12.282
   43    H    PHE   3           HN       PHE   3 113.356   8.951 -12.476
   44    HA   PHE   3           HA       PHE   3 112.758  11.528 -11.589
   45    HB2  PHE   3           HB2      PHE   3 110.390  10.583 -11.428
   46    HB3  PHE   3           HB1      PHE   3 111.188  10.469 -13.004
   47    HD1  PHE   3           HD2      PHE   3 110.119   8.666 -10.050
   48    HD2  PHE   3           HD1      PHE   3 111.649   8.370 -13.965
   49    HE1  PHE   3           HE2      PHE   3 109.628   6.293 -10.026
   50    HE2  PHE   3           HE1      PHE   3 111.170   5.943 -13.992
   51    HZ   PHE   3           HZ       PHE   3 110.154   4.890 -12.006
   52    H    PHE   4           HN       PHE   4 112.311  12.248  -9.705
   53    HA   PHE   4           HA       PHE   4 112.187  10.516  -7.368
   54    HB2  PHE   4           HB2      PHE   4 114.554  10.896  -7.420
   55    HB3  PHE   4           HB1      PHE   4 114.293  12.581  -7.852
   56    HD1  PHE   4           HD1      PHE   4 113.713  14.250  -6.225
   57    HD2  PHE   4           HD2      PHE   4 114.341  10.208  -4.969
   58    HE1  PHE   4           HE1      PHE   4 113.736  14.975  -3.925
   59    HE2  PHE   4           HE2      PHE   4 114.390  10.966  -2.665
   60    HZ   PHE   4           HZ       PHE   4 114.097  13.337  -2.115
   61    H    THR   5           HN       THR   5 110.802  11.251  -5.991
   62    HA   THR   5           HA       THR   5 111.137  13.844  -5.061
   63    HB   THR   5           HB       THR   5 109.434  14.428  -6.651
   64    HG1  THR   5           HG1      THR   5 109.499  15.308  -4.412
   65   HG21  THR   5          HG21      THR   5 108.214  12.283  -6.795
   66   HG22  THR   5          HG22      THR   5 107.100  13.600  -6.446
   67   HG23  THR   5          HG23      THR   5 107.620  12.513  -5.162
   68    H    ARG   6           HN       ARG   6 109.491  10.993  -4.668
   69    HA   ARG   6           HA       ARG   6 110.216  10.090  -2.129
   70    HB2  ARG   6           HB2      ARG   6 108.684  11.100  -0.521
   71    HB3  ARG   6           HB1      ARG   6 109.706  12.325  -1.230
   72    HG2  ARG   6           HG2      ARG   6 107.597  12.651  -2.862
   73    HG3  ARG   6           HG1      ARG   6 106.794  11.883  -1.516
   74    HD2  ARG   6           HD2      ARG   6 108.655  14.126  -1.135
   75    HD3  ARG   6           HD1      ARG   6 106.913  14.394  -1.356
   76    HE   ARG   6           HE       ARG   6 106.587  12.992   0.624
   77   HH11  ARG   6          HH11      ARG   6 109.842  14.443   0.300
   78   HH12  ARG   6          HH12      ARG   6 110.150  14.431   1.976
   79   HH21  ARG   6          HH21      ARG   6 107.064  12.986   2.925
   80   HH22  ARG   6          HH22      ARG   6 108.531  13.627   3.497
   81    H    ASN   7           HN       ASN   7 107.831  10.946  -4.200
   82    HA   ASN   7           HA       ASN   7 105.583   9.671  -3.236
   83    HB2  ASN   7           HB2      ASN   7 105.496  11.464  -4.702
   84    HB3  ASN   7           HB1      ASN   7 106.498  10.632  -5.867
   85   HD21  ASN   7          HD21      ASN   7 105.189  11.141  -7.233
   86   HD22  ASN   7          HD22      ASN   7 103.662  10.372  -7.632
   87    HA   PRO   8           HA       PRO   8 106.653   5.305  -3.830
   88    HB2  PRO   8           HB2      PRO   8 103.852   4.977  -3.679
   89    HB3  PRO   8           HB1      PRO   8 104.953   4.305  -2.594
   90    HG2  PRO   8           HG2      PRO   8 103.191   6.399  -2.316
   91    HG3  PRO   8           HG1      PRO   8 104.432   6.029  -1.091
   92    HD2  PRO   8           HD2      PRO   8 104.132   8.257  -2.738
   93    HD3  PRO   8           HD1      PRO   8 105.562   7.949  -1.729
   94    H    SER   9           HN       SER   9 103.986   7.009  -5.003
   95    HA   SER   9           HA       SER   9 103.264   5.044  -6.688
   96    HB2  SER   9           HB2      SER   9 102.430   7.648  -5.908
   97    HB3  SER   9           HB1      SER   9 101.509   6.918  -7.299
   98    HG   SER   9           HG       SER   9 100.936   5.330  -5.844
   99    H    GLU  10           HN       GLU  10 105.562   7.704  -6.945
  100    HA   GLU  10           HA       GLU  10 105.345   8.015  -9.798
  101    HB2  GLU  10           HB2      GLU  10 107.340   9.377  -9.678
  102    HB3  GLU  10           HB1      GLU  10 106.376   9.797  -8.259
  103    HG2  GLU  10           HG2      GLU  10 107.885   8.220  -6.976
  104    HG3  GLU  10           HG1      GLU  10 108.882   8.136  -8.419
  105    H    LEU  11           HN       LEU  11 107.087   6.199  -7.423
  106    HA   LEU  11           HA       LEU  11 108.976   4.902  -8.987
  107    HB2  LEU  11           HB2      LEU  11 107.467   3.838  -6.614
  108    HB3  LEU  11           HB1      LEU  11 108.893   3.094  -7.308
  109    HG   LEU  11           HG       LEU  11 108.792   5.821  -6.009
  110   HD11  LEU  11          HD11      LEU  11 110.162   4.787  -4.281
  111   HD12  LEU  11          HD12      LEU  11 110.034   3.239  -5.118
  112   HD13  LEU  11          HD13      LEU  11 108.593   3.985  -4.423
  113   HD21  LEU  11          HD21      LEU  11 111.106   4.269  -7.160
  114   HD22  LEU  11          HD22      LEU  11 111.242   5.769  -6.243
  115   HD23  LEU  11          HD23      LEU  11 110.435   5.764  -7.811
  116    H    LYS  12           HN       LYS  12 109.011   3.453 -10.302
  117    HA   LYS  12           HA       LYS  12 106.608   2.756 -11.706
  118    HB2  LYS  12           HB2      LYS  12 108.062   1.730 -13.350
  119    HB3  LYS  12           HB1      LYS  12 108.557   3.365 -12.955
  120    HG2  LYS  12           HG2      LYS  12 110.464   2.706 -11.929
  121    HG3  LYS  12           HG1      LYS  12 109.746   1.164 -11.443
  122    HD2  LYS  12           HD2      LYS  12 110.259   1.839 -14.300
  123    HD3  LYS  12           HD1      LYS  12 111.565   1.110 -13.323
  124    HE2  LYS  12           HE2      LYS  12 110.087  -0.822 -12.931
  125    HE3  LYS  12           HE1      LYS  12 108.810  -0.057 -13.866
  126    HZ1  LYS  12           HZ1      LYS  12 110.009  -1.710 -15.149
  127    HZ2  LYS  12           HZ2      LYS  12 111.461  -0.886 -14.934
  128    HZ3  LYS  12           HZ3      LYS  12 110.215  -0.181 -15.819
  129    H    GLY  13           HN       GLY  13 106.699   0.506 -12.776
  130    HA2  GLY  13           HA2      GLY  13 106.446  -1.777 -12.580
  131    HA3  GLY  13           HA1      GLY  13 107.328  -1.697 -11.063
  132    H    LYS  14           HN       LYS  14 106.258  -2.118  -9.357
  133    HA   LYS  14           HA       LYS  14 103.355  -1.779  -9.285
  134    HB2  LYS  14           HB2      LYS  14 103.212  -3.879  -7.926
  135    HB3  LYS  14           HB1      LYS  14 103.504  -4.127  -9.648
  136    HG2  LYS  14           HG2      LYS  14 105.707  -3.908  -7.788
  137    HG3  LYS  14           HG1      LYS  14 104.849  -5.439  -7.737
  138    HD2  LYS  14           HD2      LYS  14 106.129  -4.216 -10.205
  139    HD3  LYS  14           HD1      LYS  14 106.846  -5.517  -9.255
  140    HE2  LYS  14           HE2      LYS  14 104.909  -6.917  -9.740
  141    HE3  LYS  14           HE1      LYS  14 104.212  -5.640 -10.728
  142    HZ1  LYS  14           HZ1      LYS  14 105.330  -7.270 -12.099
  143    HZ2  LYS  14           HZ2      LYS  14 106.789  -7.042 -11.295
  144    HZ3  LYS  14           HZ3      LYS  14 106.114  -5.793 -12.208
  145    H    PHE  15           HN       PHE  15 102.482  -1.634  -7.219
  146    HA   PHE  15           HA       PHE  15 104.321  -0.528  -5.262
  147    HB2  PHE  15           HB2      PHE  15 102.889   1.072  -6.562
  148    HB3  PHE  15           HB1      PHE  15 101.492   0.174  -6.010
  149    HD1  PHE  15           HD2      PHE  15 103.953   0.505  -3.459
  150    HD2  PHE  15           HD1      PHE  15 100.817   2.510  -5.448
  151    HE1  PHE  15           HE2      PHE  15 103.775   2.067  -1.574
  152    HE2  PHE  15           HE1      PHE  15 100.628   4.110  -3.580
  153    HZ   PHE  15           HZ       PHE  15 102.114   3.894  -1.642
  154    H    ILE  16           HN       ILE  16 104.280  -1.924  -3.538
  155    HA   ILE  16           HA       ILE  16 101.791  -3.278  -2.990
  156    HB   ILE  16           HB       ILE  16 103.103  -5.270  -2.211
  157   HG12  ILE  16          HG12      ILE  16 105.377  -4.170  -2.377
  158   HG13  ILE  16          HG11      ILE  16 105.282  -5.798  -3.006
  159   HG21  ILE  16          HG21      ILE  16 101.683  -5.420  -4.108
  160   HG22  ILE  16          HG22      ILE  16 103.147  -6.353  -4.412
  161   HG23  ILE  16          HG23      ILE  16 102.939  -4.770  -5.160
  162   HD11  ILE  16          HD11      ILE  16 105.233  -4.917  -5.326
  163   HD12  ILE  16          HD12      ILE  16 106.669  -4.368  -4.497
  164   HD13  ILE  16          HD13      ILE  16 105.292  -3.275  -4.716
  165    H    HIS  17           HN       HIS  17 101.302  -3.597  -0.920
  166    HA   HIS  17           HA       HIS  17 103.149  -2.416   1.015
  167    HB2  HIS  17           HB2      HIS  17 101.203  -0.972   0.334
  168    HB3  HIS  17           HB1      HIS  17 100.145  -2.228   0.980
  169    HD1  HIS  17           HD1      HIS  17 101.483   0.965   1.904
  170    HD2  HIS  17           HD2      HIS  17 100.848  -2.631   3.897
  171    HE1  HIS  17           HE1      HIS  17 101.394   1.519   4.331
  172    H    THR  18           HN       THR  18 103.826  -4.188   1.876
  173    HA   THR  18           HA       THR  18 101.895  -6.282   2.604
  174    HB   THR  18           HB       THR  18 103.485  -7.069   0.921
  175    HG1  THR  18           HG1      THR  18 103.947  -8.240   3.476
  176   HG21  THR  18          HG21      THR  18 105.912  -7.340   1.450
  177   HG22  THR  18          HG22      THR  18 105.647  -6.490   2.967
  178   HG23  THR  18          HG23      THR  18 105.430  -5.643   1.442
  179    H    LYS  19           HN       LYS  19 101.712  -6.875   4.659
  180    HA   LYS  19           HA       LYS  19 103.136  -5.467   6.717
  181    HB2  LYS  19           HB2      LYS  19 100.755  -6.072   6.960
  182    HB3  LYS  19           HB1      LYS  19 101.165  -7.766   6.821
  183    HG2  LYS  19           HG2      LYS  19 102.140  -6.067   9.114
  184    HG3  LYS  19           HG1      LYS  19 100.559  -6.836   9.111
  185    HD2  LYS  19           HD2      LYS  19 101.823  -9.045   8.719
  186    HD3  LYS  19           HD1      LYS  19 103.286  -8.157   9.156
  187    HE2  LYS  19           HE2      LYS  19 102.355  -9.323  11.047
  188    HE3  LYS  19           HE1      LYS  19 102.381  -7.582  11.282
  189    HZ1  LYS  19           HZ1      LYS  19  99.973  -9.173  10.516
  190    HZ2  LYS  19           HZ2      LYS  19  99.994  -7.516  10.777
  191    HZ3  LYS  19           HZ3      LYS  19 100.298  -8.557  12.044
  192    H    LEU  20           HN       LEU  20 104.783  -6.214   7.965
  193    HA   LEU  20           HA       LEU  20 105.744  -8.901   7.333
  194    HB2  LEU  20           HB2      LEU  20 107.055  -6.409   6.795
  195    HB3  LEU  20           HB1      LEU  20 107.937  -7.259   8.056
  196    HG   LEU  20           HG       LEU  20 108.363  -9.132   6.640
  197   HD11  LEU  20          HD11      LEU  20 107.653  -9.240   4.355
  198   HD12  LEU  20          HD12      LEU  20 106.637  -7.804   4.564
  199   HD13  LEU  20          HD13      LEU  20 106.270  -9.301   5.438
  200   HD21  LEU  20          HD21      LEU  20 109.732  -7.127   6.440
  201   HD22  LEU  20          HD22      LEU  20 108.730  -6.638   5.069
  202   HD23  LEU  20          HD23      LEU  20 109.689  -8.115   4.981
  203    H    ARG  21           HN       ARG  21 105.844 -10.064   9.034
  204    HA   ARG  21           HA       ARG  21 105.296  -8.909  11.510
  205    HB2  ARG  21           HB2      ARG  21 104.421 -11.112  10.830
  206    HB3  ARG  21           HB1      ARG  21 106.059 -11.756  10.840
  207    HG2  ARG  21           HG2      ARG  21 106.177 -11.163  13.267
  208    HG3  ARG  21           HG1      ARG  21 104.468 -10.766  13.182
  209    HD2  ARG  21           HD2      ARG  21 103.992 -13.042  12.410
  210    HD3  ARG  21           HD1      ARG  21 105.696 -13.446  12.588
  211    HE   ARG  21           HE       ARG  21 104.028 -12.523  14.821
  212   HH11  ARG  21          HH11      ARG  21 106.412 -14.839  13.588
  213   HH12  ARG  21          HH12      ARG  21 106.610 -15.630  15.085
  214   HH21  ARG  21          HH21      ARG  21 104.321 -13.580  16.843
  215   HH22  ARG  21          HH22      ARG  21 105.413 -14.870  16.997
  216    H    LYS  22           HN       LYS  22 106.957  -8.162  12.853
  217    HA   LYS  22           HA       LYS  22 109.628  -8.219  12.473
  218    HB2  LYS  22           HB2      LYS  22 107.895  -7.990  14.843
  219    HB3  LYS  22           HB1      LYS  22 109.638  -8.022  15.031
  220    HG2  LYS  22           HG2      LYS  22 108.895  -5.767  15.039
  221    HG3  LYS  22           HG1      LYS  22 109.818  -6.199  13.608
  222    HD2  LYS  22           HD2      LYS  22 106.898  -6.381  13.266
  223    HD3  LYS  22           HD1      LYS  22 107.471  -4.776  13.697
  224    HE2  LYS  22           HE2      LYS  22 107.230  -5.183  11.344
  225    HE3  LYS  22           HE1      LYS  22 108.823  -4.613  11.795
  226    HZ1  LYS  22           HZ1      LYS  22 108.084  -7.420  11.237
  227    HZ2  LYS  22           HZ2      LYS  22 109.660  -6.816  11.523
  228    HZ3  LYS  22           HZ3      LYS  22 108.805  -6.369  10.144
  229    H    SER  23           HN       SER  23 110.773  -9.870  12.149
  230    HA   SER  23           HA       SER  23 110.415 -12.390  13.452
  231    HB2  SER  23           HB2      SER  23 110.986 -12.154  11.009
  232    HB3  SER  23           HB1      SER  23 112.502 -11.397  11.460
  233    HG   SER  23           HG       SER  23 112.670 -13.696  10.977
  234    H    SER  24           HN       SER  24 113.419 -12.767  13.422
  235    HA   SER  24           HA       SER  24 113.949 -12.336  16.119
  236    HB2  SER  24           HB2      SER  24 115.906 -12.853  13.893
  237    HB3  SER  24           HB1      SER  24 116.163 -13.161  15.611
  238    HG   SER  24           HG       SER  24 114.446 -14.610  15.557
  239    H    ARG  25           HN       ARG  25 113.412  -9.938  16.145
  240    HA   ARG  25           HA       ARG  25 114.051  -7.923  16.800
  241    HB2  ARG  25           HB2      ARG  25 116.694  -9.304  16.908
  242    HB3  ARG  25           HB1      ARG  25 116.686  -7.549  17.001
  243    HG2  ARG  25           HG2      ARG  25 114.985  -9.255  18.803
  244    HG3  ARG  25           HG1      ARG  25 116.641  -8.787  19.233
  245    HD2  ARG  25           HD2      ARG  25 116.029  -6.460  19.076
  246    HD3  ARG  25           HD1      ARG  25 114.424  -6.876  18.502
  247    HE   ARG  25           HE       ARG  25 114.916  -8.039  21.031
  248   HH11  ARG  25          HH11      ARG  25 114.162  -4.944  19.469
  249   HH12  ARG  25          HH12      ARG  25 113.427  -4.272  20.835
  250   HH21  ARG  25          HH21      ARG  25 113.831  -7.105  22.913
  251   HH22  ARG  25          HH22      ARG  25 113.207  -5.522  22.805
  252    H    GLY  26           HN       GLY  26 113.251  -8.184  14.453
  253    HA2  GLY  26           HA2      GLY  26 113.632  -5.902  13.209
  254    HA3  GLY  26           HA1      GLY  26 115.023  -6.819  12.652
  255    H    PHE  27           HN       PHE  27 114.760  -7.645  10.854
  256    HA   PHE  27           HA       PHE  27 112.138  -8.579   9.992
  257    HB2  PHE  27           HB2      PHE  27 114.021  -6.630   9.003
  258    HB3  PHE  27           HB1      PHE  27 113.075  -7.526   7.728
  259    HD1  PHE  27           HD2      PHE  27 110.480  -7.077   8.246
  260    HD2  PHE  27           HD1      PHE  27 113.711  -4.902   9.918
  261    HE1  PHE  27           HE2      PHE  27 108.970  -5.225   8.834
  262    HE2  PHE  27           HE1      PHE  27 112.228  -3.103  10.487
  263    HZ   PHE  27           HZ       PHE  27 109.889  -3.256  10.039
  264    H    GLY  28           HN       GLY  28 115.369  -8.424   8.427
  265    HA2  GLY  28           HA2      GLY  28 116.579 -10.575   8.209
  266    HA3  GLY  28           HA1      GLY  28 115.042 -11.338   7.889
  267    H    PHE  29           HN       PHE  29 116.515  -8.372   6.746
  268    HA   PHE  29           HA       PHE  29 117.249  -9.470   4.309
  269    HB2  PHE  29           HB2      PHE  29 115.900  -7.893   2.841
  270    HB3  PHE  29           HB1      PHE  29 115.038  -9.260   3.490
  271    HD1  PHE  29           HD2      PHE  29 113.342  -8.956   5.155
  272    HD2  PHE  29           HD1      PHE  29 115.395  -5.671   3.499
  273    HE1  PHE  29           HE2      PHE  29 111.601  -7.471   5.997
  274    HE2  PHE  29           HE1      PHE  29 113.649  -4.140   4.329
  275    HZ   PHE  29           HZ       PHE  29 111.738  -5.046   5.586
  276    H    THR  30           HN       THR  30 118.716  -8.121   3.288
  277    HA   THR  30           HA       THR  30 119.427  -5.931   5.038
  278    HB   THR  30           HB       THR  30 121.709  -6.237   3.916
  279    HG1  THR  30           HG1      THR  30 121.906  -8.469   3.127
  280   HG21  THR  30          HG21      THR  30 121.222  -7.012   6.197
  281   HG22  THR  30          HG22      THR  30 122.264  -8.166   5.372
  282   HG23  THR  30          HG23      THR  30 120.540  -8.491   5.551
  283    H    VAL  31           HN       VAL  31 119.702  -3.901   4.187
  284    HA   VAL  31           HA       VAL  31 118.666  -3.668   1.448
  285    HB   VAL  31           HB       VAL  31 117.321  -1.751   2.137
  286   HG11  VAL  31          HG11      VAL  31 115.666  -2.875   3.492
  287   HG12  VAL  31          HG12      VAL  31 116.851  -4.101   3.928
  288   HG13  VAL  31          HG13      VAL  31 116.302  -3.967   2.262
  289   HG21  VAL  31          HG21      VAL  31 118.645  -0.889   3.913
  290   HG22  VAL  31          HG22      VAL  31 118.351  -2.367   4.853
  291   HG23  VAL  31          HG23      VAL  31 117.005  -1.268   4.490
  292    H    VAL  32           HN       VAL  32 119.070  -1.730   0.371
  293    HA   VAL  32           HA       VAL  32 121.470  -0.298   1.148
  294    HB   VAL  32           HB       VAL  32 121.755   0.214  -1.330
  295   HG11  VAL  32          HG11      VAL  32 123.000  -1.874  -1.737
  296   HG12  VAL  32          HG12      VAL  32 122.203  -2.549  -0.313
  297   HG13  VAL  32          HG13      VAL  32 123.294  -1.179  -0.139
  298   HG21  VAL  32          HG21      VAL  32 119.647  -0.516  -2.147
  299   HG22  VAL  32          HG22      VAL  32 119.885  -2.142  -1.523
  300   HG23  VAL  32          HG23      VAL  32 120.866  -1.565  -2.871
  301    H    GLY  33           HN       GLY  33 121.639   1.743  -0.042
  302    HA2  GLY  33           HA2      GLY  33 120.672   3.735  -0.884
  303    HA3  GLY  33           HA1      GLY  33 119.081   3.030  -0.606
  304    H    GLY  34           HN       GLY  34 118.125   4.283   0.639
  305    HA2  GLY  34           HA2      GLY  34 117.626   5.815   2.279
  306    HA3  GLY  34           HA1      GLY  34 117.809   4.422   3.266
  307    H    ASP  35           HN       ASP  35 119.600   6.828   1.706
  308    HA   ASP  35           HA       ASP  35 121.425   6.995   4.034
  309    HB2  ASP  35           HB2      ASP  35 122.134   6.199   1.701
  310    HB3  ASP  35           HB1      ASP  35 121.989   7.865   1.229
  311    H    GLU  36           HN       GLU  36 119.217   8.622   1.922
  312    HA   GLU  36           HA       GLU  36 119.155  11.003   3.524
  313    HB2  GLU  36           HB2      GLU  36 119.908  12.337   1.431
  314    HB3  GLU  36           HB1      GLU  36 121.138  11.748   2.536
  315    HG2  GLU  36           HG2      GLU  36 121.428   9.820   1.094
  316    HG3  GLU  36           HG1      GLU  36 120.304  10.573  -0.061
  317    HA   PRO  37           HA       PRO  37 115.233  11.359   2.129
  318    HB2  PRO  37           HB2      PRO  37 116.024  14.042   1.163
  319    HB3  PRO  37           HB1      PRO  37 114.630  13.677   2.249
  320    HG2  PRO  37           HG2      PRO  37 116.763  14.778   3.298
  321    HG3  PRO  37           HG1      PRO  37 116.251  13.235   4.032
  322    HD2  PRO  37           HD2      PRO  37 118.244  13.647   1.834
  323    HD3  PRO  37           HD1      PRO  37 118.626  12.896   3.348
  324    H    ASP  38           HN       ASP  38 117.723  12.351   0.147
  325    HA   ASP  38           HA       ASP  38 116.398  12.342  -2.310
  326    HB2  ASP  38           HB2      ASP  38 118.209  13.741  -1.900
  327    HB3  ASP  38           HB1      ASP  38 119.268  12.421  -1.448
  328    H    GLU  39           HN       GLU  39 118.131   9.877  -0.414
  329    HA   GLU  39           HA       GLU  39 117.651   8.026  -2.596
  330    HB2  GLU  39           HB2      GLU  39 120.057   8.500  -2.259
  331    HB3  GLU  39           HB1      GLU  39 119.908   7.925  -0.608
  332    HG2  GLU  39           HG2      GLU  39 120.861   6.318  -2.044
  333    HG3  GLU  39           HG1      GLU  39 119.349   5.716  -1.367
  334    H    PHE  40           HN       PHE  40 116.337   6.588  -2.177
  335    HA   PHE  40           HA       PHE  40 115.046   6.095   0.421
  336    HB2  PHE  40           HB2      PHE  40 114.370   4.866  -2.255
  337    HB3  PHE  40           HB1      PHE  40 113.346   4.980  -0.843
  338    HD1  PHE  40           HD2      PHE  40 113.181   7.686  -0.111
  339    HD2  PHE  40           HD1      PHE  40 113.629   6.053  -4.009
  340    HE1  PHE  40           HE2      PHE  40 112.136   9.691  -1.072
  341    HE2  PHE  40           HE1      PHE  40 112.591   8.049  -4.976
  342    HZ   PHE  40           HZ       PHE  40 111.835   9.868  -3.515
  343    H    LEU  41           HN       LEU  41 114.359   3.692   0.812
  344    HA   LEU  41           HA       LEU  41 116.958   2.384   0.775
  345    HB2  LEU  41           HB2      LEU  41 114.478   1.588   2.304
  346    HB3  LEU  41           HB1      LEU  41 116.052   0.798   2.204
  347    HG   LEU  41           HG       LEU  41 117.077   2.731   3.255
  348   HD11  LEU  41          HD11      LEU  41 115.636   4.260   4.593
  349   HD12  LEU  41          HD12      LEU  41 114.226   3.593   3.775
  350   HD13  LEU  41          HD13      LEU  41 115.438   4.477   2.854
  351   HD21  LEU  41          HD21      LEU  41 114.953   1.408   4.899
  352   HD22  LEU  41          HD22      LEU  41 116.552   2.031   5.412
  353   HD23  LEU  41          HD23      LEU  41 116.446   0.653   4.344
  354    H    GLN  42           HN       GLN  42 117.225   0.338  -0.092
  355    HA   GLN  42           HA       GLN  42 114.934  -0.724  -1.541
  356    HB2  GLN  42           HB2      GLN  42 116.607   0.632  -2.840
  357    HB3  GLN  42           HB1      GLN  42 117.757  -0.687  -2.516
  358    HG2  GLN  42           HG2      GLN  42 115.955  -2.161  -3.571
  359    HG3  GLN  42           HG1      GLN  42 115.166  -0.696  -4.075
  360   HE21  GLN  42          HE21      GLN  42 117.811  -2.795  -4.657
  361   HE22  GLN  42          HE22      GLN  42 118.299  -2.044  -6.144
  362    H    ILE  43           HN       ILE  43 115.308  -3.014  -1.896
  363    HA   ILE  43           HA       ILE  43 116.738  -4.189   0.389
  364    HB   ILE  43           HB       ILE  43 115.337  -5.783  -1.780
  365   HG12  ILE  43          HG12      ILE  43 113.661  -4.205  -0.997
  366   HG13  ILE  43          HG11      ILE  43 113.278  -5.809  -0.401
  367   HG21  ILE  43          HG21      ILE  43 115.004  -7.471  -0.015
  368   HG22  ILE  43          HG22      ILE  43 115.923  -6.464   1.103
  369   HG23  ILE  43          HG23      ILE  43 116.699  -7.116  -0.336
  370   HD11  ILE  43          HD11      ILE  43 114.186  -5.172   1.779
  371   HD12  ILE  43          HD12      ILE  43 112.850  -4.146   1.263
  372   HD13  ILE  43          HD13      ILE  43 114.508  -3.555   1.148
  373    H    LYS  44           HN       LYS  44 118.790  -5.122   0.189
  374    HA   LYS  44           HA       LYS  44 119.771  -5.518  -2.543
  375    HB2  LYS  44           HB2      LYS  44 122.097  -5.296  -1.743
  376    HB3  LYS  44           HB1      LYS  44 121.148  -3.860  -1.469
  377    HG2  LYS  44           HG2      LYS  44 122.559  -4.162   0.461
  378    HG3  LYS  44           HG1      LYS  44 120.920  -4.581   0.955
  379    HD2  LYS  44           HD2      LYS  44 122.458  -6.113   1.909
  380    HD3  LYS  44           HD1      LYS  44 121.591  -6.966   0.641
  381    HE2  LYS  44           HE2      LYS  44 123.497  -6.683  -0.863
  382    HE3  LYS  44           HE1      LYS  44 124.356  -5.780   0.387
  383    HZ1  LYS  44           HZ1      LYS  44 125.062  -8.108   0.327
  384    HZ2  LYS  44           HZ2      LYS  44 123.467  -8.604   0.616
  385    HZ3  LYS  44           HZ3      LYS  44 124.300  -7.750   1.782
  386    H    SER  45           HN       SER  45 119.163  -7.215   0.362
  387    HA   SER  45           HA       SER  45 119.444  -9.600  -1.204
  388    HB2  SER  45           HB2      SER  45 120.995  -9.289   1.386
  389    HB3  SER  45           HB1      SER  45 120.814 -10.795   0.487
  390    HG   SER  45           HG       SER  45 121.642  -9.143  -1.257
  391    H    LEU  46           HN       LEU  46 117.732 -10.799  -0.820
  392    HA   LEU  46           HA       LEU  46 115.982 -10.290   1.335
  393    HB2  LEU  46           HB2      LEU  46 115.513 -10.722  -1.113
  394    HB3  LEU  46           HB1      LEU  46 116.090 -12.340  -0.851
  395    HG   LEU  46           HG       LEU  46 113.656 -12.020  -1.069
  396   HD11  LEU  46          HD11      LEU  46 113.052 -13.573   0.672
  397   HD12  LEU  46          HD12      LEU  46 114.632 -13.309   1.457
  398   HD13  LEU  46          HD13      LEU  46 114.541 -14.025  -0.159
  399   HD21  LEU  46          HD21      LEU  46 112.395 -11.272   0.879
  400   HD22  LEU  46          HD22      LEU  46 113.396  -9.990   0.195
  401   HD23  LEU  46          HD23      LEU  46 113.903 -10.819   1.672
  402    H    VAL  47           HN       VAL  47 116.596 -11.181   3.340
  403    HA   VAL  47           HA       VAL  47 118.485 -13.338   3.400
  404    HB   VAL  47           HB       VAL  47 117.308 -11.561   5.555
  405   HG11  VAL  47          HG11      VAL  47 117.910 -13.720   6.467
  406   HG12  VAL  47          HG12      VAL  47 118.976 -12.437   7.055
  407   HG13  VAL  47          HG13      VAL  47 119.541 -13.553   5.804
  408   HG21  VAL  47          HG21      VAL  47 119.420 -10.483   5.617
  409   HG22  VAL  47          HG22      VAL  47 118.844 -10.464   3.941
  410   HG23  VAL  47          HG23      VAL  47 120.098 -11.601   4.437
  411    H    LEU  48           HN       LEU  48 118.096 -15.296   4.092
  412    HA   LEU  48           HA       LEU  48 115.461 -16.369   4.133
  413    HB2  LEU  48           HB2      LEU  48 118.075 -17.564   5.020
  414    HB3  LEU  48           HB1      LEU  48 116.591 -18.446   4.712
  415    HG   LEU  48           HG       LEU  48 118.203 -16.938   2.679
  416   HD11  LEU  48          HD11      LEU  48 117.793 -19.899   3.085
  417   HD12  LEU  48          HD12      LEU  48 119.283 -19.000   3.374
  418   HD13  LEU  48          HD13      LEU  48 118.650 -19.159   1.735
  419   HD21  LEU  48          HD21      LEU  48 116.672 -17.958   1.039
  420   HD22  LEU  48          HD22      LEU  48 115.869 -16.823   2.115
  421   HD23  LEU  48          HD23      LEU  48 115.686 -18.560   2.373
  422    H    ASP  49           HN       ASP  49 114.233 -17.063   5.761
  423    HA   ASP  49           HA       ASP  49 113.341 -17.237   7.806
  424    HB2  ASP  49           HB2      ASP  49 115.493 -18.170   8.537
  425    HB3  ASP  49           HB1      ASP  49 116.099 -16.568   8.866
  426    H    GLY  50           HN       GLY  50 114.259 -14.588   6.350
  427    HA2  GLY  50           HA2      GLY  50 113.432 -12.528   8.221
  428    HA3  GLY  50           HA1      GLY  50 113.697 -12.505   6.448
  429    HA   PRO  51           HA       PRO  51 109.217 -13.193   7.450
  430    HB2  PRO  51           HB2      PRO  51 108.068 -10.657   7.688
  431    HB3  PRO  51           HB1      PRO  51 108.623 -11.641   9.003
  432    HG2  PRO  51           HG2      PRO  51 109.801  -9.207   8.007
  433    HG3  PRO  51           HG1      PRO  51 110.135 -10.086   9.495
  434    HD2  PRO  51           HD2      PRO  51 111.511 -10.088   6.930
  435    HD3  PRO  51           HD1      PRO  51 112.149 -10.641   8.458
  436    H    ALA  52           HN       ALA  52 110.835 -10.948   5.490
  437    HA   ALA  52           HA       ALA  52 109.054 -10.770   3.300
  438    HB1  ALA  52           HB1      ALA  52 110.873  -9.189   3.644
  439    HB2  ALA  52           HB2      ALA  52 111.103 -10.023   2.108
  440    HB3  ALA  52           HB3      ALA  52 112.055 -10.480   3.509
  441    H    ALA  53           HN       ALA  53 111.640 -12.957   4.248
  442    HA   ALA  53           HA       ALA  53 111.774 -14.500   1.856
  443    HB1  ALA  53           HB1      ALA  53 112.451 -15.259   4.692
  444    HB2  ALA  53           HB2      ALA  53 113.550 -14.423   3.584
  445    HB3  ALA  53           HB3      ALA  53 113.021 -16.074   3.230
  446    H    LEU  54           HN       LEU  54 110.273 -14.784   4.878
  447    HA   LEU  54           HA       LEU  54 109.242 -17.305   4.594
  448    HB2  LEU  54           HB2      LEU  54 108.742 -15.138   6.436
  449    HB3  LEU  54           HB1      LEU  54 108.265 -16.812   6.686
  450    HG   LEU  54           HG       LEU  54 111.114 -15.797   6.331
  451   HD11  LEU  54          HD11      LEU  54 110.046 -15.318   8.138
  452   HD12  LEU  54          HD12      LEU  54 111.347 -16.590   8.363
  453   HD13  LEU  54          HD13      LEU  54 109.539 -17.031   8.301
  454   HD21  LEU  54          HD21      LEU  54 110.086 -18.634   6.678
  455   HD22  LEU  54          HD22      LEU  54 111.763 -18.124   6.781
  456   HD23  LEU  54          HD23      LEU  54 110.919 -18.013   5.248
  457    H    ASP  55           HN       ASP  55 107.707 -14.083   4.491
  458    HA   ASP  55           HA       ASP  55 105.122 -15.247   3.921
  459    HB2  ASP  55           HB2      ASP  55 105.699 -12.938   5.131
  460    HB3  ASP  55           HB1      ASP  55 105.732 -12.351   3.480
  461    H    GLY  56           HN       GLY  56 107.916 -14.231   2.325
  462    HA2  GLY  56           HA2      GLY  56 108.400 -14.534   0.089
  463    HA3  GLY  56           HA1      GLY  56 106.700 -14.869  -0.218
  464    H    LYS  57           HN       LYS  57 106.307 -13.538  -1.797
  465    HA   LYS  57           HA       LYS  57 106.153 -11.820  -3.116
  466    HB2  LYS  57           HB2      LYS  57 104.960  -9.824  -2.413
  467    HB3  LYS  57           HB1      LYS  57 104.247 -11.269  -1.741
  468    HG2  LYS  57           HG2      LYS  57 106.155  -9.708  -0.099
  469    HG3  LYS  57           HG1      LYS  57 104.542  -9.044  -0.351
  470    HD2  LYS  57           HD2      LYS  57 105.127 -11.795   0.767
  471    HD3  LYS  57           HD1      LYS  57 104.801 -10.372   1.756
  472    HE2  LYS  57           HE2      LYS  57 102.910 -11.641  -0.236
  473    HE3  LYS  57           HE1      LYS  57 102.803 -11.728   1.516
  474    HZ1  LYS  57           HZ1      LYS  57 102.487  -9.278  -0.144
  475    HZ2  LYS  57           HZ2      LYS  57 102.598  -9.273   1.522
  476    HZ3  LYS  57           HZ3      LYS  57 101.297 -10.043   0.771
  477    H    MET  58           HN       MET  58 107.864 -10.385  -0.411
  478    HA   MET  58           HA       MET  58 109.053  -8.336  -2.037
  479    HB2  MET  58           HB2      MET  58 108.689  -8.011   0.338
  480    HB3  MET  58           HB1      MET  58 109.760  -9.326   0.745
  481    HG2  MET  58           HG2      MET  58 111.589  -7.987  -0.433
  482    HG3  MET  58           HG1      MET  58 110.388  -6.685  -0.444
  483    HE1  MET  58           HE1      MET  58 109.289  -5.693   1.679
  484    HE2  MET  58           HE2      MET  58 109.760  -6.127   3.321
  485    HE3  MET  58           HE3      MET  58 108.901  -7.295   2.321
  486    H    GLU  59           HN       GLU  59 111.205  -8.241  -2.816
  487    HA   GLU  59           HA       GLU  59 112.798 -10.673  -2.731
  488    HB2  GLU  59           HB2      GLU  59 111.641  -9.587  -5.326
  489    HB3  GLU  59           HB1      GLU  59 112.855 -10.846  -5.206
  490    HG2  GLU  59           HG2      GLU  59 111.249 -12.305  -4.135
  491    HG3  GLU  59           HG1      GLU  59 110.032 -11.032  -4.189
  492    H    THR  60           HN       THR  60 114.899 -10.159  -3.280
  493    HA   THR  60           HA       THR  60 115.989  -7.761  -2.739
  494    HB   THR  60           HB       THR  60 117.021  -9.652  -4.810
  495    HG1  THR  60           HG1      THR  60 116.813 -11.092  -3.282
  496   HG21  THR  60          HG21      THR  60 118.288  -7.629  -4.409
  497   HG22  THR  60          HG22      THR  60 119.145  -9.077  -3.832
  498   HG23  THR  60          HG23      THR  60 118.302  -8.029  -2.687
  499    H    GLY  61           HN       GLY  61 115.687  -5.863  -3.679
  500    HA2  GLY  61           HA2      GLY  61 116.282  -4.679  -5.799
  501    HA3  GLY  61           HA1      GLY  61 115.095  -5.738  -6.555
  502    H    ASP  62           HN       ASP  62 113.244  -5.512  -4.118
  503    HA   ASP  62           HA       ASP  62 112.066  -3.143  -5.097
  504    HB2  ASP  62           HB2      ASP  62 110.306  -3.555  -3.140
  505    HB3  ASP  62           HB1      ASP  62 110.222  -4.383  -4.667
  506    H    VAL  63           HN       VAL  63 111.355  -1.348  -4.160
  507    HA   VAL  63           HA       VAL  63 113.334  -0.453  -2.270
  508    HB   VAL  63           HB       VAL  63 113.889   0.842  -4.092
  509   HG11  VAL  63          HG11      VAL  63 112.318   1.774  -5.719
  510   HG12  VAL  63          HG12      VAL  63 110.989   0.980  -4.849
  511   HG13  VAL  63          HG13      VAL  63 112.289   0.020  -5.578
  512   HG21  VAL  63          HG21      VAL  63 113.025   3.135  -3.877
  513   HG22  VAL  63          HG22      VAL  63 113.380   2.434  -2.297
  514   HG23  VAL  63          HG23      VAL  63 111.714   2.544  -2.857
  515    H    ILE  64           HN       ILE  64 112.912   0.100  -0.429
  516    HA   ILE  64           HA       ILE  64 110.268   0.120   0.466
  517    HB   ILE  64           HB       ILE  64 112.839   0.432   1.999
  518   HG12  ILE  64          HG12      ILE  64 110.740  -1.732   1.835
  519   HG13  ILE  64          HG11      ILE  64 112.402  -1.809   1.257
  520   HG21  ILE  64          HG21      ILE  64 110.039   0.462   3.158
  521   HG22  ILE  64          HG22      ILE  64 111.175   1.810   3.152
  522   HG23  ILE  64          HG23      ILE  64 111.533   0.361   4.093
  523   HD11  ILE  64          HD11      ILE  64 111.522  -1.565   4.102
  524   HD12  ILE  64          HD12      ILE  64 113.203  -1.691   3.558
  525   HD13  ILE  64          HD13      ILE  64 112.085  -3.051   3.333
  526    H    VAL  65           HN       VAL  65 109.033   1.650   0.794
  527    HA   VAL  65           HA       VAL  65 109.768   4.420   0.370
  528    HB   VAL  65           HB       VAL  65 107.092   2.980   0.301
  529   HG11  VAL  65          HG11      VAL  65 106.806   5.360   0.810
  530   HG12  VAL  65          HG12      VAL  65 106.208   4.949  -0.808
  531   HG13  VAL  65          HG13      VAL  65 107.749   5.764  -0.633
  532   HG21  VAL  65          HG21      VAL  65 108.549   2.233  -1.488
  533   HG22  VAL  65          HG22      VAL  65 108.836   3.902  -1.971
  534   HG23  VAL  65          HG23      VAL  65 107.224   3.204  -2.129
  535    H    SER  66           HN       SER  66 107.936   2.266   2.666
  536    HA   SER  66           HA       SER  66 108.426   4.078   4.832
  537    HB2  SER  66           HB2      SER  66 105.569   3.847   3.826
  538    HB3  SER  66           HB1      SER  66 106.044   4.549   5.373
  539    HG   SER  66           HG       SER  66 107.454   5.578   3.307
  540    H    VAL  67           HN       VAL  67 107.134   3.339   6.898
  541    HA   VAL  67           HA       VAL  67 106.515   0.539   6.865
  542    HB   VAL  67           HB       VAL  67 108.929   0.401   7.173
  543   HG11  VAL  67          HG11      VAL  67 108.584   2.247   9.509
  544   HG12  VAL  67          HG12      VAL  67 109.354   2.635   7.972
  545   HG13  VAL  67          HG13      VAL  67 110.076   1.429   9.045
  546   HG21  VAL  67          HG21      VAL  67 107.599  -1.173   8.458
  547   HG22  VAL  67          HG22      VAL  67 107.519  -0.027   9.796
  548   HG23  VAL  67          HG23      VAL  67 109.067  -0.731   9.329
  549    H    ASN  68           HN       ASN  68 104.646   0.502   7.794
  550    HA   ASN  68           HA       ASN  68 103.045   0.409   9.278
  551    HB2  ASN  68           HB2      ASN  68 105.160  -0.175  10.695
  552    HB3  ASN  68           HB1      ASN  68 104.768   1.340  11.489
  553   HD21  ASN  68          HD21      ASN  68 104.387   0.120  13.325
  554   HD22  ASN  68          HD22      ASN  68 102.916  -0.758  13.552
  555    H    ASP  69           HN       ASP  69 104.874   3.201   9.786
  556    HA   ASP  69           HA       ASP  69 102.646   5.047   9.750
  557    HB2  ASP  69           HB2      ASP  69 102.363   4.339  12.041
  558    HB3  ASP  69           HB1      ASP  69 104.090   4.454  12.340
  559    H    THR  70           HN       THR  70 105.998   4.383  10.546
  560    HA   THR  70           HA       THR  70 106.899   7.063  10.452
  561    HB   THR  70           HB       THR  70 108.561   4.569  10.156
  562    HG1  THR  70           HG1      THR  70 107.332   5.708  12.467
  563   HG21  THR  70          HG21      THR  70 109.684   6.753   9.899
  564   HG22  THR  70          HG22      THR  70 110.218   5.922  11.357
  565   HG23  THR  70          HG23      THR  70 109.065   7.250  11.473
  566    H    CYS  71           HN       CYS  71 107.677   8.188   8.906
  567    HA   CYS  71           HA       CYS  71 107.457   7.272   6.201
  568    HB2  CYS  71           HB2      CYS  71 106.659   9.470   6.934
  569    HB3  CYS  71           HB1      CYS  71 108.295   9.895   7.402
  570    HG   CYS  71           HG       CYS  71 109.100  10.757   5.168
  571    H    VAL  72           HN       VAL  72 109.064   5.729   6.283
  572    HA   VAL  72           HA       VAL  72 111.780   6.563   6.749
  573    HB   VAL  72           HB       VAL  72 110.506   3.842   6.206
  574   HG11  VAL  72          HG11      VAL  72 113.446   4.329   6.736
  575   HG12  VAL  72          HG12      VAL  72 112.776   3.840   5.180
  576   HG13  VAL  72          HG13      VAL  72 112.648   2.763   6.570
  577   HG21  VAL  72          HG21      VAL  72 110.192   4.808   8.378
  578   HG22  VAL  72          HG22      VAL  72 111.931   5.034   8.554
  579   HG23  VAL  72          HG23      VAL  72 111.258   3.408   8.473
  580    H    LEU  73           HN       LEU  73 110.011   7.427   4.565
  581    HA   LEU  73           HA       LEU  73 111.144   6.764   2.035
  582    HB2  LEU  73           HB2      LEU  73 108.878   7.781   2.755
  583    HB3  LEU  73           HB1      LEU  73 109.777   9.266   2.929
  584    HG   LEU  73           HG       LEU  73 110.159   9.438   0.618
  585   HD11  LEU  73          HD11      LEU  73 109.114   6.609   0.535
  586   HD12  LEU  73          HD12      LEU  73 110.746   7.140   0.095
  587   HD13  LEU  73          HD13      LEU  73 109.365   7.604  -0.896
  588   HD21  LEU  73          HD21      LEU  73 107.944  10.061   1.386
  589   HD22  LEU  73          HD22      LEU  73 107.404   8.394   1.216
  590   HD23  LEU  73          HD23      LEU  73 107.834   9.317  -0.216
  591    H    GLY  74           HN       GLY  74 113.197   7.137   1.742
  592    HA2  GLY  74           HA2      GLY  74 115.241   8.191   1.656
  593    HA3  GLY  74           HA1      GLY  74 114.323   9.678   1.869
  594    H    HIS  75           HN       HIS  75 114.349   7.027   4.155
  595    HA   HIS  75           HA       HIS  75 115.043   8.820   6.273
  596    HB2  HIS  75           HB2      HIS  75 113.821   6.251   6.108
  597    HB3  HIS  75           HB1      HIS  75 115.369   6.102   6.921
  598    HD1  HIS  75           HD1      HIS  75 112.369   8.489   7.361
  599    HD2  HIS  75           HD2      HIS  75 115.217   6.315   9.416
  600    HE1  HIS  75           HE1      HIS  75 111.871   8.882   9.766
  601    H    THR  76           HN       THR  76 116.940   9.165   6.987
  602    HA   THR  76           HA       THR  76 119.288   8.488   5.616
  603    HB   THR  76           HB       THR  76 118.927   9.494   8.418
  604    HG1  THR  76           HG1      THR  76 119.375  11.158   6.156
  605   HG21  THR  76          HG21      THR  76 121.209   8.858   7.905
  606   HG22  THR  76          HG22      THR  76 121.071  10.601   8.105
  607   HG23  THR  76          HG23      THR  76 121.210   9.906   6.480
  608    H    HIS  77           HN       HIS  77 120.926   6.932   6.121
  609    HA   HIS  77           HA       HIS  77 120.403   4.485   7.059
  610    HB2  HIS  77           HB2      HIS  77 122.470   4.849   5.996
  611    HB3  HIS  77           HB1      HIS  77 122.984   6.017   7.203
  612    HD1  HIS  77           HD1      HIS  77 122.077   2.233   7.333
  613    HD2  HIS  77           HD2      HIS  77 124.826   4.977   8.826
  614    HE1  HIS  77           HE1      HIS  77 123.671   0.931   8.744
  615    H    ALA  78           HN       ALA  78 121.753   7.009   9.021
  616    HA   ALA  78           HA       ALA  78 122.062   5.529  11.394
  617    HB1  ALA  78           HB1      ALA  78 122.242   7.685  12.544
  618    HB2  ALA  78           HB2      ALA  78 121.585   8.498  11.122
  619    HB3  ALA  78           HB3      ALA  78 123.151   7.692  11.031
  620    H    GLN  79           HN       GLN  79 119.324   7.272  10.066
  621    HA   GLN  79           HA       GLN  79 117.889   7.258  12.486
  622    HB2  GLN  79           HB2      GLN  79 117.084   7.835   9.662
  623    HB3  GLN  79           HB1      GLN  79 116.069   8.186  11.036
  624    HG2  GLN  79           HG2      GLN  79 118.733   9.400  10.344
  625    HG3  GLN  79           HG1      GLN  79 117.160  10.210  10.332
  626   HE21  GLN  79          HE21      GLN  79 119.640  10.854  11.683
  627   HE22  GLN  79          HE22      GLN  79 119.267  10.921  13.352
  628    H    VAL  80           HN       VAL  80 117.695   5.642   9.383
  629    HA   VAL  80           HA       VAL  80 115.488   4.019  10.027
  630    HB   VAL  80           HB       VAL  80 116.041   4.544   7.694
  631   HG11  VAL  80          HG11      VAL  80 118.352   2.659   8.023
  632   HG12  VAL  80          HG12      VAL  80 118.460   4.401   7.817
  633   HG13  VAL  80          HG13      VAL  80 117.811   3.401   6.514
  634   HG21  VAL  80          HG21      VAL  80 115.413   2.428   6.811
  635   HG22  VAL  80          HG22      VAL  80 114.675   2.585   8.401
  636   HG23  VAL  80          HG23      VAL  80 116.112   1.589   8.190
  637    H    VAL  81           HN       VAL  81 118.956   3.332  10.218
  638    HA   VAL  81           HA       VAL  81 118.559   0.610  10.869
  639    HB   VAL  81           HB       VAL  81 120.799   1.487  10.134
  640   HG11  VAL  81          HG11      VAL  81 121.021   2.577  12.936
  641   HG12  VAL  81          HG12      VAL  81 120.949   3.517  11.445
  642   HG13  VAL  81          HG13      VAL  81 122.339   2.479  11.767
  643   HG21  VAL  81          HG21      VAL  81 120.653  -0.718  11.140
  644   HG22  VAL  81          HG22      VAL  81 120.828  -0.015  12.745
  645   HG23  VAL  81          HG23      VAL  81 122.165   0.067  11.599
  646    H    LYS  82           HN       LYS  82 118.662   3.494  12.780
  647    HA   LYS  82           HA       LYS  82 118.661   2.293  15.270
  648    HB2  LYS  82           HB2      LYS  82 119.212   4.577  14.966
  649    HB3  LYS  82           HB1      LYS  82 117.682   4.931  14.220
  650    HG2  LYS  82           HG2      LYS  82 117.881   4.132  17.118
  651    HG3  LYS  82           HG1      LYS  82 118.150   5.792  16.616
  652    HD2  LYS  82           HD2      LYS  82 115.625   4.169  16.257
  653    HD3  LYS  82           HD1      LYS  82 115.863   5.505  17.380
  654    HE2  LYS  82           HE2      LYS  82 115.851   5.682  14.349
  655    HE3  LYS  82           HE1      LYS  82 114.580   6.217  15.429
  656    HZ1  LYS  82           HZ1      LYS  82 117.321   7.390  15.310
  657    HZ2  LYS  82           HZ2      LYS  82 116.046   7.924  16.291
  658    HZ3  LYS  82           HZ3      LYS  82 115.923   8.035  14.624
  659    H    ILE  83           HN       ILE  83 115.978   2.980  13.048
  660    HA   ILE  83           HA       ILE  83 113.927   2.447  15.001
  661    HB   ILE  83           HB       ILE  83 113.782   2.603  11.981
  662   HG12  ILE  83          HG12      ILE  83 113.021   4.633  14.083
  663   HG13  ILE  83          HG11      ILE  83 114.451   4.699  13.055
  664   HG21  ILE  83          HG21      ILE  83 111.350   2.834  12.265
  665   HG22  ILE  83          HG22      ILE  83 111.533   2.576  13.998
  666   HG23  ILE  83          HG23      ILE  83 111.927   1.278  12.871
  667   HD11  ILE  83          HD11      ILE  83 112.664   6.159  12.262
  668   HD12  ILE  83          HD12      ILE  83 111.620   4.738  12.102
  669   HD13  ILE  83          HD13      ILE  83 113.059   4.891  11.096
  670    H    PHE  84           HN       PHE  84 115.293   0.861  12.246
  671    HA   PHE  84           HA       PHE  84 113.680  -1.403  12.349
  672    HB2  PHE  84           HB2      PHE  84 116.070  -0.520  10.866
  673    HB3  PHE  84           HB1      PHE  84 115.610  -2.199  10.755
  674    HD1  PHE  84           HD1      PHE  84 113.886   1.125  10.685
  675    HD2  PHE  84           HD2      PHE  84 114.315  -2.672   8.859
  676    HE1  PHE  84           HE1      PHE  84 112.233   1.755   8.995
  677    HE2  PHE  84           HE2      PHE  84 112.666  -2.054   7.156
  678    HZ   PHE  84           HZ       PHE  84 111.612   0.156   7.221
  679    H    GLN  85           HN       GLN  85 116.882  -0.746  13.699
  680    HA   GLN  85           HA       GLN  85 117.013  -3.463  14.606
  681    HB2  GLN  85           HB2      GLN  85 118.896  -1.139  14.805
  682    HB3  GLN  85           HB1      GLN  85 119.200  -2.623  15.731
  683    HG2  GLN  85           HG2      GLN  85 118.907  -2.332  12.762
  684    HG3  GLN  85           HG1      GLN  85 120.423  -2.541  13.630
  685   HE21  GLN  85          HE21      GLN  85 119.173  -4.303  11.579
  686   HE22  GLN  85          HE22      GLN  85 118.974  -5.831  12.328
  687    H    SER  86           HN       SER  86 115.641  -0.599  15.803
  688    HA   SER  86           HA       SER  86 115.728  -1.311  18.583
  689    HB2  SER  86           HB2      SER  86 115.345   1.038  17.773
  690    HB3  SER  86           HB1      SER  86 113.797   0.522  17.127
  691    HG   SER  86           HG       SER  86 113.127   0.030  19.223
  692    H    ILE  87           HN       ILE  87 113.834  -2.126  15.834
  693    HA   ILE  87           HA       ILE  87 111.465  -2.889  16.762
  694    HB   ILE  87           HB       ILE  87 113.189  -3.789  14.554
  695   HG12  ILE  87          HG12      ILE  87 110.552  -2.427  14.841
  696   HG13  ILE  87          HG11      ILE  87 112.007  -1.903  13.993
  697   HG21  ILE  87          HG21      ILE  87 110.693  -5.258  15.214
  698   HG22  ILE  87          HG22      ILE  87 112.330  -5.941  15.099
  699   HG23  ILE  87          HG23      ILE  87 111.507  -5.269  13.666
  700   HD11  ILE  87          HD11      ILE  87 110.066  -4.033  13.160
  701   HD12  ILE  87          HD12      ILE  87 111.551  -3.743  12.296
  702   HD13  ILE  87          HD13      ILE  87 110.300  -2.482  12.362
  703    HA   PRO  88           HA       PRO  88 112.251  -6.625  19.280
  704    HB2  PRO  88           HB2      PRO  88 109.783  -6.787  20.277
  705    HB3  PRO  88           HB1      PRO  88 110.853  -5.455  20.721
  706    HG2  PRO  88           HG2      PRO  88 108.437  -5.421  19.035
  707    HG3  PRO  88           HG1      PRO  88 109.238  -4.086  19.870
  708    HD2  PRO  88           HD2      PRO  88 109.492  -4.903  17.071
  709    HD3  PRO  88           HD1      PRO  88 110.104  -3.454  17.833
  710    H    ILE  89           HN       ILE  89 111.775  -8.800  19.270
  711    HA   ILE  89           HA       ILE  89 110.849  -9.980  16.874
  712    HB   ILE  89           HB       ILE  89 111.164 -11.301  19.600
  713   HG12  ILE  89          HG12      ILE  89 113.264 -11.038  17.474
  714   HG13  ILE  89          HG11      ILE  89 113.162  -9.973  18.884
  715   HG21  ILE  89          HG21      ILE  89 111.664 -13.322  18.315
  716   HG22  ILE  89          HG22      ILE  89 111.380 -12.423  16.820
  717   HG23  ILE  89          HG23      ILE  89 110.053 -12.693  17.953
  718   HD11  ILE  89          HD11      ILE  89 113.513 -11.883  20.295
  719   HD12  ILE  89          HD12      ILE  89 114.827 -11.691  19.127
  720   HD13  ILE  89          HD13      ILE  89 113.598 -12.946  18.886
  721    H    GLY  90           HN       GLY  90 108.833 -10.911  16.418
  722    HA2  GLY  90           HA2      GLY  90 106.776 -11.920  16.934
  723    HA3  GLY  90           HA1      GLY  90 106.933 -11.327  18.581
  724    H    ALA  91           HN       ALA  91 107.569  -9.109  16.161
  725    HA   ALA  91           HA       ALA  91 105.054  -7.795  16.988
  726    HB1  ALA  91           HB1      ALA  91 106.101  -5.621  16.880
  727    HB2  ALA  91           HB2      ALA  91 107.580  -6.318  16.219
  728    HB3  ALA  91           HB3      ALA  91 107.090  -6.694  17.859
  729    H    SER  92           HN       SER  92 105.074  -5.570  15.097
  730    HA   SER  92           HA       SER  92 104.558  -6.875  12.516
  731    HB2  SER  92           HB2      SER  92 102.107  -6.236  12.672
  732    HB3  SER  92           HB1      SER  92 102.617  -7.658  13.597
  733    HG   SER  92           HG       SER  92 101.209  -6.045  14.589
  734    H    VAL  93           HN       VAL  93 104.598  -5.564  10.797
  735    HA   VAL  93           HA       VAL  93 103.799  -2.782  11.104
  736    HB   VAL  93           HB       VAL  93 105.591  -1.871   9.839
  737   HG11  VAL  93          HG11      VAL  93 107.452  -1.897  11.376
  738   HG12  VAL  93          HG12      VAL  93 106.649  -3.200  12.286
  739   HG13  VAL  93          HG13      VAL  93 105.867  -1.619  12.087
  740   HG21  VAL  93          HG21      VAL  93 107.737  -3.219   9.497
  741   HG22  VAL  93          HG22      VAL  93 106.358  -3.453   8.434
  742   HG23  VAL  93          HG23      VAL  93 106.683  -4.647   9.673
  743    H    ASP  94           HN       ASP  94 103.328  -1.799   9.276
  744    HA   ASP  94           HA       ASP  94 102.604  -3.544   7.048
  745    HB2  ASP  94           HB2      ASP  94 101.867  -0.781   7.939
  746    HB3  ASP  94           HB1      ASP  94 101.429  -1.367   6.356
  747    H    LEU  95           HN       LEU  95 104.324  -3.642   5.632
  748    HA   LEU  95           HA       LEU  95 106.101  -1.350   5.499
  749    HB2  LEU  95           HB2      LEU  95 106.692  -3.870   5.794
  750    HB3  LEU  95           HB1      LEU  95 106.503  -3.912   4.055
  751    HG   LEU  95           HG       LEU  95 108.222  -2.088   3.913
  752   HD11  LEU  95          HD11      LEU  95 109.653  -1.853   5.922
  753   HD12  LEU  95          HD12      LEU  95 108.450  -2.817   6.809
  754   HD13  LEU  95          HD13      LEU  95 108.011  -1.245   6.163
  755   HD21  LEU  95          HD21      LEU  95 108.686  -4.408   3.521
  756   HD22  LEU  95          HD22      LEU  95 108.970  -4.637   5.250
  757   HD23  LEU  95          HD23      LEU  95 110.062  -3.611   4.299
  758    H    GLU  96           HN       GLU  96 106.087  -0.004   3.835
  759    HA   GLU  96           HA       GLU  96 104.482  -0.722   1.494
  760    HB2  GLU  96           HB2      GLU  96 103.645   1.181   2.815
  761    HB3  GLU  96           HB1      GLU  96 105.188   1.996   2.611
  762    HG2  GLU  96           HG2      GLU  96 104.804   2.372   0.334
  763    HG3  GLU  96           HG1      GLU  96 103.491   1.192   0.289
  764    H    LEU  97           HN       LEU  97 105.651  -1.246  -0.259
  765    HA   LEU  97           HA       LEU  97 108.021   0.287  -0.824
  766    HB2  LEU  97           HB2      LEU  97 109.505  -1.544  -1.109
  767    HB3  LEU  97           HB1      LEU  97 108.807  -1.681   0.478
  768    HG   LEU  97           HG       LEU  97 108.213  -3.445  -1.926
  769   HD11  LEU  97          HD11      LEU  97 109.198  -5.154  -0.484
  770   HD12  LEU  97          HD12      LEU  97 109.657  -3.890   0.662
  771   HD13  LEU  97          HD13      LEU  97 110.315  -3.889  -0.978
  772   HD21  LEU  97          HD21      LEU  97 106.175  -3.167  -0.528
  773   HD22  LEU  97          HD22      LEU  97 107.111  -3.632   0.894
  774   HD23  LEU  97          HD23      LEU  97 106.851  -4.793  -0.407
  775    H    CYS  98           HN       CYS  98 108.786   0.000  -3.007
  776    HA   CYS  98           HA       CYS  98 106.621  -0.881  -4.778
  777    HB2  CYS  98           HB2      CYS  98 108.565   1.390  -5.212
  778    HB3  CYS  98           HB1      CYS  98 107.330   0.867  -6.351
  779    HG   CYS  98           HG       CYS  98 106.077   3.009  -5.431
  780    H    ARG  99           HN       ARG  99 107.165  -2.061  -6.516
  781    HA   ARG  99           HA       ARG  99 109.934  -3.043  -6.586
  782    HB2  ARG  99           HB2      ARG  99 108.227  -4.732  -6.006
  783    HB3  ARG  99           HB1      ARG  99 107.370  -4.335  -7.483
  784    HG2  ARG  99           HG2      ARG  99 108.466  -6.257  -7.933
  785    HG3  ARG  99           HG1      ARG  99 109.438  -5.002  -8.711
  786    HD2  ARG  99           HD2      ARG  99 110.982  -6.426  -7.563
  787    HD3  ARG  99           HD1      ARG  99 110.788  -4.943  -6.587
  788    HE   ARG  99           HE       ARG  99 109.807  -6.117  -4.962
  789   HH11  ARG  99          HH11      ARG  99 110.121  -8.238  -7.760
  790   HH12  ARG  99          HH12      ARG  99 109.582  -9.605  -6.879
  791   HH21  ARG  99          HH21      ARG  99 109.142  -7.767  -3.905
  792   HH22  ARG  99          HH22      ARG  99 108.906  -9.338  -4.560
  793    H    GLY 100           HN       GLY 100 110.971  -2.811  -8.507
  794    HA2  GLY 100           HA2      GLY 100 109.945  -2.551 -11.040
  795    HA3  GLY 100           HA1      GLY 100 109.883  -0.926 -10.362
  796    H    TYR 101           HN       TYR 101 112.118  -1.338  -8.669
  797    HA   TYR 101           HA       TYR 101 114.252  -1.035 -10.588
  798    HB2  TYR 101           HB2      TYR 101 113.949  -0.452  -7.642
  799    HB3  TYR 101           HB1      TYR 101 115.514  -0.363  -8.431
  800    HD1  TYR 101           HD1      TYR 101 112.143   1.137  -8.255
  801    HD2  TYR 101           HD2      TYR 101 116.065   1.472  -9.864
  802    HE1  TYR 101           HE1      TYR 101 111.648   3.436  -8.980
  803    HE2  TYR 101           HE2      TYR 101 115.584   3.770 -10.580
  804    HH   TYR 101           HH       TYR 101 112.947   5.524  -9.503
  805    HA   PRO 102           HA       PRO 102 115.777  -5.061  -9.193
  806    HB2  PRO 102           HB2      PRO 102 117.751  -5.317 -10.935
  807    HB3  PRO 102           HB1      PRO 102 116.089  -5.255 -11.535
  808    HG2  PRO 102           HG2      PRO 102 118.190  -3.135 -11.559
  809    HG3  PRO 102           HG1      PRO 102 116.962  -3.507 -12.779
  810    HD2  PRO 102           HD2      PRO 102 116.799  -1.505 -10.797
  811    HD3  PRO 102           HD1      PRO 102 115.474  -2.097 -11.820
  812    H    LEU 103           HN       LEU 103 118.459  -5.700  -9.093
  813    HA   LEU 103           HA       LEU 103 119.602  -3.622  -7.367
  814    HB2  LEU 103           HB2      LEU 103 119.070  -6.145  -6.660
  815    HB3  LEU 103           HB1      LEU 103 120.558  -6.466  -7.517
  816    HG   LEU 103           HG       LEU 103 120.886  -6.350  -5.086
  817   HD11  LEU 103          HD11      LEU 103 122.214  -4.076  -6.526
  818   HD12  LEU 103          HD12      LEU 103 122.770  -5.750  -6.465
  819   HD13  LEU 103          HD13      LEU 103 122.725  -4.777  -4.992
  820   HD21  LEU 103          HD21      LEU 103 120.673  -4.229  -3.907
  821   HD22  LEU 103          HD22      LEU 103 119.125  -4.804  -4.529
  822   HD23  LEU 103          HD23      LEU 103 119.976  -3.496  -5.348
  823    HA   PRO 104           HA       PRO 104 121.898  -3.732 -11.341
  824    HB2  PRO 104           HB2      PRO 104 121.856  -1.110 -11.874
  825    HB3  PRO 104           HB1      PRO 104 120.431  -2.132 -12.075
  826    HG2  PRO 104           HG2      PRO 104 120.990  -0.090 -10.020
  827    HG3  PRO 104           HG1      PRO 104 119.437  -0.728 -10.574
  828    HD2  PRO 104           HD2      PRO 104 120.949  -1.483  -8.227
  829    HD3  PRO 104           HD1      PRO 104 119.364  -2.077  -8.757
  830    H    PHE 105           HN       PHE 105 123.418  -4.045  -9.083
  831    HA   PHE 105           HA       PHE 105 125.900  -3.084  -9.905
  832    HB2  PHE 105           HB2      PHE 105 126.518  -1.720  -7.925
  833    HB3  PHE 105           HB1      PHE 105 125.208  -0.959  -8.811
  834    HD1  PHE 105           HD1      PHE 105 122.985  -0.832  -7.848
  835    HD2  PHE 105           HD2      PHE 105 126.201  -2.596  -5.702
  836    HE1  PHE 105           HE1      PHE 105 121.683  -0.684  -5.778
  837    HE2  PHE 105           HE2      PHE 105 124.904  -2.452  -3.627
  838    HZ   PHE 105           HZ       PHE 105 122.642  -1.494  -3.665
  839    H    ASP 106           HN       ASP 106 127.554  -3.924  -8.376
  840    HA   ASP 106           HA       ASP 106 126.522  -6.343  -7.102
  841    HB2  ASP 106           HB2      ASP 106 129.301  -5.462  -7.596
  842    HB3  ASP 106           HB1      ASP 106 128.877  -6.997  -6.904
  843    HA   PRO 107           HA       PRO 107 127.413  -4.134  -3.325
  844    HB2  PRO 107           HB2      PRO 107 126.282  -6.389  -1.901
  845    HB3  PRO 107           HB1      PRO 107 125.476  -4.865  -2.299
  846    HG2  PRO 107           HG2      PRO 107 124.642  -7.211  -3.477
  847    HG3  PRO 107           HG1      PRO 107 124.703  -5.648  -4.356
  848    HD2  PRO 107           HD2      PRO 107 126.851  -7.675  -4.233
  849    HD3  PRO 107           HD1      PRO 107 125.985  -7.229  -5.663
  850    H    ASP 108           HN       ASP 108 128.682  -6.788  -4.586
  851    HA   ASP 108           HA       ASP 108 129.994  -8.040  -2.537
  852    HB2  ASP 108           HB2      ASP 108 129.555  -9.193  -4.597
  853    HB3  ASP 108           HB1      ASP 108 130.523  -8.037  -5.502
  854    H    ASP 109           HN       ASP 109 130.537  -5.379  -4.564
  855    HA   ASP 109           HA       ASP 109 133.366  -4.982  -4.138
  856    HB2  ASP 109           HB2      ASP 109 132.055  -4.359  -6.258
  857    HB3  ASP 109           HB1      ASP 109 131.307  -3.091  -5.308
  858    HA   PRO 110           HA       PRO 110 132.592  -2.940  -0.170
  859    HB2  PRO 110           HB2      PRO 110 135.110  -1.590  -0.891
  860    HB3  PRO 110           HB1      PRO 110 134.682  -2.383   0.618
  861    HG2  PRO 110           HG2      PRO 110 136.315  -3.616  -1.061
  862    HG3  PRO 110           HG1      PRO 110 134.973  -4.548  -0.364
  863    HD2  PRO 110           HD2      PRO 110 135.168  -3.286  -3.088
  864    HD3  PRO 110           HD1      PRO 110 134.603  -4.912  -2.624
  865    H    ASN 111           HN       ASN 111 133.384  -0.570   0.656
  866    HA   ASN 111           HA       ASN 111 133.327   1.465   0.681
  867    HB2  ASN 111           HB2      ASN 111 132.179   1.593  -2.105
  868    HB3  ASN 111           HB1      ASN 111 132.465   2.962  -1.031
  869   HD21  ASN 111          HD21      ASN 111 135.039   1.875  -0.051
  870   HD22  ASN 111          HD22      ASN 111 136.138   2.067  -1.350
  871    H    THR 112           HN       THR 112 132.039   2.487   1.785
  872    HA   THR 112           HA       THR 112 129.341   1.759   2.419
  873    HB   THR 112           HB       THR 112 130.698   4.402   3.009
  874    HG1  THR 112           HG1      THR 112 131.290   1.772   3.836
  875   HG21  THR 112          HG21      THR 112 129.050   2.533   4.745
  876   HG22  THR 112          HG22      THR 112 128.374   3.925   3.911
  877   HG23  THR 112          HG23      THR 112 129.583   4.154   5.173
  878    H    SER 113           HN       SER 113 128.643   4.829   2.373
  879    HA   SER 113           HA       SER 113 127.216   4.755  -0.071
  880    HB2  SER 113           HB2      SER 113 127.859   7.151   1.622
  881    HB3  SER 113           HB1      SER 113 126.421   6.856   0.641
  882    HG   SER 113           HG       SER 113 125.659   6.285   2.573
  883    H    LEU 114           HN       LEU 114 128.647   4.528  -1.802
  884    HA   LEU 114           HA       LEU 114 130.596   6.558  -2.172
  885    HB2  LEU 114           HB2      LEU 114 131.241   5.241  -4.169
  886    HB3  LEU 114           HB1      LEU 114 131.346   4.362  -2.676
  887    HG   LEU 114           HG       LEU 114 130.669   2.877  -4.374
  888   HD11  LEU 114          HD11      LEU 114 128.764   1.811  -3.666
  889   HD12  LEU 114          HD12      LEU 114 128.125   3.241  -2.930
  890   HD13  LEU 114          HD13      LEU 114 129.579   2.475  -2.248
  891   HD21  LEU 114          HD21      LEU 114 128.370   4.656  -5.026
  892   HD22  LEU 114          HD22      LEU 114 128.662   3.071  -5.750
  893   HD23  LEU 114          HD23      LEU 114 129.790   4.409  -6.042
  894    H    VAL 115           HN       VAL 115 130.451   8.166  -3.589
  895    HA   VAL 115           HA       VAL 115 127.765   8.685  -4.583
  896    HB   VAL 115           HB       VAL 115 130.168  10.531  -4.510
  897   HG11  VAL 115          HG11      VAL 115 128.546  12.340  -4.916
  898   HG12  VAL 115          HG12      VAL 115 127.253  11.148  -5.024
  899   HG13  VAL 115          HG13      VAL 115 128.515  11.167  -6.238
  900   HG21  VAL 115          HG21      VAL 115 129.081  11.597  -2.591
  901   HG22  VAL 115          HG22      VAL 115 129.429   9.893  -2.258
  902   HG23  VAL 115          HG23      VAL 115 127.792  10.397  -2.664
  903    H    THR 116           HN       THR 116 127.280   8.611  -6.652
  904    HA   THR 116           HA       THR 116 129.428   8.869  -8.563
  905    HB   THR 116           HB       THR 116 128.873   6.410  -8.365
  906    HG1  THR 116           HG1      THR 116 129.578   6.817 -10.354
  907   HG21  THR 116          HG21      THR 116 126.194   7.307  -9.377
  908   HG22  THR 116          HG22      THR 116 126.501   6.622  -7.774
  909   HG23  THR 116          HG23      THR 116 126.692   5.620  -9.226
  910    H    SER 117           HN       SER 117 128.712   9.850 -10.456
  911    HA   SER 117           HA       SER 117 126.367  11.468  -9.954
  912    HB2  SER 117           HB2      SER 117 128.498  12.672 -10.371
  913    HB3  SER 117           HB1      SER 117 128.621  11.904 -11.950
  914    HG   SER 117           HG       SER 117 127.519  13.517 -12.644
  915    H    VAL 118           HN       VAL 118 124.585  11.031 -11.085
  916    HA   VAL 118           HA       VAL 118 124.850   9.260 -13.387
  917    HB   VAL 118           HB       VAL 118 122.400   9.799 -11.674
  918   HG11  VAL 118          HG11      VAL 118 121.426   7.859 -12.827
  919   HG12  VAL 118          HG12      VAL 118 122.872   7.733 -13.830
  920   HG13  VAL 118          HG13      VAL 118 121.828   9.145 -13.967
  921   HG21  VAL 118          HG21      VAL 118 122.774   7.568 -10.742
  922   HG22  VAL 118          HG22      VAL 118 124.158   8.633 -10.442
  923   HG23  VAL 118          HG23      VAL 118 124.244   7.411 -11.708
  924    H    ALA 119           HN       ALA 119 125.025  10.494 -15.097
  925    HA   ALA 119           HA       ALA 119 122.941  12.461 -15.536
  926    HB1  ALA 119           HB1      ALA 119 124.986  13.677 -14.976
  927    HB2  ALA 119           HB2      ALA 119 124.573  13.920 -16.674
  928    HB3  ALA 119           HB3      ALA 119 125.864  12.803 -16.229
  929    H    ILE 120           HN       ILE 120 122.041  10.612 -16.516
  930    HA   ILE 120           HA       ILE 120 123.226   9.550 -18.946
  931    HB   ILE 120           HB       ILE 120 120.525   9.086 -17.641
  932   HG12  ILE 120          HG12      ILE 120 122.266   8.276 -16.207
  933   HG13  ILE 120          HG11      ILE 120 121.472   6.893 -16.944
  934   HG21  ILE 120          HG21      ILE 120 120.266   7.118 -19.042
  935   HG22  ILE 120          HG22      ILE 120 121.761   7.519 -19.883
  936   HG23  ILE 120          HG23      ILE 120 120.367   8.594 -20.002
  937   HD11  ILE 120          HD11      ILE 120 123.350   6.705 -18.534
  938   HD12  ILE 120          HD12      ILE 120 123.864   6.566 -16.850
  939   HD13  ILE 120          HD13      ILE 120 124.130   8.070 -17.727
  940    H    LEU 121           HN       LEU 121 120.206  10.978 -18.128
  941    HA   LEU 121           HA       LEU 121 119.039  12.706 -18.730
  942    HB2  LEU 121           HB2      LEU 121 120.016  14.744 -19.671
  943    HB3  LEU 121           HB1      LEU 121 120.848  14.101 -18.274
  944    HG   LEU 121           HG       LEU 121 122.553  13.158 -19.973
  945   HD11  LEU 121          HD11      LEU 121 121.294  15.258 -21.716
  946   HD12  LEU 121          HD12      LEU 121 121.279  13.520 -22.004
  947   HD13  LEU 121          HD13      LEU 121 122.804  14.408 -22.045
  948   HD21  LEU 121          HD21      LEU 121 123.800  15.268 -19.982
  949   HD22  LEU 121          HD22      LEU 121 123.059  14.944 -18.415
  950   HD23  LEU 121          HD23      LEU 121 122.336  16.127 -19.506
  951    H    ASP 122           HN       ASP 122 120.565  11.770 -21.551
  952    HA   ASP 122           HA       ASP 122 118.104  11.260 -22.895
  953    HB2  ASP 122           HB2      ASP 122 118.093  13.825 -22.815
  954    HB3  ASP 122           HB1      ASP 122 119.504  13.775 -23.862
  955    H    LYS 123           HN       LYS 123 118.636   9.868 -24.492
  956    HA   LYS 123           HA       LYS 123 121.396   9.959 -25.463
  957    HB2  LYS 123           HB2      LYS 123 119.839   7.660 -24.407
  958    HB3  LYS 123           HB1      LYS 123 120.831   7.363 -25.823
  959    HG2  LYS 123           HG2      LYS 123 121.982   6.757 -23.755
  960    HG3  LYS 123           HG1      LYS 123 122.820   8.025 -24.632
  961    HD2  LYS 123           HD2      LYS 123 121.935   9.686 -23.055
  962    HD3  LYS 123           HD1      LYS 123 121.056   8.431 -22.197
  963    HE2  LYS 123           HE2      LYS 123 123.111   8.986 -21.055
  964    HE3  LYS 123           HE1      LYS 123 123.148   7.323 -21.628
  965    HZ1  LYS 123           HZ1      LYS 123 125.240   8.429 -21.989
  966    HZ2  LYS 123           HZ2      LYS 123 124.516   9.631 -22.923
  967    HZ3  LYS 123           HZ3      LYS 123 124.557   8.042 -23.478
  968    H    GLU 124           HN       GLU 124 120.982  11.051 -27.274
  969    HA   GLU 124           HA       GLU 124 119.053   9.972 -29.141
  970    HB2  GLU 124           HB2      GLU 124 119.898  12.235 -30.346
  971    HB3  GLU 124           HB1      GLU 124 118.550  12.181 -29.229
  972    HG2  GLU 124           HG2      GLU 124 120.019  14.070 -28.786
  973    HG3  GLU 124           HG1      GLU 124 119.988  12.959 -27.426
  974    HA   PRO 125           HA       PRO 125 122.259   8.184 -31.543
  975    HB2  PRO 125           HB2      PRO 125 121.010   7.956 -33.933
  976    HB3  PRO 125           HB1      PRO 125 120.621   6.924 -32.552
  977    HG2  PRO 125           HG2      PRO 125 119.184   9.333 -33.583
  978    HG3  PRO 125           HG1      PRO 125 118.519   7.806 -32.973
  979    HD2  PRO 125           HD2      PRO 125 118.639  10.090 -31.486
  980    HD3  PRO 125           HD1      PRO 125 118.701   8.464 -30.781
  981    H1   ARG 151           HT1      ARG 151 117.661   7.130  -4.558
  982    H2   ARG 151           HT2      ARG 151 117.185   8.738  -4.642
  983    H3   ARG 151           HT3      ARG 151 118.235   8.098  -5.794
  984    HA   ARG 151           HA       ARG 151 115.453   7.194  -5.325
  985    HB2  ARG 151           HB2      ARG 151 114.898   8.143  -7.556
  986    HB3  ARG 151           HB1      ARG 151 115.363   9.360  -6.380
  987    HG2  ARG 151           HG2      ARG 151 117.399   8.282  -8.284
  988    HG3  ARG 151           HG1      ARG 151 116.254   9.511  -8.819
  989    HD2  ARG 151           HD2      ARG 151 117.074  11.094  -7.310
  990    HD3  ARG 151           HD1      ARG 151 117.848   9.875  -6.304
  991    HE   ARG 151           HE       ARG 151 119.132   9.663  -8.672
  992   HH11  ARG 151          HH11      ARG 151 118.453  12.503  -6.657
  993   HH12  ARG 151          HH12      ARG 151 119.982  13.178  -6.897
  994   HH21  ARG 151          HH21      ARG 151 121.206  10.628  -8.998
  995   HH22  ARG 151          HH22      ARG 151 121.549  12.129  -8.267
  996    H    SER 152           HN       SER 152 118.411   5.880  -6.045
  997    HA   SER 152           HA       SER 152 117.249   3.784  -7.574
  998    HB2  SER 152           HB2      SER 152 118.833   4.144  -9.574
  999    HB3  SER 152           HB1      SER 152 117.412   5.184  -9.469
 1000    HG   SER 152           HG       SER 152 119.510   6.202  -8.115
 1001    H    SER 153           HN       SER 153 118.830   4.146  -5.127
 1002    HA   SER 153           HA       SER 153 120.489   3.261  -3.979
 1003    HB2  SER 153           HB2      SER 153 120.337   1.140  -6.130
 1004    HB3  SER 153           HB1      SER 153 121.194   0.966  -4.593
 1005    HG   SER 153           HG       SER 153 118.487   0.880  -5.127
 1006    H    ARG 154           HN       ARG 154 121.340   5.294  -5.430
 1007    HA   ARG 154           HA       ARG 154 124.098   4.547  -6.142
 1008    HB2  ARG 154           HB2      ARG 154 122.556   6.904  -7.303
 1009    HB3  ARG 154           HB1      ARG 154 124.169   6.384  -7.746
 1010    HG2  ARG 154           HG2      ARG 154 121.606   4.893  -8.302
 1011    HG3  ARG 154           HG1      ARG 154 122.557   5.803  -9.469
 1012    HD2  ARG 154           HD2      ARG 154 124.436   4.238  -9.126
 1013    HD3  ARG 154           HD1      ARG 154 123.445   3.321  -7.990
 1014    HE   ARG 154           HE       ARG 154 122.092   3.615 -10.437
 1015   HH11  ARG 154          HH11      ARG 154 124.763   1.712  -9.029
 1016   HH12  ARG 154          HH12      ARG 154 124.625   0.469 -10.188
 1017   HH21  ARG 154          HH21      ARG 154 121.981   1.922 -11.996
 1018   HH22  ARG 154          HH22      ARG 154 123.062   0.605 -11.932
 1019    H    THR 155           HN       THR 155 125.586   5.703  -4.915
 1020    HA   THR 155           HA       THR 155 126.272   6.707  -3.042
 1021    HB   THR 155           HB       THR 155 123.854   8.575  -3.324
 1022    HG1  THR 155           HG1      THR 155 125.346   9.927  -4.484
 1023   HG21  THR 155          HG21      THR 155 125.018   8.762  -1.189
 1024   HG22  THR 155          HG22      THR 155 125.354  10.199  -2.162
 1025   HG23  THR 155          HG23      THR 155 126.562   8.916  -2.015
 1026    H    ARG 156           HN       ARG 156 125.310   4.486  -2.634
 1027    HA   ARG 156           HA       ARG 156 123.001   4.571  -0.803
 1028    HB2  ARG 156           HB2      ARG 156 122.220   2.543  -1.652
 1029    HB3  ARG 156           HB1      ARG 156 122.854   3.316  -3.087
 1030    HG2  ARG 156           HG2      ARG 156 124.182   1.111  -1.491
 1031    HG3  ARG 156           HG1      ARG 156 123.390   0.932  -3.047
 1032    HD2  ARG 156           HD2      ARG 156 125.134   2.247  -4.116
 1033    HD3  ARG 156           HD1      ARG 156 125.859   2.611  -2.547
 1034    HE   ARG 156           HE       ARG 156 126.201   0.244  -4.107
 1035   HH11  ARG 156          HH11      ARG 156 126.441   1.529  -0.761
 1036   HH12  ARG 156          HH12      ARG 156 127.303   0.185  -0.194
 1037   HH21  ARG 156          HH21      ARG 156 127.433  -1.545  -3.254
 1038   HH22  ARG 156          HH22      ARG 156 127.858  -1.612  -1.610
 1039    H    ARG 157           HN       ARG 157 123.090   3.267   1.073
 1040    HA   ARG 157           HA       ARG 157 125.710   2.054   1.678
 1041    HB2  ARG 157           HB2      ARG 157 125.256   2.693   4.067
 1042    HB3  ARG 157           HB1      ARG 157 125.468   4.080   3.012
 1043    HG2  ARG 157           HG2      ARG 157 123.686   4.633   4.428
 1044    HG3  ARG 157           HG1      ARG 157 122.932   4.194   2.900
 1045    HD2  ARG 157           HD2      ARG 157 122.733   1.846   3.905
 1046    HD3  ARG 157           HD1      ARG 157 123.066   2.623   5.443
 1047    HE   ARG 157           HE       ARG 157 121.092   4.056   4.871
 1048   HH11  ARG 157          HH11      ARG 157 121.375   0.868   3.401
 1049   HH12  ARG 157          HH12      ARG 157 119.728   0.485   3.516
 1050   HH21  ARG 157          HH21      ARG 157 118.868   3.599   5.008
 1051   HH22  ARG 157          HH22      ARG 157 118.233   2.100   4.482
 1052    H    GLU 158           HN       GLU 158 125.354   0.391   3.568
 1053    HA   GLU 158           HA       GLU 158 122.957  -1.171   2.961
 1054    HB2  GLU 158           HB2      GLU 158 125.633  -1.995   4.076
 1055    HB3  GLU 158           HB1      GLU 158 124.228  -3.043   4.097
 1056    HG2  GLU 158           HG2      GLU 158 124.144  -2.919   1.639
 1057    HG3  GLU 158           HG1      GLU 158 125.614  -1.944   1.667
 1058    H    THR 159           HN       THR 159 121.772  -2.064   4.594
 1059    HA   THR 159           HA       THR 159 122.379  -1.573   7.375
 1060    HB   THR 159           HB       THR 159 119.797  -0.588   6.077
 1061    HG1  THR 159           HG1      THR 159 122.128   0.492   6.487
 1062   HG21  THR 159          HG21      THR 159 120.606  -0.496   9.028
 1063   HG22  THR 159          HG22      THR 159 119.327  -1.498   8.370
 1064   HG23  THR 159          HG23      THR 159 119.164   0.247   8.357
 1065    H    GLN 160           HN       GLN 160 122.105  -3.487   8.261
 1066    HA   GLN 160           HA       GLN 160 120.494  -5.480   6.956
 1067    HB2  GLN 160           HB2      GLN 160 122.621  -6.223   7.858
 1068    HB3  GLN 160           HB1      GLN 160 122.216  -5.589   9.448
 1069    HG2  GLN 160           HG2      GLN 160 120.475  -7.249   9.701
 1070    HG3  GLN 160           HG1      GLN 160 120.752  -7.843   8.069
 1071   HE21  GLN 160          HE21      GLN 160 121.919  -7.752  11.306
 1072   HE22  GLN 160          HE22      GLN 160 123.085  -9.000  11.150
 1073    H    VAL 161           HN       VAL 161 118.476  -6.064   7.546
 1074    HA   VAL 161           HA       VAL 161 117.670  -5.105  10.085
 1075    HB   VAL 161           HB       VAL 161 115.507  -4.352   9.290
 1076   HG11  VAL 161          HG11      VAL 161 116.074  -2.496   7.846
 1077   HG12  VAL 161          HG12      VAL 161 117.661  -3.216   7.568
 1078   HG13  VAL 161          HG13      VAL 161 117.206  -2.673   9.198
 1079   HG21  VAL 161          HG21      VAL 161 116.374  -5.086   6.511
 1080   HG22  VAL 161          HG22      VAL 161 114.867  -4.280   6.947
 1081   HG23  VAL 161          HG23      VAL 161 115.167  -5.943   7.461
  Start of MODEL    6
    1    H1   GLY  -3           HT1      GLY  -3 116.220   7.474 -25.194
    2    H2   GLY  -3           HT2      GLY  -3 114.588   7.915 -25.085
    3    H3   GLY  -3           HT3      GLY  -3 115.486   7.551 -23.693
    4    HA2  GLY  -3           HA1      GLY  -3 116.031   9.839 -25.459
    5    HA3  GLY  -3           HA2      GLY  -3 115.179   9.913 -23.915
    6    H    ALA  -2           HN       ALA  -2 116.487  10.751 -22.455
    7    HA   ALA  -2           HA       ALA  -2 119.113   9.530 -22.072
    8    HB1  ALA  -2           HB1      ALA  -2 120.196  11.709 -21.814
    9    HB2  ALA  -2           HB2      ALA  -2 118.682  12.520 -22.203
   10    HB3  ALA  -2           HB3      ALA  -2 119.501  11.555 -23.430
   11    H    MET  -1           HN       MET  -1 116.598   9.294 -20.746
   12    HA   MET  -1           HA       MET  -1 116.841  10.874 -18.347
   13    HB2  MET  -1           HB2      MET  -1 114.726   8.931 -19.264
   14    HB3  MET  -1           HB1      MET  -1 114.723   9.633 -17.662
   15    HG2  MET  -1           HG2      MET  -1 113.209  10.860 -19.070
   16    HG3  MET  -1           HG1      MET  -1 114.580  11.877 -18.663
   17    HE1  MET  -1           HE1      MET  -1 113.506  13.103 -22.235
   18    HE2  MET  -1           HE2      MET  -1 113.804  13.571 -20.562
   19    HE3  MET  -1           HE3      MET  -1 112.451  12.509 -20.953
   20    H    GLY   0           HN       GLY   0 118.986   9.670 -18.241
   21    HA2  GLY   0           HA2      GLY   0 118.683   7.221 -16.665
   22    HA3  GLY   0           HA1      GLY   0 120.176   7.789 -17.411
   23    H    LYS   1           HN       LYS   1 117.865   9.594 -15.507
   24    HA   LYS   1           HA       LYS   1 119.976  10.123 -13.534
   25    HB2  LYS   1           HB2      LYS   1 117.610  11.869 -14.294
   26    HB3  LYS   1           HB1      LYS   1 118.710  12.187 -12.982
   27    HG2  LYS   1           HG2      LYS   1 119.433  13.618 -14.646
   28    HG3  LYS   1           HG1      LYS   1 120.533  12.251 -14.761
   29    HD2  LYS   1           HD2      LYS   1 119.826  13.004 -16.984
   30    HD3  LYS   1           HD1      LYS   1 119.251  11.373 -16.650
   31    HE2  LYS   1           HE2      LYS   1 117.572  12.830 -17.753
   32    HE3  LYS   1           HE1      LYS   1 117.018  12.172 -16.225
   33    HZ1  LYS   1           HZ1      LYS   1 116.472  14.511 -16.557
   34    HZ2  LYS   1           HZ2      LYS   1 118.097  14.926 -16.590
   35    HZ3  LYS   1           HZ3      LYS   1 117.406  14.302 -15.182
   36    HA   PRO   2           HA       PRO   2 117.146   8.276 -10.714
   37    HB2  PRO   2           HB2      PRO   2 117.901   9.471  -8.399
   38    HB3  PRO   2           HB1      PRO   2 118.772   8.130  -9.143
   39    HG2  PRO   2           HG2      PRO   2 119.387  11.030  -9.106
   40    HG3  PRO   2           HG1      PRO   2 120.516   9.660  -9.132
   41    HD2  PRO   2           HD2      PRO   2 119.850  11.240 -11.312
   42    HD3  PRO   2           HD1      PRO   2 120.525   9.613 -11.430
   43    H    PHE   3           HN       PHE   3 115.203   8.714 -10.098
   44    HA   PHE   3           HA       PHE   3 114.346  11.473 -10.144
   45    HB2  PHE   3           HB2      PHE   3 112.055  10.443 -10.485
   46    HB3  PHE   3           HB1      PHE   3 113.205  10.198 -11.818
   47    HD1  PHE   3           HD1      PHE   3 114.229   7.913 -12.014
   48    HD2  PHE   3           HD2      PHE   3 111.087   8.848  -9.376
   49    HE1  PHE   3           HE1      PHE   3 113.680   5.506 -11.844
   50    HE2  PHE   3           HE2      PHE   3 110.508   6.544  -9.170
   51    HZ   PHE   3           HZ       PHE   3 111.804   4.797 -10.409
   52    H    PHE   4           HN       PHE   4 113.528  12.360  -8.419
   53    HA   PHE   4           HA       PHE   4 112.730  10.749  -6.156
   54    HB2  PHE   4           HB2      PHE   4 114.939  10.946  -5.400
   55    HB3  PHE   4           HB1      PHE   4 115.136  12.502  -6.214
   56    HD1  PHE   4           HD1      PHE   4 113.587  10.899  -3.239
   57    HD2  PHE   4           HD2      PHE   4 114.758  14.532  -5.126
   58    HE1  PHE   4           HE1      PHE   4 112.984  12.177  -1.214
   59    HE2  PHE   4           HE2      PHE   4 114.171  15.778  -3.121
   60    HZ   PHE   4           HZ       PHE   4 113.295  14.588  -1.146
   61    H    THR   5           HN       THR   5 111.203  11.629  -5.092
   62    HA   THR   5           HA       THR   5 111.319  14.270  -4.301
   63    HB   THR   5           HB       THR   5 110.107  14.775  -6.314
   64    HG1  THR   5           HG1      THR   5 109.669  15.968  -4.405
   65   HG21  THR   5          HG21      THR   5 107.898  12.978  -5.242
   66   HG22  THR   5          HG22      THR   5 108.850  12.667  -6.674
   67   HG23  THR   5          HG23      THR   5 107.737  14.034  -6.637
   68    H    ARG   6           HN       ARG   6 109.654  11.470  -4.209
   69    HA   ARG   6           HA       ARG   6 109.781  10.640  -1.626
   70    HB2  ARG   6           HB2      ARG   6 107.877  11.549  -0.392
   71    HB3  ARG   6           HB1      ARG   6 108.975  12.827  -0.884
   72    HG2  ARG   6           HG2      ARG   6 107.471  13.276  -2.817
   73    HG3  ARG   6           HG1      ARG   6 106.313  12.156  -2.085
   74    HD2  ARG   6           HD2      ARG   6 107.606  14.355  -0.716
   75    HD3  ARG   6           HD1      ARG   6 106.063  14.600  -1.568
   76    HE   ARG   6           HE       ARG   6 105.838  12.404   0.222
   77   HH11  ARG   6          HH11      ARG   6 106.059  15.956   0.448
   78   HH12  ARG   6          HH12      ARG   6 105.219  16.020   1.921
   79   HH21  ARG   6          HH21      ARG   6 104.656  12.551   2.234
   80   HH22  ARG   6          HH22      ARG   6 104.426  14.071   2.956
   81    H    ASN   7           HN       ASN   7 108.017  11.115  -4.427
   82    HA   ASN   7           HA       ASN   7 105.713   9.666  -3.660
   83    HB2  ASN   7           HB2      ASN   7 106.612  10.764  -6.249
   84    HB3  ASN   7           HB1      ASN   7 105.382   9.506  -6.274
   85   HD21  ASN   7          HD21      ASN   7 106.081  12.785  -5.512
   86   HD22  ASN   7          HD22      ASN   7 104.490  13.227  -5.032
   87    HA   PRO   8           HA       PRO   8 107.057   5.382  -4.020
   88    HB2  PRO   8           HB2      PRO   8 104.214   5.131  -4.164
   89    HB3  PRO   8           HB1      PRO   8 105.218   4.319  -3.061
   90    HG2  PRO   8           HG2      PRO   8 103.485   6.310  -2.593
   91    HG3  PRO   8           HG1      PRO   8 104.829   6.017  -1.456
   92    HD2  PRO   8           HD2      PRO   8 104.244   8.172  -3.214
   93    HD3  PRO   8           HD1      PRO   8 105.588   8.094  -2.049
   94    H    SER   9           HN       SER   9 104.451   7.029  -5.194
   95    HA   SER   9           HA       SER   9 103.612   5.500  -7.100
   96    HB2  SER   9           HB2      SER   9 103.463   8.242  -6.285
   97    HB3  SER   9           HB1      SER   9 102.337   7.668  -7.595
   98    HG   SER   9           HG       SER   9 101.341   6.552  -6.046
   99    H    GLU  10           HN       GLU  10 106.312   7.996  -7.085
  100    HA   GLU  10           HA       GLU  10 106.411   8.217  -9.954
  101    HB2  GLU  10           HB2      GLU  10 108.481   9.545  -9.631
  102    HB3  GLU  10           HB1      GLU  10 107.263  10.092  -8.475
  103    HG2  GLU  10           HG2      GLU  10 108.440   8.616  -6.814
  104    HG3  GLU  10           HG1      GLU  10 109.703   8.409  -8.008
  105    H    LEU  11           HN       LEU  11 107.773   6.338  -7.406
  106    HA   LEU  11           HA       LEU  11 109.784   4.948  -8.805
  107    HB2  LEU  11           HB2      LEU  11 108.044   4.044  -6.522
  108    HB3  LEU  11           HB1      LEU  11 109.492   3.226  -7.079
  109    HG   LEU  11           HG       LEU  11 109.445   6.026  -5.932
  110   HD11  LEU  11          HD11      LEU  11 110.329   3.436  -4.708
  111   HD12  LEU  11          HD12      LEU  11 108.886   4.349  -4.266
  112   HD13  LEU  11          HD13      LEU  11 110.489   5.036  -3.980
  113   HD21  LEU  11          HD21      LEU  11 111.282   5.669  -7.498
  114   HD22  LEU  11          HD22      LEU  11 111.710   4.185  -6.665
  115   HD23  LEU  11          HD23      LEU  11 111.888   5.735  -5.840
  116    H    LYS  12           HN       LYS  12 109.869   3.410  -9.972
  117    HA   LYS  12           HA       LYS  12 107.591   2.853 -11.611
  118    HB2  LYS  12           HB2      LYS  12 109.191   1.660 -13.044
  119    HB3  LYS  12           HB1      LYS  12 109.602   3.341 -12.720
  120    HG2  LYS  12           HG2      LYS  12 111.247   2.769 -11.207
  121    HG3  LYS  12           HG1      LYS  12 110.648   1.114 -11.101
  122    HD2  LYS  12           HD2      LYS  12 111.337   0.678 -13.334
  123    HD3  LYS  12           HD1      LYS  12 111.818   2.362 -13.598
  124    HE2  LYS  12           HE2      LYS  12 113.526   2.060 -11.791
  125    HE3  LYS  12           HE1      LYS  12 113.089   0.355 -11.723
  126    HZ1  LYS  12           HZ1      LYS  12 115.059   0.736 -13.114
  127    HZ2  LYS  12           HZ2      LYS  12 114.194   1.744 -14.115
  128    HZ3  LYS  12           HZ3      LYS  12 113.802   0.121 -14.032
  129    H    GLY  13           HN       GLY  13 107.362   0.729 -12.541
  130    HA2  GLY  13           HA2      GLY  13 107.129  -1.599 -12.384
  131    HA3  GLY  13           HA1      GLY  13 107.744  -1.528 -10.745
  132    H    LYS  14           HN       LYS  14 106.414  -1.829  -9.223
  133    HA   LYS  14           HA       LYS  14 103.597  -1.147  -9.425
  134    HB2  LYS  14           HB2      LYS  14 103.144  -3.420  -8.303
  135    HB3  LYS  14           HB1      LYS  14 103.304  -3.358 -10.062
  136    HG2  LYS  14           HG2      LYS  14 105.686  -3.887  -8.471
  137    HG3  LYS  14           HG1      LYS  14 104.511  -5.197  -8.496
  138    HD2  LYS  14           HD2      LYS  14 104.603  -4.980 -11.048
  139    HD3  LYS  14           HD1      LYS  14 105.949  -3.868 -10.817
  140    HE2  LYS  14           HE2      LYS  14 106.853  -6.039 -11.307
  141    HE3  LYS  14           HE1      LYS  14 107.143  -5.675  -9.607
  142    HZ1  LYS  14           HZ1      LYS  14 106.361  -7.979 -10.041
  143    HZ2  LYS  14           HZ2      LYS  14 104.888  -7.360 -10.557
  144    HZ3  LYS  14           HZ3      LYS  14 105.369  -7.145  -8.968
  145    H    PHE  15           HN       PHE  15 102.596  -0.939  -7.413
  146    HA   PHE  15           HA       PHE  15 104.508  -0.396  -5.276
  147    HB2  PHE  15           HB2      PHE  15 103.607   1.607  -6.362
  148    HB3  PHE  15           HB1      PHE  15 101.986   0.979  -6.131
  149    HD1  PHE  15           HD1      PHE  15 104.361   0.682  -3.404
  150    HD2  PHE  15           HD2      PHE  15 101.377   3.063  -5.201
  151    HE1  PHE  15           HE1      PHE  15 104.210   2.037  -1.318
  152    HE2  PHE  15           HE2      PHE  15 101.194   4.439  -3.156
  153    HZ   PHE  15           HZ       PHE  15 102.607   3.948  -1.226
  154    H    ILE  16           HN       ILE  16 104.189  -1.691  -3.611
  155    HA   ILE  16           HA       ILE  16 101.533  -2.694  -3.029
  156    HB   ILE  16           HB       ILE  16 102.534  -4.854  -2.358
  157   HG12  ILE  16          HG12      ILE  16 104.931  -4.112  -2.523
  158   HG13  ILE  16          HG11      ILE  16 104.588  -5.674  -3.210
  159   HG21  ILE  16          HG21      ILE  16 102.370  -4.197  -5.251
  160   HG22  ILE  16          HG22      ILE  16 101.081  -4.719  -4.156
  161   HG23  ILE  16          HG23      ILE  16 102.393  -5.836  -4.584
  162   HD11  ILE  16          HD11      ILE  16 106.162  -4.360  -4.613
  163   HD12  ILE  16          HD12      ILE  16 104.905  -3.131  -4.852
  164   HD13  ILE  16          HD13      ILE  16 104.683  -4.751  -5.474
  165    H    HIS  17           HN       HIS  17 101.191  -3.418  -0.968
  166    HA   HIS  17           HA       HIS  17 103.250  -2.634   0.882
  167    HB2  HIS  17           HB2      HIS  17 101.484  -1.708   2.421
  168    HB3  HIS  17           HB1      HIS  17 101.717  -0.874   0.880
  169    HD1  HIS  17           HD1      HIS  17  99.700  -0.424  -0.485
  170    HD2  HIS  17           HD2      HIS  17  99.004  -3.288   2.430
  171    HE1  HIS  17           HE1      HIS  17  97.236  -0.869  -0.519
  172    H    THR  18           HN       THR  18 103.929  -4.246   1.886
  173    HA   THR  18           HA       THR  18 102.100  -6.460   2.522
  174    HB   THR  18           HB       THR  18 103.569  -7.166   0.734
  175    HG1  THR  18           HG1      THR  18 104.512  -8.320   3.167
  176   HG21  THR  18          HG21      THR  18 105.912  -6.509   2.521
  177   HG22  THR  18          HG22      THR  18 105.367  -5.524   1.170
  178   HG23  THR  18          HG23      THR  18 105.973  -7.152   0.869
  179    H    LYS  19           HN       LYS  19 102.172  -7.298   4.510
  180    HA   LYS  19           HA       LYS  19 103.546  -5.784   6.570
  181    HB2  LYS  19           HB2      LYS  19 101.169  -6.371   6.773
  182    HB3  LYS  19           HB1      LYS  19 101.560  -8.073   6.694
  183    HG2  LYS  19           HG2      LYS  19 102.430  -6.245   8.949
  184    HG3  LYS  19           HG1      LYS  19 100.933  -7.166   8.961
  185    HD2  LYS  19           HD2      LYS  19 102.431  -9.261   8.694
  186    HD3  LYS  19           HD1      LYS  19 103.783  -8.202   9.077
  187    HE2  LYS  19           HE2      LYS  19 103.045  -9.312  11.051
  188    HE3  LYS  19           HE1      LYS  19 102.745  -7.583  11.157
  189    HZ1  LYS  19           HZ1      LYS  19 100.723  -9.621  10.453
  190    HZ2  LYS  19           HZ2      LYS  19 100.407  -7.970  10.709
  191    HZ3  LYS  19           HZ3      LYS  19 100.904  -8.956  11.979
  192    H    LEU  20           HN       LEU  20 105.256  -6.505   7.758
  193    HA   LEU  20           HA       LEU  20 106.091  -9.293   7.405
  194    HB2  LEU  20           HB2      LEU  20 107.607  -6.863   6.893
  195    HB3  LEU  20           HB1      LEU  20 108.370  -7.830   8.139
  196    HG   LEU  20           HG       LEU  20 108.638  -9.682   6.647
  197   HD11  LEU  20          HD11      LEU  20 107.144  -8.080   4.594
  198   HD12  LEU  20          HD12      LEU  20 106.631  -9.591   5.391
  199   HD13  LEU  20          HD13      LEU  20 108.040  -9.585   4.342
  200   HD21  LEU  20          HD21      LEU  20 110.120  -8.686   5.043
  201   HD22  LEU  20          HD22      LEU  20 110.277  -7.938   6.629
  202   HD23  LEU  20          HD23      LEU  20 109.404  -7.101   5.340
  203    H    ARG  21           HN       ARG  21 106.223 -10.311   9.270
  204    HA   ARG  21           HA       ARG  21 105.743  -8.729  11.522
  205    HB2  ARG  21           HB2      ARG  21 104.579 -10.874  11.214
  206    HB3  ARG  21           HB1      ARG  21 106.119 -11.722  11.302
  207    HG2  ARG  21           HG2      ARG  21 106.445 -10.954  13.565
  208    HG3  ARG  21           HG1      ARG  21 104.950 -10.036  13.487
  209    HD2  ARG  21           HD2      ARG  21 103.740 -12.131  13.094
  210    HD3  ARG  21           HD1      ARG  21 105.253 -13.007  13.340
  211    HE   ARG  21           HE       ARG  21 104.622 -11.177  15.469
  212   HH11  ARG  21          HH11      ARG  21 104.038 -14.499  14.366
  213   HH12  ARG  21          HH12      ARG  21 103.762 -15.107  15.918
  214   HH21  ARG  21          HH21      ARG  21 104.243 -12.019  17.613
  215   HH22  ARG  21          HH22      ARG  21 103.867 -13.665  17.818
  216    H    LYS  22           HN       LYS  22 107.549  -7.762  12.400
  217    HA   LYS  22           HA       LYS  22 110.139  -7.967  12.347
  218    HB2  LYS  22           HB2      LYS  22 108.322  -7.737  14.665
  219    HB3  LYS  22           HB1      LYS  22 110.055  -7.712  14.882
  220    HG2  LYS  22           HG2      LYS  22 109.164  -5.507  14.879
  221    HG3  LYS  22           HG1      LYS  22 110.209  -5.874  13.502
  222    HD2  LYS  22           HD2      LYS  22 108.447  -5.612  12.034
  223    HD3  LYS  22           HD1      LYS  22 107.350  -6.192  13.314
  224    HE2  LYS  22           HE2      LYS  22 106.940  -3.842  12.846
  225    HE3  LYS  22           HE1      LYS  22 107.474  -4.146  14.486
  226    HZ1  LYS  22           HZ1      LYS  22 109.215  -3.058  12.319
  227    HZ2  LYS  22           HZ2      LYS  22 109.654  -3.344  13.940
  228    HZ3  LYS  22           HZ3      LYS  22 108.522  -2.200  13.587
  229    H    SER  23           HN       SER  23 111.265  -9.729  12.209
  230    HA   SER  23           HA       SER  23 110.769 -12.020  13.882
  231    HB2  SER  23           HB2      SER  23 111.304 -12.171  11.417
  232    HB3  SER  23           HB1      SER  23 112.906 -11.542  11.768
  233    HG   SER  23           HG       SER  23 113.330 -13.611  11.970
  234    H    SER  24           HN       SER  24 113.884 -12.434  13.821
  235    HA   SER  24           HA       SER  24 114.414 -11.762  16.445
  236    HB2  SER  24           HB2      SER  24 116.407 -12.279  14.256
  237    HB3  SER  24           HB1      SER  24 116.618 -12.563  15.985
  238    HG   SER  24           HG       SER  24 115.404 -14.301  15.883
  239    H    ARG  25           HN       ARG  25 113.793  -9.440  16.440
  240    HA   ARG  25           HA       ARG  25 114.208  -7.402  16.888
  241    HB2  ARG  25           HB2      ARG  25 116.977  -8.389  17.090
  242    HB3  ARG  25           HB1      ARG  25 116.554  -6.700  17.429
  243    HG2  ARG  25           HG2      ARG  25 114.871  -7.404  19.002
  244    HG3  ARG  25           HG1      ARG  25 115.234  -9.087  18.648
  245    HD2  ARG  25           HD2      ARG  25 116.253  -8.555  20.578
  246    HD3  ARG  25           HD1      ARG  25 117.449  -8.670  19.240
  247    HE   ARG  25           HE       ARG  25 116.676  -6.000  19.573
  248   HH11  ARG  25          HH11      ARG  25 118.630  -8.352  21.347
  249   HH12  ARG  25          HH12      ARG  25 119.614  -7.173  22.090
  250   HH21  ARG  25          HH21      ARG  25 118.003  -4.397  20.582
  251   HH22  ARG  25          HH22      ARG  25 119.292  -4.861  21.597
  252    H    GLY  26           HN       GLY  26 113.790  -7.969  14.350
  253    HA2  GLY  26           HA2      GLY  26 114.300  -5.744  12.903
  254    HA3  GLY  26           HA1      GLY  26 115.646  -6.838  12.544
  255    H    PHE  27           HN       PHE  27 115.260  -7.776  10.705
  256    HA   PHE  27           HA       PHE  27 112.577  -8.858  10.260
  257    HB2  PHE  27           HB2      PHE  27 114.103  -6.910   8.755
  258    HB3  PHE  27           HB1      PHE  27 113.018  -7.939   7.795
  259    HD1  PHE  27           HD2      PHE  27 110.540  -7.929   9.071
  260    HD2  PHE  27           HD1      PHE  27 113.588  -4.998   9.415
  261    HE1  PHE  27           HE2      PHE  27 108.884  -6.253   9.930
  262    HE2  PHE  27           HE1      PHE  27 111.979  -3.423  10.269
  263    HZ   PHE  27           HZ       PHE  27 109.671  -4.050  10.564
  264    H    GLY  28           HN       GLY  28 115.665  -8.694   8.423
  265    HA2  GLY  28           HA2      GLY  28 116.742 -10.878   8.031
  266    HA3  GLY  28           HA1      GLY  28 115.130 -11.548   7.841
  267    H    PHE  29           HN       PHE  29 116.484  -8.553   6.564
  268    HA   PHE  29           HA       PHE  29 117.036  -9.625   4.005
  269    HB2  PHE  29           HB2      PHE  29 115.534  -8.200   2.688
  270    HB3  PHE  29           HB1      PHE  29 114.621  -9.315   3.651
  271    HD1  PHE  29           HD1      PHE  29 115.637  -5.861   3.315
  272    HD2  PHE  29           HD2      PHE  29 113.053  -8.531   5.288
  273    HE1  PHE  29           HE1      PHE  29 114.276  -3.931   4.122
  274    HE2  PHE  29           HE2      PHE  29 111.701  -6.641   6.112
  275    HZ   PHE  29           HZ       PHE  29 112.308  -4.346   5.525
  276    H    THR  30           HN       THR  30 118.449  -8.222   2.934
  277    HA   THR  30           HA       THR  30 119.267  -6.094   4.744
  278    HB   THR  30           HB       THR  30 121.569  -6.396   3.863
  279    HG1  THR  30           HG1      THR  30 121.901  -8.376   2.657
  280   HG21  THR  30          HG21      THR  30 120.293  -8.943   4.832
  281   HG22  THR  30          HG22      THR  30 120.738  -7.602   5.861
  282   HG23  THR  30          HG23      THR  30 121.995  -8.513   4.997
  283    H    VAL  31           HN       VAL  31 119.584  -4.078   3.969
  284    HA   VAL  31           HA       VAL  31 118.500  -3.747   1.283
  285    HB   VAL  31           HB       VAL  31 116.945  -2.340   2.080
  286   HG11  VAL  31          HG11      VAL  31 117.751  -3.273   4.766
  287   HG12  VAL  31          HG12      VAL  31 116.601  -4.007   3.653
  288   HG13  VAL  31          HG13      VAL  31 116.256  -2.427   4.363
  289   HG21  VAL  31          HG21      VAL  31 119.013  -1.033   3.808
  290   HG22  VAL  31          HG22      VAL  31 117.316  -0.543   3.643
  291   HG23  VAL  31          HG23      VAL  31 118.393  -0.484   2.242
  292    H    VAL  32           HN       VAL  32 119.083  -1.718   0.211
  293    HA   VAL  32           HA       VAL  32 121.659  -0.620   0.963
  294    HB   VAL  32           HB       VAL  32 122.162  -0.279  -1.490
  295   HG11  VAL  32          HG11      VAL  32 123.326  -1.933  -0.204
  296   HG12  VAL  32          HG12      VAL  32 123.003  -2.552  -1.830
  297   HG13  VAL  32          HG13      VAL  32 122.018  -3.082  -0.463
  298   HG21  VAL  32          HG21      VAL  32 119.963  -0.658  -2.424
  299   HG22  VAL  32          HG22      VAL  32 119.957  -2.316  -1.827
  300   HG23  VAL  32          HG23      VAL  32 121.093  -1.837  -3.091
  301    H    GLY  33           HN       GLY  33 121.753   1.441   1.076
  302    HA2  GLY  33           HA2      GLY  33 121.290   3.564  -0.144
  303    HA3  GLY  33           HA1      GLY  33 119.649   2.980  -0.273
  304    H    GLY  34           HN       GLY  34 118.489   4.236   0.773
  305    HA2  GLY  34           HA2      GLY  34 117.637   5.728   2.244
  306    HA3  GLY  34           HA1      GLY  34 117.837   4.493   3.432
  307    H    ASP  35           HN       ASP  35 119.915   6.564   1.649
  308    HA   ASP  35           HA       ASP  35 121.445   7.037   4.099
  309    HB2  ASP  35           HB2      ASP  35 122.360   6.258   1.914
  310    HB3  ASP  35           HB1      ASP  35 122.055   7.848   1.303
  311    H    GLU  36           HN       GLU  36 119.128   8.508   2.120
  312    HA   GLU  36           HA       GLU  36 119.421  11.096   3.413
  313    HB2  GLU  36           HB2      GLU  36 119.956  12.100   1.146
  314    HB3  GLU  36           HB1      GLU  36 121.301  11.312   1.968
  315    HG2  GLU  36           HG2      GLU  36 120.854   9.311   0.717
  316    HG3  GLU  36           HG1      GLU  36 119.615  10.177  -0.215
  317    HA   PRO  37           HA       PRO  37 115.299  11.520   2.321
  318    HB2  PRO  37           HB2      PRO  37 116.181  14.027   1.057
  319    HB3  PRO  37           HB1      PRO  37 114.867  13.871   2.284
  320    HG2  PRO  37           HG2      PRO  37 117.147  14.935   3.010
  321    HG3  PRO  37           HG1      PRO  37 116.604  13.535   3.972
  322    HD2  PRO  37           HD2      PRO  37 118.453  13.574   1.618
  323    HD3  PRO  37           HD1      PRO  37 118.853  12.944   3.201
  324    H    ASP  38           HN       ASP  38 117.645  12.486   0.105
  325    HA   ASP  38           HA       ASP  38 116.187  12.312  -2.236
  326    HB2  ASP  38           HB2      ASP  38 118.052  13.695  -2.172
  327    HB3  ASP  38           HB1      ASP  38 119.095  12.417  -1.567
  328    H    GLU  39           HN       GLU  39 117.858   9.903  -0.326
  329    HA   GLU  39           HA       GLU  39 117.277   8.024  -2.445
  330    HB2  GLU  39           HB2      GLU  39 119.680   8.307  -2.487
  331    HB3  GLU  39           HB1      GLU  39 119.782   7.978  -0.764
  332    HG2  GLU  39           HG2      GLU  39 119.090   5.703  -1.105
  333    HG3  GLU  39           HG1      GLU  39 118.787   6.028  -2.809
  334    H    PHE  40           HN       PHE  40 115.945   6.721  -1.952
  335    HA   PHE  40           HA       PHE  40 114.964   6.067   0.713
  336    HB2  PHE  40           HB2      PHE  40 114.067   4.896  -1.931
  337    HB3  PHE  40           HB1      PHE  40 113.149   5.019  -0.441
  338    HD1  PHE  40           HD1      PHE  40 113.260   7.782   0.306
  339    HD2  PHE  40           HD2      PHE  40 113.067   6.081  -3.587
  340    HE1  PHE  40           HE1      PHE  40 112.204   9.835  -0.540
  341    HE2  PHE  40           HE2      PHE  40 112.015   8.130  -4.439
  342    HZ   PHE  40           HZ       PHE  40 111.580  10.010  -2.916
  343    H    LEU  41           HN       LEU  41 114.422   3.613   1.053
  344    HA   LEU  41           HA       LEU  41 117.078   2.433   0.784
  345    HB2  LEU  41           HB2      LEU  41 114.761   1.392   2.474
  346    HB3  LEU  41           HB1      LEU  41 116.409   0.793   2.328
  347    HG   LEU  41           HG       LEU  41 117.226   2.823   3.310
  348   HD11  LEU  41          HD11      LEU  41 115.375   4.404   2.969
  349   HD12  LEU  41          HD12      LEU  41 115.657   4.255   4.703
  350   HD13  LEU  41          HD13      LEU  41 114.312   3.409   3.957
  351   HD21  LEU  41          HD21      LEU  41 115.392   1.109   4.941
  352   HD22  LEU  41          HD22      LEU  41 116.531   2.277   5.615
  353   HD23  LEU  41          HD23      LEU  41 117.140   0.944   4.687
  354    H    GLN  42           HN       GLN  42 117.381   0.429  -0.222
  355    HA   GLN  42           HA       GLN  42 115.068  -0.542  -1.729
  356    HB2  GLN  42           HB2      GLN  42 116.929   0.890  -2.765
  357    HB3  GLN  42           HB1      GLN  42 117.939  -0.548  -2.661
  358    HG2  GLN  42           HG2      GLN  42 115.292  -0.371  -4.067
  359    HG3  GLN  42           HG1      GLN  42 116.780   0.038  -4.913
  360   HE21  GLN  42          HE21      GLN  42 118.161  -1.648  -5.481
  361   HE22  GLN  42          HE22      GLN  42 117.617  -3.291  -5.474
  362    H    ILE  43           HN       ILE  43 115.649  -2.881  -2.369
  363    HA   ILE  43           HA       ILE  43 116.936  -4.134   0.004
  364    HB   ILE  43           HB       ILE  43 114.937  -5.473  -1.828
  365   HG12  ILE  43          HG12      ILE  43 113.810  -3.683  -0.717
  366   HG13  ILE  43          HG11      ILE  43 113.343  -5.188   0.062
  367   HG21  ILE  43          HG21      ILE  43 114.751  -7.168  -0.035
  368   HG22  ILE  43          HG22      ILE  43 116.019  -6.363   0.878
  369   HG23  ILE  43          HG23      ILE  43 116.376  -7.073  -0.690
  370   HD11  ILE  43          HD11      ILE  43 114.958  -4.704   1.851
  371   HD12  ILE  43          HD12      ILE  43 113.688  -3.496   1.704
  372   HD13  ILE  43          HD13      ILE  43 115.303  -3.155   1.077
  373    H    LYS  44           HN       LYS  44 118.758  -5.242  -0.266
  374    HA   LYS  44           HA       LYS  44 119.504  -5.931  -3.014
  375    HB2  LYS  44           HB2      LYS  44 121.822  -6.014  -2.312
  376    HB3  LYS  44           HB1      LYS  44 121.097  -4.475  -1.892
  377    HG2  LYS  44           HG2      LYS  44 121.110  -4.946   0.388
  378    HG3  LYS  44           HG1      LYS  44 121.230  -6.685   0.114
  379    HD2  LYS  44           HD2      LYS  44 123.511  -6.430  -0.676
  380    HD3  LYS  44           HD1      LYS  44 123.407  -4.677  -0.483
  381    HE2  LYS  44           HE2      LYS  44 123.006  -6.630   1.762
  382    HE3  LYS  44           HE1      LYS  44 124.566  -5.903   1.372
  383    HZ1  LYS  44           HZ1      LYS  44 123.812  -3.822   1.889
  384    HZ2  LYS  44           HZ2      LYS  44 123.303  -4.759   3.161
  385    HZ3  LYS  44           HZ3      LYS  44 122.179  -4.212   2.008
  386    H    SER  45           HN       SER  45 118.871  -7.389   0.079
  387    HA   SER  45           HA       SER  45 119.009  -9.884  -1.360
  388    HB2  SER  45           HB2      SER  45 120.572  -9.477   1.191
  389    HB3  SER  45           HB1      SER  45 120.362 -11.010   0.351
  390    HG   SER  45           HG       SER  45 121.219  -9.262  -1.411
  391    H    LEU  46           HN       LEU  46 117.252 -10.923  -0.943
  392    HA   LEU  46           HA       LEU  46 115.720 -10.564   1.345
  393    HB2  LEU  46           HB2      LEU  46 114.633 -11.175  -0.641
  394    HB3  LEU  46           HB1      LEU  46 115.813 -12.422  -0.972
  395    HG   LEU  46           HG       LEU  46 114.870 -13.838   0.747
  396   HD11  LEU  46          HD11      LEU  46 112.946 -11.589   1.236
  397   HD12  LEU  46          HD12      LEU  46 114.312 -12.057   2.259
  398   HD13  LEU  46          HD13      LEU  46 112.968 -13.188   2.021
  399   HD21  LEU  46          HD21      LEU  46 113.874 -13.918  -1.460
  400   HD22  LEU  46          HD22      LEU  46 112.761 -12.627  -1.001
  401   HD23  LEU  46          HD23      LEU  46 112.658 -14.203  -0.208
  402    H    VAL  47           HN       VAL  47 116.498 -11.414   3.286
  403    HA   VAL  47           HA       VAL  47 118.442 -13.503   3.157
  404    HB   VAL  47           HB       VAL  47 117.333 -11.925   5.498
  405   HG11  VAL  47          HG11      VAL  47 118.058 -14.121   6.180
  406   HG12  VAL  47          HG12      VAL  47 119.165 -12.878   6.792
  407   HG13  VAL  47          HG13      VAL  47 119.619 -13.870   5.393
  408   HG21  VAL  47          HG21      VAL  47 119.497 -10.816   5.514
  409   HG22  VAL  47          HG22      VAL  47 118.680 -10.570   3.974
  410   HG23  VAL  47          HG23      VAL  47 119.998 -11.736   4.099
  411    H    LEU  48           HN       LEU  48 117.892 -15.483   3.309
  412    HA   LEU  48           HA       LEU  48 115.176 -16.278   3.663
  413    HB2  LEU  48           HB2      LEU  48 117.671 -17.946   3.574
  414    HB3  LEU  48           HB1      LEU  48 116.017 -18.517   3.392
  415    HG   LEU  48           HG       LEU  48 117.451 -16.656   1.518
  416   HD11  LEU  48          HD11      LEU  48 117.327 -18.497  -0.083
  417   HD12  LEU  48          HD12      LEU  48 116.620 -19.521   1.167
  418   HD13  LEU  48          HD13      LEU  48 118.272 -18.923   1.344
  419   HD21  LEU  48          HD21      LEU  48 114.652 -17.797   1.354
  420   HD22  LEU  48          HD22      LEU  48 115.469 -16.934   0.055
  421   HD23  LEU  48          HD23      LEU  48 115.081 -16.094   1.545
  422    H    ASP  49           HN       ASP  49 114.181 -17.397   5.152
  423    HA   ASP  49           HA       ASP  49 113.519 -17.905   7.192
  424    HB2  ASP  49           HB2      ASP  49 115.662 -18.955   7.613
  425    HB3  ASP  49           HB1      ASP  49 116.396 -17.434   8.028
  426    H    GLY  50           HN       GLY  50 114.262 -15.147   5.992
  427    HA2  GLY  50           HA2      GLY  50 113.660 -13.265   8.158
  428    HA3  GLY  50           HA1      GLY  50 113.851 -13.054   6.393
  429    HA   PRO  51           HA       PRO  51 109.382 -13.599   7.580
  430    HB2  PRO  51           HB2      PRO  51 108.373 -11.020   7.981
  431    HB3  PRO  51           HB1      PRO  51 109.041 -12.038   9.218
  432    HG2  PRO  51           HG2      PRO  51 110.174  -9.665   8.032
  433    HG3  PRO  51           HG1      PRO  51 110.600 -10.473   9.541
  434    HD2  PRO  51           HD2      PRO  51 111.805 -10.605   6.909
  435    HD3  PRO  51           HD1      PRO  51 112.495 -11.183   8.408
  436    H    ALA  52           HN       ALA  52 110.921 -11.399   5.465
  437    HA   ALA  52           HA       ALA  52 108.897 -11.185   3.472
  438    HB1  ALA  52           HB1      ALA  52 110.777  -9.631   3.535
  439    HB2  ALA  52           HB2      ALA  52 110.803 -10.522   2.019
  440    HB3  ALA  52           HB3      ALA  52 111.904 -10.958   3.317
  441    H    ALA  53           HN       ALA  53 111.499 -13.422   4.126
  442    HA   ALA  53           HA       ALA  53 111.381 -14.941   1.720
  443    HB1  ALA  53           HB1      ALA  53 112.346 -15.718   4.468
  444    HB2  ALA  53           HB2      ALA  53 113.325 -14.867   3.267
  445    HB3  ALA  53           HB3      ALA  53 112.769 -16.518   2.948
  446    H    LEU  54           HN       LEU  54 110.167 -15.197   4.877
  447    HA   LEU  54           HA       LEU  54 109.108 -17.741   4.708
  448    HB2  LEU  54           HB2      LEU  54 108.855 -15.560   6.587
  449    HB3  LEU  54           HB1      LEU  54 108.353 -17.220   6.892
  450    HG   LEU  54           HG       LEU  54 111.179 -16.294   6.241
  451   HD11  LEU  54          HD11      LEU  54 110.302 -15.816   8.166
  452   HD12  LEU  54          HD12      LEU  54 111.624 -17.087   8.168
  453   HD13  LEU  54          HD13      LEU  54 109.829 -17.546   8.357
  454   HD21  LEU  54          HD21      LEU  54 111.776 -18.664   6.606
  455   HD22  LEU  54          HD22      LEU  54 110.838 -18.454   5.150
  456   HD23  LEU  54          HD23      LEU  54 110.067 -19.096   6.606
  457    H    ASP  55           HN       ASP  55 107.633 -14.518   4.838
  458    HA   ASP  55           HA       ASP  55 104.964 -15.514   4.515
  459    HB2  ASP  55           HB2      ASP  55 105.639 -13.272   5.562
  460    HB3  ASP  55           HB1      ASP  55 106.012 -12.750   3.944
  461    H    GLY  56           HN       GLY  56 107.616 -14.683   2.593
  462    HA2  GLY  56           HA2      GLY  56 107.948 -14.895   0.304
  463    HA3  GLY  56           HA1      GLY  56 106.259 -15.399   0.157
  464    H    LYS  57           HN       LYS  57 106.513 -13.875  -1.783
  465    HA   LYS  57           HA       LYS  57 105.563 -12.133  -2.783
  466    HB2  LYS  57           HB2      LYS  57 103.705 -12.317  -1.332
  467    HB3  LYS  57           HB1      LYS  57 104.568 -11.549  -0.016
  468    HG2  LYS  57           HG2      LYS  57 104.375  -9.423  -1.094
  469    HG3  LYS  57           HG1      LYS  57 103.701 -10.172  -2.542
  470    HD2  LYS  57           HD2      LYS  57 101.955  -9.121  -1.107
  471    HD3  LYS  57           HD1      LYS  57 101.703 -10.845  -1.330
  472    HE2  LYS  57           HE2      LYS  57 103.110  -9.750   1.111
  473    HE3  LYS  57           HE1      LYS  57 101.359  -9.849   1.032
  474    HZ1  LYS  57           HZ1      LYS  57 102.634 -11.788   2.119
  475    HZ2  LYS  57           HZ2      LYS  57 103.027 -12.277   0.567
  476    HZ3  LYS  57           HZ3      LYS  57 101.421 -12.157   1.025
  477    H    MET  58           HN       MET  58 107.238 -10.973   0.120
  478    HA   MET  58           HA       MET  58 108.127  -8.613  -1.369
  479    HB2  MET  58           HB2      MET  58 107.455  -8.357   1.026
  480    HB3  MET  58           HB1      MET  58 108.722  -9.440   1.507
  481    HG2  MET  58           HG2      MET  58 109.306  -6.934   0.055
  482    HG3  MET  58           HG1      MET  58 109.061  -6.947   1.805
  483    HE1  MET  58           HE1      MET  58 111.274  -6.001   2.417
  484    HE2  MET  58           HE2      MET  58 111.486  -5.683   0.702
  485    HE3  MET  58           HE3      MET  58 112.809  -6.406   1.643
  486    H    GLU  59           HN       GLU  59 110.230  -8.309  -2.140
  487    HA   GLU  59           HA       GLU  59 112.054 -10.565  -1.871
  488    HB2  GLU  59           HB2      GLU  59 110.930  -9.706  -4.544
  489    HB3  GLU  59           HB1      GLU  59 112.196 -10.896  -4.307
  490    HG2  GLU  59           HG2      GLU  59 110.562 -12.324  -3.105
  491    HG3  GLU  59           HG1      GLU  59 109.327 -11.110  -3.434
  492    H    THR  60           HN       THR  60 114.103 -10.145  -3.033
  493    HA   THR  60           HA       THR  60 115.287  -7.661  -2.665
  494    HB   THR  60           HB       THR  60 116.007  -9.729  -4.745
  495    HG1  THR  60           HG1      THR  60 116.026 -11.063  -3.143
  496   HG21  THR  60          HG21      THR  60 118.228  -9.069  -4.190
  497   HG22  THR  60          HG22      THR  60 117.585  -8.091  -2.874
  498   HG23  THR  60          HG23      THR  60 117.268  -7.612  -4.558
  499    H    GLY  61           HN       GLY  61 115.212  -5.818  -3.922
  500    HA2  GLY  61           HA2      GLY  61 115.159  -4.869  -6.136
  501    HA3  GLY  61           HA1      GLY  61 113.983  -6.100  -6.579
  502    H    ASP  62           HN       ASP  62 113.006  -5.486  -3.618
  503    HA   ASP  62           HA       ASP  62 111.006  -3.566  -4.362
  504    HB2  ASP  62           HB2      ASP  62 111.608  -5.039  -1.806
  505    HB3  ASP  62           HB1      ASP  62 110.542  -3.646  -1.808
  506    H    VAL  63           HN       VAL  63 111.145  -1.461  -4.114
  507    HA   VAL  63           HA       VAL  63 113.292  -0.526  -2.427
  508    HB   VAL  63           HB       VAL  63 113.522   0.518  -4.579
  509   HG11  VAL  63          HG11      VAL  63 111.790   1.888  -5.619
  510   HG12  VAL  63          HG12      VAL  63 110.641   1.296  -4.396
  511   HG13  VAL  63          HG13      VAL  63 111.426   0.172  -5.521
  512   HG21  VAL  63          HG21      VAL  63 113.314   2.916  -4.114
  513   HG22  VAL  63          HG22      VAL  63 113.968   2.039  -2.728
  514   HG23  VAL  63          HG23      VAL  63 112.282   2.552  -2.731
  515    H    ILE  64           HN       ILE  64 112.990   0.092  -0.559
  516    HA   ILE  64           HA       ILE  64 110.460   0.045   0.612
  517    HB   ILE  64           HB       ILE  64 113.150   0.731   1.769
  518   HG12  ILE  64          HG12      ILE  64 112.914  -1.584   1.034
  519   HG13  ILE  64          HG11      ILE  64 113.076  -1.487   2.783
  520   HG21  ILE  64          HG21      ILE  64 111.456   1.819   3.133
  521   HG22  ILE  64          HG22      ILE  64 112.158   0.461   4.015
  522   HG23  ILE  64          HG23      ILE  64 110.567   0.303   3.272
  523   HD11  ILE  64          HD11      ILE  64 110.528  -1.956   1.241
  524   HD12  ILE  64          HD12      ILE  64 110.643  -1.801   2.993
  525   HD13  ILE  64          HD13      ILE  64 111.430  -3.149   2.175
  526    H    VAL  65           HN       VAL  65 109.124   1.641   0.643
  527    HA   VAL  65           HA       VAL  65 109.910   4.432   0.216
  528    HB   VAL  65           HB       VAL  65 107.198   3.113  -0.031
  529   HG11  VAL  65          HG11      VAL  65 107.054   5.507   0.270
  530   HG12  VAL  65          HG12      VAL  65 106.597   5.039  -1.377
  531   HG13  VAL  65          HG13      VAL  65 108.177   5.747  -1.077
  532   HG21  VAL  65          HG21      VAL  65 109.186   3.682  -2.211
  533   HG22  VAL  65          HG22      VAL  65 107.533   3.116  -2.454
  534   HG23  VAL  65          HG23      VAL  65 108.707   2.093  -1.627
  535    H    SER  66           HN       SER  66 107.579   2.468   2.119
  536    HA   SER  66           HA       SER  66 107.805   4.392   4.283
  537    HB2  SER  66           HB2      SER  66 106.039   5.357   2.940
  538    HB3  SER  66           HB1      SER  66 105.174   3.839   2.848
  539    HG   SER  66           HG       SER  66 104.252   4.327   4.590
  540    H    VAL  67           HN       VAL  67 106.688   3.553   6.326
  541    HA   VAL  67           HA       VAL  67 106.146   0.740   6.244
  542    HB   VAL  67           HB       VAL  67 108.527   0.591   6.487
  543   HG11  VAL  67          HG11      VAL  67 108.317   2.443   8.845
  544   HG12  VAL  67          HG12      VAL  67 108.987   2.846   7.265
  545   HG13  VAL  67          HG13      VAL  67 109.786   1.639   8.284
  546   HG21  VAL  67          HG21      VAL  67 108.761  -0.568   8.612
  547   HG22  VAL  67          HG22      VAL  67 107.199  -0.947   7.869
  548   HG23  VAL  67          HG23      VAL  67 107.289   0.197   9.200
  549    H    ASN  68           HN       ASN  68 104.283   0.716   7.065
  550    HA   ASN  68           HA       ASN  68 102.594   0.547   8.615
  551    HB2  ASN  68           HB2      ASN  68 104.333  -0.489   9.864
  552    HB3  ASN  68           HB1      ASN  68 104.882   1.057  10.483
  553   HD21  ASN  68          HD21      ASN  68 102.557  -1.499  10.716
  554   HD22  ASN  68          HD22      ASN  68 101.964  -1.024  12.245
  555    H    ASP  69           HN       ASP  69 104.549   3.008   9.831
  556    HA   ASP  69           HA       ASP  69 102.418   5.026   9.767
  557    HB2  ASP  69           HB2      ASP  69 102.054   4.103  11.959
  558    HB3  ASP  69           HB1      ASP  69 103.778   4.115  12.310
  559    H    THR  70           HN       THR  70 105.715   4.131  10.572
  560    HA   THR  70           HA       THR  70 106.794   6.722  10.594
  561    HB   THR  70           HB       THR  70 108.161   4.077  10.110
  562    HG1  THR  70           HG1      THR  70 107.205   5.322  12.464
  563   HG21  THR  70          HG21      THR  70 109.532   6.101   9.800
  564   HG22  THR  70          HG22      THR  70 110.052   5.191  11.217
  565   HG23  THR  70          HG23      THR  70 109.084   6.654  11.413
  566    H    CYS  71           HN       CYS  71 107.364   7.924   9.014
  567    HA   CYS  71           HA       CYS  71 107.069   6.936   6.337
  568    HB2  CYS  71           HB2      CYS  71 106.156   9.128   7.152
  569    HB3  CYS  71           HB1      CYS  71 107.810   9.693   7.324
  570    HG   CYS  71           HG       CYS  71 106.004   9.191   4.542
  571    H    VAL  72           HN       VAL  72 108.813   5.530   6.318
  572    HA   VAL  72           HA       VAL  72 111.474   6.405   6.953
  573    HB   VAL  72           HB       VAL  72 110.657   4.044   7.184
  574   HG11  VAL  72          HG11      VAL  72 109.406   3.753   5.200
  575   HG12  VAL  72          HG12      VAL  72 110.710   2.566   5.217
  576   HG13  VAL  72          HG13      VAL  72 110.830   4.000   4.194
  577   HG21  VAL  72          HG21      VAL  72 113.016   4.461   7.266
  578   HG22  VAL  72          HG22      VAL  72 113.117   4.412   5.506
  579   HG23  VAL  72          HG23      VAL  72 112.718   2.950   6.406
  580    H    LEU  73           HN       LEU  73 109.518   7.182   4.590
  581    HA   LEU  73           HA       LEU  73 110.913   7.103   2.192
  582    HB2  LEU  73           HB2      LEU  73 108.503   7.630   2.722
  583    HB3  LEU  73           HB1      LEU  73 109.056   9.197   3.256
  584    HG   LEU  73           HG       LEU  73 109.734   9.774   1.027
  585   HD11  LEU  73          HD11      LEU  73 110.461   7.599   0.242
  586   HD12  LEU  73          HD12      LEU  73 109.182   8.200  -0.822
  587   HD13  LEU  73          HD13      LEU  73 108.824   6.979   0.408
  588   HD21  LEU  73          HD21      LEU  73 107.463  10.225   1.688
  589   HD22  LEU  73          HD22      LEU  73 106.997   8.573   1.297
  590   HD23  LEU  73          HD23      LEU  73 107.466   9.669   0.007
  591    H    GLY  74           HN       GLY  74 112.890   7.872   2.045
  592    HA2  GLY  74           HA2      GLY  74 114.616   9.381   1.964
  593    HA3  GLY  74           HA1      GLY  74 113.431  10.598   2.442
  594    H    HIS  75           HN       HIS  75 113.919   7.764   4.419
  595    HA   HIS  75           HA       HIS  75 114.496   9.383   6.654
  596    HB2  HIS  75           HB2      HIS  75 113.625   6.704   6.207
  597    HB3  HIS  75           HB1      HIS  75 115.182   6.627   6.993
  598    HD1  HIS  75           HD1      HIS  75 112.110   8.842   7.678
  599    HD2  HIS  75           HD2      HIS  75 114.784   6.269   9.494
  600    HE1  HIS  75           HE1      HIS  75 111.459   8.805  10.100
  601    H    THR  76           HN       THR  76 116.470   9.716   7.552
  602    HA   THR  76           HA       THR  76 118.797   9.318   5.918
  603    HB   THR  76           HB       THR  76 118.590  10.045   8.840
  604    HG1  THR  76           HG1      THR  76 117.727  11.422   6.783
  605   HG21  THR  76          HG21      THR  76 120.768  11.120   8.550
  606   HG22  THR  76          HG22      THR  76 120.840  10.547   6.878
  607   HG23  THR  76          HG23      THR  76 120.851   9.392   8.218
  608    H    HIS  77           HN       HIS  77 120.372   7.615   6.177
  609    HA   HIS  77           HA       HIS  77 119.565   5.212   6.940
  610    HB2  HIS  77           HB2      HIS  77 121.672   5.773   5.697
  611    HB3  HIS  77           HB1      HIS  77 122.441   5.975   7.277
  612    HD1  HIS  77           HD1      HIS  77 122.728   3.813   8.731
  613    HD2  HIS  77           HD2      HIS  77 121.171   3.209   4.946
  614    HE1  HIS  77           HE1      HIS  77 122.761   1.343   8.351
  615    H    ALA  78           HN       ALA  78 121.227   7.402   9.035
  616    HA   ALA  78           HA       ALA  78 121.637   5.639  11.197
  617    HB1  ALA  78           HB1      ALA  78 121.301   8.630  11.273
  618    HB2  ALA  78           HB2      ALA  78 122.816   7.768  10.996
  619    HB3  ALA  78           HB3      ALA  78 121.995   7.635  12.554
  620    H    GLN  79           HN       GLN  79 118.958   7.683  10.275
  621    HA   GLN  79           HA       GLN  79 117.494   7.446  12.656
  622    HB2  GLN  79           HB2      GLN  79 116.542   8.019   9.846
  623    HB3  GLN  79           HB1      GLN  79 115.635   8.349  11.304
  624    HG2  GLN  79           HG2      GLN  79 118.286   9.595  10.690
  625    HG3  GLN  79           HG1      GLN  79 116.757  10.331  10.209
  626   HE21  GLN  79          HE21      GLN  79 118.790  11.403  11.834
  627   HE22  GLN  79          HE22      GLN  79 118.143  11.663  13.398
  628    H    VAL  80           HN       VAL  80 117.173   5.968   9.415
  629    HA   VAL  80           HA       VAL  80 115.070   4.241  10.091
  630    HB   VAL  80           HB       VAL  80 115.344   4.744   7.719
  631   HG11  VAL  80          HG11      VAL  80 117.974   3.302   7.819
  632   HG12  VAL  80          HG12      VAL  80 117.759   5.042   7.752
  633   HG13  VAL  80          HG13      VAL  80 117.214   4.046   6.402
  634   HG21  VAL  80          HG21      VAL  80 116.003   1.813   8.135
  635   HG22  VAL  80          HG22      VAL  80 115.062   2.528   6.816
  636   HG23  VAL  80          HG23      VAL  80 114.435   2.519   8.445
  637    H    VAL  81           HN       VAL  81 118.532   3.581   9.925
  638    HA   VAL  81           HA       VAL  81 118.234   0.849  10.532
  639    HB   VAL  81           HB       VAL  81 120.353   1.810   9.565
  640   HG11  VAL  81          HG11      VAL  81 120.942   2.625  12.405
  641   HG12  VAL  81          HG12      VAL  81 120.699   3.702  11.033
  642   HG13  VAL  81          HG13      VAL  81 122.106   2.636  11.076
  643   HG21  VAL  81          HG21      VAL  81 120.677   0.051  11.987
  644   HG22  VAL  81          HG22      VAL  81 121.879   0.255  10.713
  645   HG23  VAL  81          HG23      VAL  81 120.317  -0.475  10.344
  646    H    LYS  82           HN       LYS  82 118.493   3.632  12.587
  647    HA   LYS  82           HA       LYS  82 118.847   2.267  14.980
  648    HB2  LYS  82           HB2      LYS  82 119.254   4.583  14.847
  649    HB3  LYS  82           HB1      LYS  82 117.643   4.911  14.272
  650    HG2  LYS  82           HG2      LYS  82 118.057   3.800  17.044
  651    HG3  LYS  82           HG1      LYS  82 118.328   5.512  16.745
  652    HD2  LYS  82           HD2      LYS  82 115.751   4.009  16.241
  653    HD3  LYS  82           HD1      LYS  82 116.068   5.086  17.603
  654    HE2  LYS  82           HE2      LYS  82 116.433   6.937  15.982
  655    HE3  LYS  82           HE1      LYS  82 115.987   5.850  14.675
  656    HZ1  LYS  82           HZ1      LYS  82 114.129   7.152  15.265
  657    HZ2  LYS  82           HZ2      LYS  82 114.277   6.766  16.894
  658    HZ3  LYS  82           HZ3      LYS  82 113.803   5.578  15.796
  659    H    ILE  83           HN       ILE  83 115.891   2.951  13.140
  660    HA   ILE  83           HA       ILE  83 114.141   2.207  15.322
  661    HB   ILE  83           HB       ILE  83 113.520   2.301  12.355
  662   HG12  ILE  83          HG12      ILE  83 113.121   4.436  14.462
  663   HG13  ILE  83          HG11      ILE  83 114.332   4.471  13.185
  664   HG21  ILE  83          HG21      ILE  83 111.885   1.006  13.625
  665   HG22  ILE  83          HG22      ILE  83 111.173   2.520  13.072
  666   HG23  ILE  83          HG23      ILE  83 111.676   2.347  14.752
  667   HD11  ILE  83          HD11      ILE  83 111.365   4.464  12.808
  668   HD12  ILE  83          HD12      ILE  83 112.572   4.545  11.518
  669   HD13  ILE  83          HD13      ILE  83 112.411   5.876  12.673
  670    H    PHE  84           HN       PHE  84 115.206   0.831  12.333
  671    HA   PHE  84           HA       PHE  84 113.846  -1.580  12.491
  672    HB2  PHE  84           HB2      PHE  84 116.017  -0.445  10.831
  673    HB3  PHE  84           HB1      PHE  84 115.664  -2.145  10.689
  674    HD1  PHE  84           HD1      PHE  84 113.931   1.170  10.690
  675    HD2  PHE  84           HD2      PHE  84 114.041  -2.777   9.130
  676    HE1  PHE  84           HE1      PHE  84 112.093   1.732   9.152
  677    HE2  PHE  84           HE2      PHE  84 112.211  -2.226   7.588
  678    HZ   PHE  84           HZ       PHE  84 111.234   0.029   7.594
  679    H    GLN  85           HN       GLN  85 116.981  -0.646  13.694
  680    HA   GLN  85           HA       GLN  85 117.714  -3.364  14.290
  681    HB2  GLN  85           HB2      GLN  85 119.065  -0.930  13.940
  682    HB3  GLN  85           HB1      GLN  85 119.336  -1.393  15.610
  683    HG2  GLN  85           HG2      GLN  85 121.030  -2.120  13.916
  684    HG3  GLN  85           HG1      GLN  85 120.417  -3.407  14.979
  685   HE21  GLN  85          HE21      GLN  85 120.652  -2.128  11.800
  686   HE22  GLN  85          HE22      GLN  85 119.973  -3.496  10.974
  687    H    SER  86           HN       SER  86 116.056  -0.762  15.954
  688    HA   SER  86           HA       SER  86 116.500  -2.119  18.493
  689    HB2  SER  86           HB2      SER  86 115.319  -0.146  19.525
  690    HB3  SER  86           HB1      SER  86 116.799   0.262  18.663
  691    HG   SER  86           HG       SER  86 115.653   1.078  17.028
  692    H    ILE  87           HN       ILE  87 114.477  -2.431  16.048
  693    HA   ILE  87           HA       ILE  87 111.988  -2.790  16.833
  694    HB   ILE  87           HB       ILE  87 113.770  -4.309  15.023
  695   HG12  ILE  87          HG12      ILE  87 111.419  -2.503  14.716
  696   HG13  ILE  87          HG11      ILE  87 113.093  -2.229  14.240
  697   HG21  ILE  87          HG21      ILE  87 112.240  -6.080  15.810
  698   HG22  ILE  87          HG22      ILE  87 111.968  -5.608  14.118
  699   HG23  ILE  87          HG23      ILE  87 110.876  -5.063  15.317
  700   HD11  ILE  87          HD11      ILE  87 112.832  -4.042  12.542
  701   HD12  ILE  87          HD12      ILE  87 111.720  -2.689  12.325
  702   HD13  ILE  87          HD13      ILE  87 111.158  -4.176  13.073
  703    HA   PRO  88           HA       PRO  88 112.027  -6.333  19.723
  704    HB2  PRO  88           HB2      PRO  88 109.352  -6.304  20.194
  705    HB3  PRO  88           HB1      PRO  88 110.457  -5.127  20.905
  706    HG2  PRO  88           HG2      PRO  88 108.397  -4.710  18.891
  707    HG3  PRO  88           HG1      PRO  88 109.352  -3.499  19.761
  708    HD2  PRO  88           HD2      PRO  88 109.769  -4.647  17.072
  709    HD3  PRO  88           HD1      PRO  88 110.422  -3.161  17.695
  710    H    ILE  89           HN       ILE  89 111.630  -8.452  19.549
  711    HA   ILE  89           HA       ILE  89 111.020  -9.530  17.002
  712    HB   ILE  89           HB       ILE  89 111.175 -11.001  19.664
  713   HG12  ILE  89          HG12      ILE  89 113.423 -10.482  17.749
  714   HG13  ILE  89          HG11      ILE  89 113.167  -9.537  19.219
  715   HG21  ILE  89          HG21      ILE  89 110.293 -12.350  17.849
  716   HG22  ILE  89          HG22      ILE  89 111.909 -12.909  18.301
  717   HG23  ILE  89          HG23      ILE  89 111.684 -11.931  16.845
  718   HD11  ILE  89          HD11      ILE  89 114.880 -11.165  19.532
  719   HD12  ILE  89          HD12      ILE  89 113.815 -12.455  18.963
  720   HD13  ILE  89          HD13      ILE  89 113.464 -11.617  20.483
  721    H    GLY  90           HN       GLY  90 109.151 -10.613  16.338
  722    HA2  GLY  90           HA2      GLY  90 107.095 -11.649  16.534
  723    HA3  GLY  90           HA1      GLY  90 107.042 -11.182  18.228
  724    H    ALA  91           HN       ALA  91 107.874  -8.742  16.063
  725    HA   ALA  91           HA       ALA  91 105.296  -7.466  16.793
  726    HB1  ALA  91           HB1      ALA  91 107.904  -6.097  16.090
  727    HB2  ALA  91           HB2      ALA  91 107.240  -6.289  17.699
  728    HB3  ALA  91           HB3      ALA  91 106.424  -5.262  16.525
  729    H    SER  92           HN       SER  92 105.278  -5.285  14.900
  730    HA   SER  92           HA       SER  92 104.854  -6.698  12.326
  731    HB2  SER  92           HB2      SER  92 102.394  -6.088  12.407
  732    HB3  SER  92           HB1      SER  92 102.904  -7.450  13.417
  733    HG   SER  92           HG       SER  92 103.152  -5.619  15.038
  734    H    VAL  93           HN       VAL  93 104.909  -5.482  10.565
  735    HA   VAL  93           HA       VAL  93 103.994  -2.752  10.585
  736    HB   VAL  93           HB       VAL  93 106.042  -2.052   9.265
  737   HG11  VAL  93          HG11      VAL  93 106.176  -2.268  12.269
  738   HG12  VAL  93          HG12      VAL  93 105.530  -0.967  11.291
  739   HG13  VAL  93          HG13      VAL  93 107.257  -1.286  11.272
  740   HG21  VAL  93          HG21      VAL  93 107.265  -4.272  10.836
  741   HG22  VAL  93          HG22      VAL  93 108.132  -3.041   9.891
  742   HG23  VAL  93          HG23      VAL  93 107.071  -4.194   9.083
  743    H    ASP  94           HN       ASP  94 103.797  -1.814   8.640
  744    HA   ASP  94           HA       ASP  94 103.123  -3.691   6.531
  745    HB2  ASP  94           HB2      ASP  94 102.276  -0.849   7.101
  746    HB3  ASP  94           HB1      ASP  94 101.669  -1.867   5.814
  747    H    LEU  95           HN       LEU  95 104.766  -3.712   5.138
  748    HA   LEU  95           HA       LEU  95 106.428  -1.341   4.784
  749    HB2  LEU  95           HB2      LEU  95 106.680  -4.102   3.570
  750    HB3  LEU  95           HB1      LEU  95 107.761  -2.780   3.223
  751    HG   LEU  95           HG       LEU  95 108.877  -4.239   4.699
  752   HD11  LEU  95          HD11      LEU  95 107.887  -1.899   6.247
  753   HD12  LEU  95          HD12      LEU  95 109.316  -1.958   5.203
  754   HD13  LEU  95          HD13      LEU  95 109.251  -2.906   6.700
  755   HD21  LEU  95          HD21      LEU  95 106.510  -4.089   6.549
  756   HD22  LEU  95          HD22      LEU  95 108.046  -4.900   6.877
  757   HD23  LEU  95          HD23      LEU  95 107.002  -5.475   5.571
  758    H    GLU  96           HN       GLU  96 105.764   0.108   3.451
  759    HA   GLU  96           HA       GLU  96 104.212  -0.561   1.081
  760    HB2  GLU  96           HB2      GLU  96 105.162   2.067   2.212
  761    HB3  GLU  96           HB1      GLU  96 104.071   1.907   0.848
  762    HG2  GLU  96           HG2      GLU  96 102.376   0.918   2.327
  763    HG3  GLU  96           HG1      GLU  96 103.478   1.081   3.692
  764    H    LEU  97           HN       LEU  97 105.471  -1.190  -0.563
  765    HA   LEU  97           HA       LEU  97 107.954   0.199  -0.997
  766    HB2  LEU  97           HB2      LEU  97 109.311  -1.780  -1.056
  767    HB3  LEU  97           HB1      LEU  97 108.512  -1.672   0.484
  768    HG   LEU  97           HG       LEU  97 108.199  -3.723  -1.693
  769   HD11  LEU  97          HD11      LEU  97 108.641  -3.839   1.268
  770   HD12  LEU  97          HD12      LEU  97 109.814  -4.159  -0.004
  771   HD13  LEU  97          HD13      LEU  97 108.441  -5.245   0.233
  772   HD21  LEU  97          HD21      LEU  97 105.888  -3.050  -1.102
  773   HD22  LEU  97          HD22      LEU  97 106.248  -3.403   0.592
  774   HD23  LEU  97          HD23      LEU  97 106.279  -4.699  -0.610
  775    H    CYS  98           HN       CYS  98 108.831  -0.155  -3.102
  776    HA   CYS  98           HA       CYS  98 106.663  -0.854  -4.940
  777    HB2  CYS  98           HB2      CYS  98 107.314   1.592  -4.794
  778    HB3  CYS  98           HB1      CYS  98 108.872   1.138  -5.470
  779    HG   CYS  98           HG       CYS  98 107.994   0.579  -7.990
  780    H    ARG  99           HN       ARG  99 107.052  -2.364  -6.309
  781    HA   ARG  99           HA       ARG  99 109.694  -3.609  -6.365
  782    HB2  ARG  99           HB2      ARG  99 107.753  -4.979  -5.822
  783    HB3  ARG  99           HB1      ARG  99 106.993  -4.550  -7.341
  784    HG2  ARG  99           HG2      ARG  99 107.874  -6.647  -7.653
  785    HG3  ARG  99           HG1      ARG  99 109.014  -5.561  -8.446
  786    HD2  ARG  99           HD2      ARG  99 110.270  -7.184  -7.082
  787    HD3  ARG  99           HD1      ARG  99 110.386  -5.548  -6.384
  788    HE   ARG  99           HE       ARG  99 109.126  -6.116  -4.684
  789   HH11  ARG  99          HH11      ARG  99 109.305  -8.824  -6.892
  790   HH12  ARG  99          HH12      ARG  99 108.745  -9.981  -5.777
  791   HH21  ARG  99          HH21      ARG  99 108.410  -7.497  -3.231
  792   HH22  ARG  99          HH22      ARG  99 108.057  -9.155  -3.568
  793    H    GLY 100           HN       GLY 100 110.818  -3.688  -8.295
  794    HA2  GLY 100           HA2      GLY 100 110.209  -3.629 -10.856
  795    HA3  GLY 100           HA1      GLY 100 109.748  -1.986 -10.436
  796    H    TYR 101           HN       TYR 101 111.949  -2.250  -8.360
  797    HA   TYR 101           HA       TYR 101 113.992  -1.101  -9.961
  798    HB2  TYR 101           HB2      TYR 101 113.296  -1.291  -7.135
  799    HB3  TYR 101           HB1      TYR 101 115.023  -1.360  -7.389
  800    HD1  TYR 101           HD2      TYR 101 112.007   0.638  -8.296
  801    HD2  TYR 101           HD1      TYR 101 116.217   0.604  -7.689
  802    HE1  TYR 101           HE2      TYR 101 112.063   3.081  -8.555
  803    HE2  TYR 101           HE1      TYR 101 116.284   3.044  -7.950
  804    HH   TYR 101           HH       TYR 101 113.549   4.974  -7.847
  805    HA   PRO 102           HA       PRO 102 116.223  -4.949 -10.191
  806    HB2  PRO 102           HB2      PRO 102 118.223  -4.109 -11.758
  807    HB3  PRO 102           HB1      PRO 102 116.588  -4.270 -12.407
  808    HG2  PRO 102           HG2      PRO 102 118.081  -1.818 -11.627
  809    HG3  PRO 102           HG1      PRO 102 116.911  -2.053 -12.935
  810    HD2  PRO 102           HD2      PRO 102 116.379  -0.915 -10.424
  811    HD3  PRO 102           HD1      PRO 102 115.176  -1.478 -11.601
  812    H    LEU 103           HN       LEU 103 118.575  -5.517  -9.792
  813    HA   LEU 103           HA       LEU 103 119.684  -3.773  -7.715
  814    HB2  LEU 103           HB2      LEU 103 118.876  -6.313  -7.352
  815    HB3  LEU 103           HB1      LEU 103 120.457  -6.641  -8.023
  816    HG   LEU 103           HG       LEU 103 120.514  -6.756  -5.599
  817   HD11  LEU 103          HD11      LEU 103 122.318  -5.207  -5.101
  818   HD12  LEU 103          HD12      LEU 103 121.968  -4.327  -6.590
  819   HD13  LEU 103          HD13      LEU 103 122.540  -5.993  -6.663
  820   HD21  LEU 103          HD21      LEU 103 118.712  -5.347  -4.977
  821   HD22  LEU 103          HD22      LEU 103 119.476  -3.948  -5.719
  822   HD23  LEU 103          HD23      LEU 103 120.184  -4.658  -4.281
  823    HA   PRO 104           HA       PRO 104 122.561  -3.729 -11.307
  824    HB2  PRO 104           HB2      PRO 104 122.967  -0.969 -11.165
  825    HB3  PRO 104           HB1      PRO 104 121.785  -1.774 -12.193
  826    HG2  PRO 104           HG2      PRO 104 121.273  -0.084  -9.957
  827    HG3  PRO 104           HG1      PRO 104 120.092  -0.968 -10.929
  828    HD2  PRO 104           HD2      PRO 104 121.237  -1.637  -8.281
  829    HD3  PRO 104           HD1      PRO 104 119.700  -2.134  -9.017
  830    H    PHE 105           HN       PHE 105 123.315  -4.524  -8.862
  831    HA   PHE 105           HA       PHE 105 126.045  -3.671  -8.614
  832    HB2  PHE 105           HB2      PHE 105 124.061  -3.453  -6.303
  833    HB3  PHE 105           HB1      PHE 105 125.796  -3.472  -6.090
  834    HD1  PHE 105           HD1      PHE 105 127.139  -1.539  -7.000
  835    HD2  PHE 105           HD2      PHE 105 122.890  -1.479  -6.764
  836    HE1  PHE 105           HE1      PHE 105 127.165   0.917  -7.148
  837    HE2  PHE 105           HE2      PHE 105 122.915   0.974  -6.922
  838    HZ   PHE 105           HZ       PHE 105 125.051   2.174  -7.112
  839    H    ASP 106           HN       ASP 106 126.924  -5.210  -6.823
  840    HA   ASP 106           HA       ASP 106 125.523  -7.748  -7.059
  841    HB2  ASP 106           HB2      ASP 106 127.825  -7.775  -7.754
  842    HB3  ASP 106           HB1      ASP 106 128.277  -7.161  -6.114
  843    HA   PRO 107           HA       PRO 107 124.558  -6.930  -2.866
  844    HB2  PRO 107           HB2      PRO 107 122.696  -8.991  -2.833
  845    HB3  PRO 107           HB1      PRO 107 122.429  -7.402  -3.557
  846    HG2  PRO 107           HG2      PRO 107 122.547  -9.863  -5.007
  847    HG3  PRO 107           HG1      PRO 107 122.628  -8.219  -5.689
  848    HD2  PRO 107           HD2      PRO 107 124.884  -9.975  -4.856
  849    HD3  PRO 107           HD1      PRO 107 124.728  -9.146  -6.334
  850    H    ASP 108           HN       ASP 108 126.420  -9.366  -3.894
  851    HA   ASP 108           HA       ASP 108 126.042 -10.994  -1.661
  852    HB2  ASP 108           HB2      ASP 108 126.171 -12.235  -3.652
  853    HB3  ASP 108           HB1      ASP 108 127.616 -11.390  -4.185
  854    H    ASP 109           HN       ASP 109 128.156  -8.903  -3.270
  855    HA   ASP 109           HA       ASP 109 130.656  -9.042  -2.299
  856    HB2  ASP 109           HB2      ASP 109 129.747  -7.440  -3.993
  857    HB3  ASP 109           HB1      ASP 109 129.131  -6.463  -2.671
  858    HA   PRO 110           HA       PRO 110 131.336  -8.995   2.086
  859    HB2  PRO 110           HB2      PRO 110 132.488  -6.550   0.869
  860    HB3  PRO 110           HB1      PRO 110 133.091  -7.308   2.330
  861    HG2  PRO 110           HG2      PRO 110 134.099  -7.992  -0.027
  862    HG3  PRO 110           HG1      PRO 110 133.629  -9.319   1.061
  863    HD2  PRO 110           HD2      PRO 110 132.399  -8.492  -1.468
  864    HD3  PRO 110           HD1      PRO 110 132.123  -9.980  -0.532
  865    H    ASN 111           HN       ASN 111 131.686  -5.666   2.036
  866    HA   ASN 111           HA       ASN 111 130.808  -3.954   2.758
  867    HB2  ASN 111           HB2      ASN 111 128.117  -5.146   2.137
  868    HB3  ASN 111           HB1      ASN 111 128.426  -3.474   2.612
  869   HD21  ASN 111          HD21      ASN 111 130.445  -5.303   0.546
  870   HD22  ASN 111          HD22      ASN 111 130.250  -4.438  -0.903
  871    H    THR 112           HN       THR 112 131.606  -4.048   4.634
  872    HA   THR 112           HA       THR 112 130.191  -5.238   6.850
  873    HB   THR 112           HB       THR 112 132.665  -5.420   6.660
  874    HG1  THR 112           HG1      THR 112 132.443  -5.634   8.683
  875   HG21  THR 112          HG21      THR 112 132.671  -2.430   7.139
  876   HG22  THR 112          HG22      THR 112 133.180  -3.244   5.662
  877   HG23  THR 112          HG23      THR 112 134.099  -3.463   7.153
  878    H    SER 113           HN       SER 113 130.882  -3.194   8.842
  879    HA   SER 113           HA       SER 113 128.699  -1.519   8.515
  880    HB2  SER 113           HB2      SER 113 130.971  -1.152  10.428
  881    HB3  SER 113           HB1      SER 113 129.311  -0.637  10.589
  882    HG   SER 113           HG       SER 113 129.124  -2.407  11.655
  883    H    LEU 114           HN       LEU 114 128.849  -0.109   6.801
  884    HA   LEU 114           HA       LEU 114 131.185   1.424   6.220
  885    HB2  LEU 114           HB2      LEU 114 128.342   1.977   5.371
  886    HB3  LEU 114           HB1      LEU 114 129.805   2.551   4.596
  887    HG   LEU 114           HG       LEU 114 128.723  -0.251   4.632
  888   HD11  LEU 114          HD11      LEU 114 128.625   0.037   2.217
  889   HD12  LEU 114          HD12      LEU 114 129.209   1.698   2.403
  890   HD13  LEU 114          HD13      LEU 114 127.653   1.225   3.090
  891   HD21  LEU 114          HD21      LEU 114 131.341   0.744   3.531
  892   HD22  LEU 114          HD22      LEU 114 130.673  -0.893   3.319
  893   HD23  LEU 114          HD23      LEU 114 131.090  -0.293   4.935
  894    H    VAL 115           HN       VAL 115 131.789   2.849   7.687
  895    HA   VAL 115           HA       VAL 115 129.709   4.388   9.044
  896    HB   VAL 115           HB       VAL 115 131.109   4.523  11.036
  897   HG11  VAL 115          HG11      VAL 115 129.510   2.713  10.871
  898   HG12  VAL 115          HG12      VAL 115 130.932   2.196  11.784
  899   HG13  VAL 115          HG13      VAL 115 130.717   1.687  10.109
  900   HG21  VAL 115          HG21      VAL 115 133.026   2.691   9.581
  901   HG22  VAL 115          HG22      VAL 115 133.137   3.140  11.283
  902   HG23  VAL 115          HG23      VAL 115 133.331   4.370  10.033
  903    H    THR 116           HN       THR 116 129.776   6.476   8.997
  904    HA   THR 116           HA       THR 116 131.920   7.728   7.567
  905    HB   THR 116           HB       THR 116 129.459   8.445   7.372
  906    HG1  THR 116           HG1      THR 116 130.573   9.990   6.590
  907   HG21  THR 116          HG21      THR 116 130.047   9.664  10.050
  908   HG22  THR 116          HG22      THR 116 128.921   8.339   9.753
  909   HG23  THR 116          HG23      THR 116 128.580   9.956   9.102
  910    H    SER 117           HN       SER 117 133.407   9.119   8.544
  911    HA   SER 117           HA       SER 117 133.962   8.285  11.245
  912    HB2  SER 117           HB2      SER 117 136.198   9.450  10.781
  913    HB3  SER 117           HB1      SER 117 135.827   8.016   9.821
  914    HG   SER 117           HG       SER 117 135.221  10.643   8.970
  915    H    VAL 118           HN       VAL 118 132.657   9.312  12.480
  916    HA   VAL 118           HA       VAL 118 132.860  12.207  12.590
  917    HB   VAL 118           HB       VAL 118 130.572  11.530  12.295
  918   HG11  VAL 118          HG11      VAL 118 130.888   9.717  14.674
  919   HG12  VAL 118          HG12      VAL 118 130.827   9.218  12.995
  920   HG13  VAL 118          HG13      VAL 118 129.399   9.968  13.747
  921   HG21  VAL 118          HG21      VAL 118 129.505  12.430  14.333
  922   HG22  VAL 118          HG22      VAL 118 130.910  13.382  13.849
  923   HG23  VAL 118          HG23      VAL 118 131.036  12.250  15.191
  924    H    ALA 119           HN       ALA 119 134.459  12.701  13.857
  925    HA   ALA 119           HA       ALA 119 134.598  11.395  16.449
  926    HB1  ALA 119           HB1      ALA 119 136.932  11.758  14.595
  927    HB2  ALA 119           HB2      ALA 119 136.145  10.231  14.982
  928    HB3  ALA 119           HB3      ALA 119 137.009  11.121  16.237
  929    H    ILE 120           HN       ILE 120 133.605  13.403  17.035
  930    HA   ILE 120           HA       ILE 120 135.470  15.661  17.191
  931    HB   ILE 120           HB       ILE 120 132.544  15.462  18.026
  932   HG12  ILE 120          HG12      ILE 120 132.728  15.180  15.612
  933   HG13  ILE 120          HG11      ILE 120 132.016  16.744  15.982
  934   HG21  ILE 120          HG21      ILE 120 134.284  17.909  17.689
  935   HG22  ILE 120          HG22      ILE 120 133.719  17.240  19.218
  936   HG23  ILE 120          HG23      ILE 120 132.562  17.922  18.075
  937   HD11  ILE 120          HD11      ILE 120 134.198  17.808  15.553
  938   HD12  ILE 120          HD12      ILE 120 133.586  16.927  14.153
  939   HD13  ILE 120          HD13      ILE 120 134.864  16.226  15.142
  940    H    LEU 121           HN       LEU 121 134.402  12.982  18.763
  941    HA   LEU 121           HA       LEU 121 134.832  14.002  21.474
  942    HB2  LEU 121           HB2      LEU 121 133.685  12.124  22.326
  943    HB3  LEU 121           HB1      LEU 121 132.776  12.706  20.959
  944    HG   LEU 121           HG       LEU 121 132.579  10.427  20.918
  945   HD11  LEU 121          HD11      LEU 121 132.906  11.134  18.713
  946   HD12  LEU 121          HD12      LEU 121 133.685   9.566  18.895
  947   HD13  LEU 121          HD13      LEU 121 134.658  11.036  18.868
  948   HD21  LEU 121          HD21      LEU 121 135.543  10.056  21.288
  949   HD22  LEU 121          HD22      LEU 121 134.394   8.749  20.992
  950   HD23  LEU 121          HD23      LEU 121 134.274   9.714  22.463
  951    H    ASP 122           HN       ASP 122 136.301  12.340  19.096
  952    HA   ASP 122           HA       ASP 122 137.961  10.625  20.753
  953    HB2  ASP 122           HB2      ASP 122 136.862  10.012  18.459
  954    HB3  ASP 122           HB1      ASP 122 138.153  11.001  17.780
  955    H    LYS 123           HN       LYS 123 140.259  10.786  19.058
  956    HA   LYS 123           HA       LYS 123 142.269  11.588  19.470
  957    HB2  LYS 123           HB2      LYS 123 142.870  13.291  17.949
  958    HB3  LYS 123           HB1      LYS 123 141.594  12.369  17.222
  959    HG2  LYS 123           HG2      LYS 123 141.088  15.042  18.537
  960    HG3  LYS 123           HG1      LYS 123 141.527  14.888  16.844
  961    HD2  LYS 123           HD2      LYS 123 139.485  13.620  16.413
  962    HD3  LYS 123           HD1      LYS 123 139.072  13.633  18.122
  963    HE2  LYS 123           HE2      LYS 123 139.303  16.037  16.332
  964    HE3  LYS 123           HE1      LYS 123 137.812  15.294  16.920
  965    HZ1  LYS 123           HZ1      LYS 123 139.878  16.565  18.656
  966    HZ2  LYS 123           HZ2      LYS 123 138.429  15.902  19.186
  967    HZ3  LYS 123           HZ3      LYS 123 138.420  17.253  18.212
  968    H    GLU 124           HN       GLU 124 141.001  11.922  21.750
  969    HA   GLU 124           HA       GLU 124 141.074  14.563  22.805
  970    HB2  GLU 124           HB2      GLU 124 139.542  12.854  23.644
  971    HB3  GLU 124           HB1      GLU 124 140.903  11.879  24.176
  972    HG2  GLU 124           HG2      GLU 124 141.541  13.758  25.695
  973    HG3  GLU 124           HG1      GLU 124 140.031  14.543  25.260
  974    HA   PRO 125           HA       PRO 125 145.410  14.121  24.017
  975    HB2  PRO 125           HB2      PRO 125 145.907  16.856  23.786
  976    HB3  PRO 125           HB1      PRO 125 146.153  15.677  22.497
  977    HG2  PRO 125           HG2      PRO 125 144.233  17.781  22.569
  978    HG3  PRO 125           HG1      PRO 125 144.405  16.528  21.336
  979    HD2  PRO 125           HD2      PRO 125 142.517  16.677  23.622
  980    HD3  PRO 125           HD1      PRO 125 142.361  15.852  22.056
  981    H1   ARG 151           HT1      ARG 151 124.843  -8.179  15.806
  982    H2   ARG 151           HT2      ARG 151 124.888  -6.897  16.909
  983    H3   ARG 151           HT3      ARG 151 126.240  -7.257  15.991
  984    HA   ARG 151           HA       ARG 151 125.143  -6.601  13.978
  985    HB2  ARG 151           HB2      ARG 151 122.868  -7.298  14.725
  986    HB3  ARG 151           HB1      ARG 151 122.826  -5.950  15.840
  987    HG2  ARG 151           HG2      ARG 151 121.467  -5.426  13.968
  988    HG3  ARG 151           HG1      ARG 151 122.911  -4.427  13.877
  989    HD2  ARG 151           HD2      ARG 151 122.210  -5.355  11.691
  990    HD3  ARG 151           HD1      ARG 151 123.837  -5.836  12.157
  991    HE   ARG 151           HE       ARG 151 123.125  -7.999  12.449
  992   HH11  ARG 151          HH11      ARG 151 120.213  -6.052  11.707
  993   HH12  ARG 151          HH12      ARG 151 119.348  -7.353  11.077
  994   HH21  ARG 151          HH21      ARG 151 121.920  -9.764  11.577
  995   HH22  ARG 151          HH22      ARG 151 120.348  -9.549  10.995
  996    H    SER 152           HN       SER 152 127.116  -5.335  14.563
  997    HA   SER 152           HA       SER 152 126.597  -2.815  15.941
  998    HB2  SER 152           HB2      SER 152 128.632  -4.183  16.538
  999    HB3  SER 152           HB1      SER 152 129.216  -3.973  14.893
 1000    HG   SER 152           HG       SER 152 129.610  -1.868  15.274
 1001    H    SER 153           HN       SER 153 125.173  -2.244  14.155
 1002    HA   SER 153           HA       SER 153 126.118  -2.033  11.532
 1003    HB2  SER 153           HB2      SER 153 123.706  -0.746  12.804
 1004    HB3  SER 153           HB1      SER 153 124.023  -0.824  11.072
 1005    HG   SER 153           HG       SER 153 123.650  -2.899  11.055
 1006    H    ARG 154           HN       ARG 154 124.870   0.903  13.193
 1007    HA   ARG 154           HA       ARG 154 125.208   3.039  12.556
 1008    HB2  ARG 154           HB2      ARG 154 127.388   4.016  13.337
 1009    HB3  ARG 154           HB1      ARG 154 126.604   3.001  14.526
 1010    HG2  ARG 154           HG2      ARG 154 128.193   1.234  14.124
 1011    HG3  ARG 154           HG1      ARG 154 128.903   2.134  12.784
 1012    HD2  ARG 154           HD2      ARG 154 128.860   3.034  15.664
 1013    HD3  ARG 154           HD1      ARG 154 130.248   2.314  14.848
 1014    HE   ARG 154           HE       ARG 154 129.415   4.490  13.337
 1015   HH11  ARG 154          HH11      ARG 154 130.691   4.029  16.605
 1016   HH12  ARG 154          HH12      ARG 154 131.571   5.485  16.639
 1017   HH21  ARG 154          HH21      ARG 154 130.603   6.490  13.360
 1018   HH22  ARG 154          HH22      ARG 154 131.545   6.927  14.704
 1019    H    THR 155           HN       THR 155 125.263   1.466  10.384
 1020    HA   THR 155           HA       THR 155 127.384   1.935   8.553
 1021    HB   THR 155           HB       THR 155 125.448   0.854   7.195
 1022    HG1  THR 155           HG1      THR 155 123.965  -0.151   8.414
 1023   HG21  THR 155          HG21      THR 155 127.497  -0.235   7.768
 1024   HG22  THR 155          HG22      THR 155 126.149  -1.350   8.020
 1025   HG23  THR 155          HG23      THR 155 126.925  -0.561   9.403
 1026    H    ARG 156           HN       ARG 156 126.341   2.412   6.283
 1027    HA   ARG 156           HA       ARG 156 124.093   4.160   6.097
 1028    HB2  ARG 156           HB2      ARG 156 125.299   5.817   4.751
 1029    HB3  ARG 156           HB1      ARG 156 126.066   5.728   6.325
 1030    HG2  ARG 156           HG2      ARG 156 127.873   4.403   5.392
 1031    HG3  ARG 156           HG1      ARG 156 127.075   4.402   3.819
 1032    HD2  ARG 156           HD2      ARG 156 128.120   6.804   5.309
 1033    HD3  ARG 156           HD1      ARG 156 128.821   6.080   3.861
 1034    HE   ARG 156           HE       ARG 156 126.069   7.122   3.758
 1035   HH11  ARG 156          HH11      ARG 156 129.416   7.287   2.564
 1036   HH12  ARG 156          HH12      ARG 156 129.054   8.484   1.423
 1037   HH21  ARG 156          HH21      ARG 156 125.638   8.753   2.251
 1038   HH22  ARG 156          HH22      ARG 156 126.886   9.371   1.251
 1039    H    ARG 157           HN       ARG 157 123.150   3.759   3.808
 1040    HA   ARG 157           HA       ARG 157 122.858   2.582   1.988
 1041    HB2  ARG 157           HB2      ARG 157 125.799   1.876   2.231
 1042    HB3  ARG 157           HB1      ARG 157 124.787   1.291   0.927
 1043    HG2  ARG 157           HG2      ARG 157 125.247   4.213   1.491
 1044    HG3  ARG 157           HG1      ARG 157 126.232   3.261   0.378
 1045    HD2  ARG 157           HD2      ARG 157 123.261   3.721   0.184
 1046    HD3  ARG 157           HD1      ARG 157 124.494   4.479  -0.824
 1047    HE   ARG 157           HE       ARG 157 124.832   1.720  -1.023
 1048   HH11  ARG 157          HH11      ARG 157 122.350   4.115  -1.990
 1049   HH12  ARG 157          HH12      ARG 157 121.857   3.190  -3.322
 1050   HH21  ARG 157          HH21      ARG 157 124.094   0.522  -2.826
 1051   HH22  ARG 157          HH22      ARG 157 122.823   1.132  -3.819
 1052    H    GLU 158           HN       GLU 158 124.922   0.755   4.113
 1053    HA   GLU 158           HA       GLU 158 123.640  -1.753   3.618
 1054    HB2  GLU 158           HB2      GLU 158 125.852  -0.813   5.387
 1055    HB3  GLU 158           HB1      GLU 158 125.255  -2.461   5.456
 1056    HG2  GLU 158           HG2      GLU 158 126.376  -1.089   3.026
 1057    HG3  GLU 158           HG1      GLU 158 127.219  -2.273   4.036
 1058    H    THR 159           HN       THR 159 121.435  -1.274   4.398
 1059    HA   THR 159           HA       THR 159 121.325  -1.183   7.326
 1060    HB   THR 159           HB       THR 159 118.799  -1.324   5.723
 1061    HG1  THR 159           HG1      THR 159 120.606   0.884   5.767
 1062   HG21  THR 159          HG21      THR 159 119.651   0.306   8.140
 1063   HG22  THR 159          HG22      THR 159 118.749  -1.187   8.202
 1064   HG23  THR 159          HG23      THR 159 118.021   0.251   7.489
 1065    H    GLN 160           HN       GLN 160 121.978  -3.254   7.785
 1066    HA   GLN 160           HA       GLN 160 120.605  -5.480   6.588
 1067    HB2  GLN 160           HB2      GLN 160 122.784  -5.191   8.644
 1068    HB3  GLN 160           HB1      GLN 160 121.855  -6.679   8.535
 1069    HG2  GLN 160           HG2      GLN 160 124.020  -6.715   7.320
 1070    HG3  GLN 160           HG1      GLN 160 122.624  -7.136   6.356
 1071   HE21  GLN 160          HE21      GLN 160 125.225  -4.969   6.811
 1072   HE22  GLN 160          HE22      GLN 160 125.029  -4.146   5.302
 1073    H    VAL 161           HN       VAL 161 118.537  -5.865   7.190
 1074    HA   VAL 161           HA       VAL 161 117.959  -5.358   9.962
 1075    HB   VAL 161           HB       VAL 161 115.651  -4.760   9.411
 1076   HG11  VAL 161          HG11      VAL 161 115.898  -2.769   8.210
 1077   HG12  VAL 161          HG12      VAL 161 117.458  -3.266   7.586
 1078   HG13  VAL 161          HG13      VAL 161 117.263  -2.925   9.340
 1079   HG21  VAL 161          HG21      VAL 161 115.307  -6.134   7.409
 1080   HG22  VAL 161          HG22      VAL 161 116.389  -5.044   6.531
 1081   HG23  VAL 161          HG23      VAL 161 114.874  -4.433   7.177
  Start of MODEL    7
    1    H1   GLY  -3           HT1      GLY  -3 120.072  16.833 -20.815
    2    H2   GLY  -3           HT2      GLY  -3 119.412  16.903 -19.263
    3    H3   GLY  -3           HT3      GLY  -3 118.912  18.006 -20.460
    4    HA2  GLY  -3           HA1      GLY  -3 117.278  16.275 -20.111
    5    HA3  GLY  -3           HA2      GLY  -3 117.967  16.227 -21.732
    6    H    ALA  -2           HN       ALA  -2 116.878  13.985 -21.128
    7    HA   ALA  -2           HA       ALA  -2 117.207  11.819 -21.303
    8    HB1  ALA  -2           HB1      ALA  -2 119.380  12.303 -22.390
    9    HB2  ALA  -2           HB2      ALA  -2 119.331  10.759 -21.542
   10    HB3  ALA  -2           HB3      ALA  -2 120.156  12.139 -20.813
   11    H    MET  -1           HN       MET  -1 117.449  13.454 -18.655
   12    HA   MET  -1           HA       MET  -1 117.229  13.119 -16.468
   13    HB2  MET  -1           HB2      MET  -1 115.901  10.592 -17.415
   14    HB3  MET  -1           HB1      MET  -1 115.808  11.191 -15.768
   15    HG2  MET  -1           HG2      MET  -1 114.794  12.577 -18.241
   16    HG3  MET  -1           HG1      MET  -1 113.819  11.796 -16.998
   17    HE1  MET  -1           HE1      MET  -1 115.313  12.723 -14.301
   18    HE2  MET  -1           HE2      MET  -1 113.563  12.718 -14.519
   19    HE3  MET  -1           HE3      MET  -1 114.371  14.165 -13.919
   20    H    GLY   0           HN       GLY   0 119.663  12.884 -16.644
   21    HA2  GLY   0           HA2      GLY   0 120.609  10.300 -15.686
   22    HA3  GLY   0           HA1      GLY   0 121.606  11.706 -16.050
   23    H    LYS   1           HN       LYS   1 118.897  12.401 -14.268
   24    HA   LYS   1           HA       LYS   1 120.434  12.516 -11.786
   25    HB2  LYS   1           HB2      LYS   1 118.190  14.305 -12.783
   26    HB3  LYS   1           HB1      LYS   1 118.754  14.310 -11.129
   27    HG2  LYS   1           HG2      LYS   1 119.782  16.164 -12.169
   28    HG3  LYS   1           HG1      LYS   1 121.023  14.924 -12.007
   29    HD2  LYS   1           HD2      LYS   1 121.234  15.962 -14.185
   30    HD3  LYS   1           HD1      LYS   1 120.657  14.311 -14.390
   31    HE2  LYS   1           HE2      LYS   1 119.440  15.769 -15.877
   32    HE3  LYS   1           HE1      LYS   1 118.345  15.199 -14.630
   33    HZ1  LYS   1           HZ1      LYS   1 118.636  17.343 -13.485
   34    HZ2  LYS   1           HZ2      LYS   1 118.039  17.525 -15.043
   35    HZ3  LYS   1           HZ3      LYS   1 119.651  17.866 -14.738
   36    HA   PRO   2           HA       PRO   2 117.538   9.535 -10.356
   37    HB2  PRO   2           HB2      PRO   2 117.714   9.991  -7.677
   38    HB3  PRO   2           HB1      PRO   2 118.948   9.122  -8.591
   39    HG2  PRO   2           HG2      PRO   2 118.921  11.965  -7.667
   40    HG3  PRO   2           HG1      PRO   2 120.274  10.826  -7.710
   41    HD2  PRO   2           HD2      PRO   2 119.892  12.772  -9.564
   42    HD3  PRO   2           HD1      PRO   2 120.707  11.253  -9.952
   43    H    PHE   3           HN       PHE   3 115.405   9.426  -9.672
   44    HA   PHE   3           HA       PHE   3 114.145  11.991  -9.550
   45    HB2  PHE   3           HB2      PHE   3 112.060  10.712 -10.000
   46    HB3  PHE   3           HB1      PHE   3 113.267  10.583 -11.276
   47    HD1  PHE   3           HD1      PHE   3 114.509   8.435 -11.495
   48    HD2  PHE   3           HD2      PHE   3 111.285   8.959  -8.856
   49    HE1  PHE   3           HE1      PHE   3 114.241   5.977 -11.380
   50    HE2  PHE   3           HE2      PHE   3 110.976   6.545  -8.692
   51    HZ   PHE   3           HZ       PHE   3 112.459   5.022  -9.968
   52    H    PHE   4           HN       PHE   4 113.191  12.739  -7.866
   53    HA   PHE   4           HA       PHE   4 112.496  11.058  -5.646
   54    HB2  PHE   4           HB2      PHE   4 114.723  11.569  -4.887
   55    HB3  PHE   4           HB1      PHE   4 114.535  13.223  -5.490
   56    HD1  PHE   4           HD1      PHE   4 113.537  14.937  -4.220
   57    HD2  PHE   4           HD2      PHE   4 113.536  10.953  -2.741
   58    HE1  PHE   4           HE1      PHE   4 112.687  15.754  -2.134
   59    HE2  PHE   4           HE2      PHE   4 112.697  11.768  -0.573
   60    HZ   PHE   4           HZ       PHE   4 112.268  14.171  -0.246
   61    H    THR   5           HN       THR   5 110.641  11.672  -5.076
   62    HA   THR   5           HA       THR   5 110.274  14.257  -4.003
   63    HB   THR   5           HB       THR   5 109.660  14.794  -6.224
   64    HG1  THR   5           HG1      THR   5 107.546  14.665  -4.367
   65   HG21  THR   5          HG21      THR   5 107.709  13.772  -7.414
   66   HG22  THR   5          HG22      THR   5 107.564  12.607  -6.096
   67   HG23  THR   5          HG23      THR   5 109.001  12.607  -7.104
   68    H    ARG   6           HN       ARG   6 110.422  11.463  -3.323
   69    HA   ARG   6           HA       ARG   6 109.679   9.969  -1.781
   70    HB2  ARG   6           HB2      ARG   6 108.738  10.823   0.184
   71    HB3  ARG   6           HB1      ARG   6 109.729  12.080  -0.553
   72    HG2  ARG   6           HG2      ARG   6 107.652  13.035  -1.486
   73    HG3  ARG   6           HG1      ARG   6 106.756  11.898  -0.478
   74    HD2  ARG   6           HD2      ARG   6 108.816  13.782   0.307
   75    HD3  ARG   6           HD1      ARG   6 107.072  14.104   0.542
   76    HE   ARG   6           HE       ARG   6 107.274  11.939   1.965
   77   HH11  ARG   6          HH11      ARG   6 109.777  14.464   1.838
   78   HH12  ARG   6          HH12      ARG   6 110.380  14.175   3.393
   79   HH21  ARG   6          HH21      ARG   6 108.156  11.506   4.161
   80   HH22  ARG   6          HH22      ARG   6 109.440  12.475   4.724
   81    H    ASN   7           HN       ASN   7 108.165  10.579  -4.054
   82    HA   ASN   7           HA       ASN   7 105.516   9.470  -3.489
   83    HB2  ASN   7           HB2      ASN   7 106.839  10.449  -5.974
   84    HB3  ASN   7           HB1      ASN   7 105.450   9.394  -6.117
   85   HD21  ASN   7          HD21      ASN   7 105.725  11.663  -3.501
   86   HD22  ASN   7          HD22      ASN   7 104.510  12.753  -4.051
   87    HA   PRO   8           HA       PRO   8 106.971   5.082  -3.965
   88    HB2  PRO   8           HB2      PRO   8 104.167   4.731  -4.189
   89    HB3  PRO   8           HB1      PRO   8 105.153   3.944  -3.045
   90    HG2  PRO   8           HG2      PRO   8 103.338   6.035  -2.752
   91    HG3  PRO   8           HG1      PRO   8 104.426   5.506  -1.450
   92    HD2  PRO   8           HD2      PRO   8 104.352   7.932  -2.770
   93    HD3  PRO   8           HD1      PRO   8 105.690   7.398  -1.736
   94    H    SER   9           HN       SER   9 104.516   6.974  -5.302
   95    HA   SER   9           HA       SER   9 103.779   5.284  -7.196
   96    HB2  SER   9           HB2      SER   9 102.388   6.911  -6.243
   97    HB3  SER   9           HB1      SER   9 103.339   8.229  -6.912
   98    HG   SER   9           HG       SER   9 101.397   7.783  -8.050
   99    H    GLU  10           HN       GLU  10 106.373   7.709  -6.992
  100    HA   GLU  10           HA       GLU  10 106.738   8.027  -9.831
  101    HB2  GLU  10           HB2      GLU  10 108.652   9.408  -9.318
  102    HB3  GLU  10           HB1      GLU  10 107.412   9.836  -8.147
  103    HG2  GLU  10           HG2      GLU  10 108.623   8.307  -6.533
  104    HG3  GLU  10           HG1      GLU  10 109.906   8.199  -7.725
  105    H    LEU  11           HN       LEU  11 107.887   6.134  -7.196
  106    HA   LEU  11           HA       LEU  11 110.005   4.837  -8.497
  107    HB2  LEU  11           HB2      LEU  11 108.275   4.017  -6.187
  108    HB3  LEU  11           HB1      LEU  11 109.643   3.072  -6.746
  109    HG   LEU  11           HG       LEU  11 109.870   5.927  -5.782
  110   HD11  LEU  11          HD11      LEU  11 110.440   3.344  -4.369
  111   HD12  LEU  11          HD12      LEU  11 109.131   4.474  -3.999
  112   HD13  LEU  11          HD13      LEU  11 110.817   4.958  -3.756
  113   HD21  LEU  11          HD21      LEU  11 111.656   5.224  -7.313
  114   HD22  LEU  11          HD22      LEU  11 111.929   3.793  -6.338
  115   HD23  LEU  11          HD23      LEU  11 112.262   5.389  -5.664
  116    H    LYS  12           HN       LYS  12 110.143   3.304  -9.689
  117    HA   LYS  12           HA       LYS  12 107.912   2.607 -11.369
  118    HB2  LYS  12           HB2      LYS  12 109.612   1.641 -12.804
  119    HB3  LYS  12           HB1      LYS  12 109.994   3.299 -12.340
  120    HG2  LYS  12           HG2      LYS  12 111.545   2.552 -10.703
  121    HG3  LYS  12           HG1      LYS  12 111.014   0.889 -10.979
  122    HD2  LYS  12           HD2      LYS  12 113.157   1.238 -12.095
  123    HD3  LYS  12           HD1      LYS  12 111.870   1.081 -13.291
  124    HE2  LYS  12           HE2      LYS  12 111.784   3.490 -13.579
  125    HE3  LYS  12           HE1      LYS  12 113.013   3.710 -12.331
  126    HZ1  LYS  12           HZ1      LYS  12 114.557   2.468 -13.737
  127    HZ2  LYS  12           HZ2      LYS  12 114.001   3.835 -14.539
  128    HZ3  LYS  12           HZ3      LYS  12 113.381   2.311 -14.916
  129    H    GLY  13           HN       GLY  13 108.116   0.295 -12.380
  130    HA2  GLY  13           HA2      GLY  13 108.100  -1.995 -12.104
  131    HA3  GLY  13           HA1      GLY  13 108.535  -1.791 -10.417
  132    H    LYS  14           HN       LYS  14 107.109  -2.558  -9.215
  133    HA   LYS  14           HA       LYS  14 104.291  -1.980  -9.675
  134    HB2  LYS  14           HB2      LYS  14 103.871  -4.280  -8.616
  135    HB3  LYS  14           HB1      LYS  14 104.309  -4.193 -10.322
  136    HG2  LYS  14           HG2      LYS  14 106.518  -4.563  -8.448
  137    HG3  LYS  14           HG1      LYS  14 105.393  -5.917  -8.531
  138    HD2  LYS  14           HD2      LYS  14 105.703  -5.889 -11.030
  139    HD3  LYS  14           HD1      LYS  14 106.941  -4.651 -10.807
  140    HE2  LYS  14           HE2      LYS  14 108.257  -6.188  -9.454
  141    HE3  LYS  14           HE1      LYS  14 107.006  -7.416  -9.601
  142    HZ1  LYS  14           HZ1      LYS  14 108.603  -6.317 -11.861
  143    HZ2  LYS  14           HZ2      LYS  14 107.425  -7.516 -11.972
  144    HZ3  LYS  14           HZ3      LYS  14 108.824  -7.809 -11.117
  145    H    PHE  15           HN       PHE  15 103.021  -1.877  -7.758
  146    HA   PHE  15           HA       PHE  15 104.656  -1.026  -5.515
  147    HB2  PHE  15           HB2      PHE  15 103.760   0.828  -6.880
  148    HB3  PHE  15           HB1      PHE  15 102.152   0.157  -6.702
  149    HD1  PHE  15           HD2      PHE  15 104.129   0.002  -3.726
  150    HD2  PHE  15           HD1      PHE  15 101.639   2.482  -6.047
  151    HE1  PHE  15           HE2      PHE  15 103.782   1.465  -1.748
  152    HE2  PHE  15           HE1      PHE  15 101.271   3.976  -4.115
  153    HZ   PHE  15           HZ       PHE  15 102.347   3.484  -1.967
  154    H    ILE  16           HN       ILE  16 104.223  -2.242  -3.837
  155    HA   ILE  16           HA       ILE  16 101.571  -3.342  -3.494
  156    HB   ILE  16           HB       ILE  16 102.557  -5.414  -2.562
  157   HG12  ILE  16          HG12      ILE  16 104.920  -4.548  -2.367
  158   HG13  ILE  16          HG11      ILE  16 104.771  -6.165  -3.014
  159   HG21  ILE  16          HG21      ILE  16 102.828  -6.552  -4.724
  160   HG22  ILE  16          HG22      ILE  16 102.924  -4.975  -5.506
  161   HG23  ILE  16          HG23      ILE  16 101.449  -5.456  -4.666
  162   HD11  ILE  16          HD11      ILE  16 106.488  -4.800  -4.202
  163   HD12  ILE  16          HD12      ILE  16 105.189  -3.715  -4.773
  164   HD13  ILE  16          HD13      ILE  16 105.216  -5.396  -5.250
  165    H    HIS  17           HN       HIS  17 101.041  -3.881  -1.358
  166    HA   HIS  17           HA       HIS  17 102.755  -2.597   0.632
  167    HB2  HIS  17           HB2      HIS  17 100.794  -1.201   0.039
  168    HB3  HIS  17           HB1      HIS  17  99.736  -2.544   0.483
  169    HD1  HIS  17           HD1      HIS  17  98.603  -0.972   2.316
  170    HD2  HIS  17           HD2      HIS  17 102.658  -1.684   2.846
  171    HE1  HIS  17           HE1      HIS  17  99.160  -0.177   4.620
  172    H    THR  18           HN       THR  18 103.473  -4.134   1.855
  173    HA   THR  18           HA       THR  18 101.676  -6.321   2.647
  174    HB   THR  18           HB       THR  18 103.257  -7.165   0.943
  175    HG1  THR  18           HG1      THR  18 102.557  -8.545   2.676
  176   HG21  THR  18          HG21      THR  18 105.420  -6.493   2.953
  177   HG22  THR  18          HG22      THR  18 105.156  -5.666   1.424
  178   HG23  THR  18          HG23      THR  18 105.655  -7.360   1.431
  179    H    LYS  19           HN       LYS  19 102.110  -7.229   4.694
  180    HA   LYS  19           HA       LYS  19 103.418  -5.336   6.503
  181    HB2  LYS  19           HB2      LYS  19 101.006  -5.739   6.771
  182    HB3  LYS  19           HB1      LYS  19 101.311  -7.450   6.976
  183    HG2  LYS  19           HG2      LYS  19 102.491  -5.450   8.848
  184    HG3  LYS  19           HG1      LYS  19 100.809  -5.938   9.013
  185    HD2  LYS  19           HD2      LYS  19 101.670  -8.340   9.127
  186    HD3  LYS  19           HD1      LYS  19 103.292  -7.654   9.275
  187    HE2  LYS  19           HE2      LYS  19 102.306  -8.173  11.420
  188    HE3  LYS  19           HE1      LYS  19 102.698  -6.470  11.227
  189    HZ1  LYS  19           HZ1      LYS  19 100.484  -6.883  12.273
  190    HZ2  LYS  19           HZ2      LYS  19  99.946  -7.566  10.837
  191    HZ3  LYS  19           HZ3      LYS  19 100.395  -5.949  10.888
  192    H    LEU  20           HN       LEU  20 105.056  -6.013   7.844
  193    HA   LEU  20           HA       LEU  20 105.893  -8.788   7.542
  194    HB2  LEU  20           HB2      LEU  20 107.427  -6.302   7.188
  195    HB3  LEU  20           HB1      LEU  20 108.171  -7.435   8.288
  196    HG   LEU  20           HG       LEU  20 108.447  -9.078   6.578
  197   HD11  LEU  20          HD11      LEU  20 107.703  -8.806   4.326
  198   HD12  LEU  20          HD12      LEU  20 106.780  -7.355   4.772
  199   HD13  LEU  20          HD13      LEU  20 106.371  -8.942   5.460
  200   HD21  LEU  20          HD21      LEU  20 109.780  -7.876   4.954
  201   HD22  LEU  20          HD22      LEU  20 110.071  -7.330   6.602
  202   HD23  LEU  20          HD23      LEU  20 109.084  -6.355   5.511
  203    H    ARG  21           HN       ARG  21 105.609  -9.714   9.263
  204    HA   ARG  21           HA       ARG  21 105.310  -8.227  11.637
  205    HB2  ARG  21           HB2      ARG  21 103.815 -10.082  11.130
  206    HB3  ARG  21           HB1      ARG  21 105.176 -11.189  11.099
  207    HG2  ARG  21           HG2      ARG  21 105.594 -10.739  13.440
  208    HG3  ARG  21           HG1      ARG  21 104.205  -9.654  13.483
  209    HD2  ARG  21           HD2      ARG  21 102.743 -11.481  12.752
  210    HD3  ARG  21           HD1      ARG  21 104.116 -12.586  12.798
  211    HE   ARG  21           HE       ARG  21 103.656 -11.228  15.264
  212   HH11  ARG  21          HH11      ARG  21 102.541 -13.905  13.278
  213   HH12  ARG  21          HH12      ARG  21 102.114 -14.927  14.553
  214   HH21  ARG  21          HH21      ARG  21 102.994 -12.522  17.071
  215   HH22  ARG  21          HH22      ARG  21 102.374 -14.077  16.847
  216    H    LYS  22           HN       LYS  22 107.335  -7.586  12.480
  217    HA   LYS  22           HA       LYS  22 109.752  -8.371  12.114
  218    HB2  LYS  22           HB2      LYS  22 108.311  -7.370  14.420
  219    HB3  LYS  22           HB1      LYS  22 109.934  -7.970  14.689
  220    HG2  LYS  22           HG2      LYS  22 109.983  -5.686  14.291
  221    HG3  LYS  22           HG1      LYS  22 110.780  -6.615  13.004
  222    HD2  LYS  22           HD2      LYS  22 109.641  -4.949  11.840
  223    HD3  LYS  22           HD1      LYS  22 108.457  -6.248  11.885
  224    HE2  LYS  22           HE2      LYS  22 107.342  -4.202  12.450
  225    HE3  LYS  22           HE1      LYS  22 107.452  -5.193  13.885
  226    HZ1  LYS  22           HZ1      LYS  22 109.319  -3.794  14.677
  227    HZ2  LYS  22           HZ2      LYS  22 107.981  -2.879  14.375
  228    HZ3  LYS  22           HZ3      LYS  22 109.224  -2.847  13.294
  229    H    SER  23           HN       SER  23 110.838  -9.989  12.174
  230    HA   SER  23           HA       SER  23 109.991 -12.404  13.495
  231    HB2  SER  23           HB2      SER  23 110.642 -12.352  11.070
  232    HB3  SER  23           HB1      SER  23 112.257 -11.848  11.546
  233    HG   SER  23           HG       SER  23 111.405 -14.288  11.281
  234    H    SER  24           HN       SER  24 112.792 -13.335  13.647
  235    HA   SER  24           HA       SER  24 113.292 -12.610  16.309
  236    HB2  SER  24           HB2      SER  24 115.106 -14.037  14.383
  237    HB3  SER  24           HB1      SER  24 115.242 -14.023  16.140
  238    HG   SER  24           HG       SER  24 114.101 -15.782  15.861
  239    H    ARG  25           HN       ARG  25 113.381 -10.302  16.040
  240    HA   ARG  25           HA       ARG  25 114.486  -8.436  16.514
  241    HB2  ARG  25           HB2      ARG  25 116.792 -10.321  16.549
  242    HB3  ARG  25           HB1      ARG  25 117.125  -8.598  16.512
  243    HG2  ARG  25           HG2      ARG  25 115.277  -9.804  18.552
  244    HG3  ARG  25           HG1      ARG  25 117.036  -9.688  18.827
  245    HD2  ARG  25           HD2      ARG  25 116.749  -7.234  18.280
  246    HD3  ARG  25           HD1      ARG  25 115.017  -7.512  18.368
  247    HE   ARG  25           HE       ARG  25 116.170  -8.468  20.711
  248   HH11  ARG  25          HH11      ARG  25 115.382  -5.430  19.083
  249   HH12  ARG  25          HH12      ARG  25 115.638  -4.459  20.459
  250   HH21  ARG  25          HH21      ARG  25 116.489  -7.104  22.633
  251   HH22  ARG  25          HH22      ARG  25 116.242  -5.438  22.527
  252    H    GLY  26           HN       GLY  26 113.482  -7.919  14.619
  253    HA2  GLY  26           HA2      GLY  26 114.082  -6.167  13.041
  254    HA3  GLY  26           HA1      GLY  26 115.441  -7.192  12.579
  255    H    PHE  27           HN       PHE  27 115.117  -7.891  10.685
  256    HA   PHE  27           HA       PHE  27 112.436  -8.788   9.960
  257    HB2  PHE  27           HB2      PHE  27 114.249  -6.830   8.829
  258    HB3  PHE  27           HB1      PHE  27 113.181  -7.684   7.657
  259    HD1  PHE  27           HD1      PHE  27 110.621  -7.397   8.580
  260    HD2  PHE  27           HD2      PHE  27 113.979  -5.031   9.656
  261    HE1  PHE  27           HE1      PHE  27 109.137  -5.586   9.342
  262    HE2  PHE  27           HE2      PHE  27 112.538  -3.287  10.397
  263    HZ   PHE  27           HZ       PHE  27 110.146  -3.532  10.300
  264    H    GLY  28           HN       GLY  28 115.591  -8.588   8.310
  265    HA2  GLY  28           HA2      GLY  28 116.744 -10.682   7.877
  266    HA3  GLY  28           HA1      GLY  28 115.155 -11.402   7.619
  267    H    PHE  29           HN       PHE  29 116.725  -8.428   6.532
  268    HA   PHE  29           HA       PHE  29 117.105  -9.393   3.948
  269    HB2  PHE  29           HB2      PHE  29 115.699  -7.805   2.668
  270    HB3  PHE  29           HB1      PHE  29 114.747  -8.946   3.549
  271    HD1  PHE  29           HD2      PHE  29 116.021  -5.490   3.721
  272    HD2  PHE  29           HD1      PHE  29 112.987  -8.177   4.964
  273    HE1  PHE  29           HE2      PHE  29 114.724  -3.593   4.656
  274    HE2  PHE  29           HE1      PHE  29 111.703  -6.311   5.894
  275    HZ   PHE  29           HZ       PHE  29 112.563  -4.018   5.742
  276    H    THR  30           HN       THR  30 118.541  -8.012   2.784
  277    HA   THR  30           HA       THR  30 119.414  -5.769   4.459
  278    HB   THR  30           HB       THR  30 121.653  -6.038   3.333
  279    HG1  THR  30           HG1      THR  30 121.984  -8.142   2.362
  280   HG21  THR  30          HG21      THR  30 121.203  -6.965   5.592
  281   HG22  THR  30          HG22      THR  30 122.378  -7.927   4.699
  282   HG23  THR  30          HG23      THR  30 120.707  -8.477   4.847
  283    H    VAL  31           HN       VAL  31 119.714  -3.898   3.766
  284    HA   VAL  31           HA       VAL  31 118.516  -3.450   1.200
  285    HB   VAL  31           HB       VAL  31 116.771  -3.463   2.711
  286   HG11  VAL  31          HG11      VAL  31 117.985  -3.286   4.838
  287   HG12  VAL  31          HG12      VAL  31 116.677  -2.094   4.779
  288   HG13  VAL  31          HG13      VAL  31 118.343  -1.599   4.458
  289   HG21  VAL  31          HG21      VAL  31 117.635  -0.692   2.377
  290   HG22  VAL  31          HG22      VAL  31 115.977  -1.231   2.794
  291   HG23  VAL  31          HG23      VAL  31 116.708  -1.663   1.217
  292    H    VAL  32           HN       VAL  32 119.089  -1.597   0.232
  293    HA   VAL  32           HA       VAL  32 121.239  -0.049   1.398
  294    HB   VAL  32           HB       VAL  32 122.097   0.268  -0.918
  295   HG11  VAL  32          HG11      VAL  32 121.982  -2.570   0.062
  296   HG12  VAL  32          HG12      VAL  32 123.115  -1.341   0.639
  297   HG13  VAL  32          HG13      VAL  32 123.189  -1.910  -1.035
  298   HG21  VAL  32          HG21      VAL  32 120.091  -1.895  -1.466
  299   HG22  VAL  32          HG22      VAL  32 121.376  -1.448  -2.600
  300   HG23  VAL  32          HG23      VAL  32 120.111  -0.282  -2.172
  301    H    GLY  33           HN       GLY  33 120.967   1.939   1.479
  302    HA2  GLY  33           HA2      GLY  33 120.366   3.841  -0.096
  303    HA3  GLY  33           HA1      GLY  33 118.763   3.114  -0.002
  304    H    GLY  34           HN       GLY  34 117.680   4.521   1.042
  305    HA2  GLY  34           HA2      GLY  34 117.050   6.095   2.580
  306    HA3  GLY  34           HA1      GLY  34 117.369   4.832   3.738
  307    H    ASP  35           HN       ASP  35 119.228   6.705   1.648
  308    HA   ASP  35           HA       ASP  35 121.407   7.142   3.576
  309    HB2  ASP  35           HB2      ASP  35 121.636   6.402   1.139
  310    HB3  ASP  35           HB1      ASP  35 120.921   7.919   0.682
  311    H    GLU  36           HN       GLU  36 118.875   8.944   1.919
  312    HA   GLU  36           HA       GLU  36 118.938  10.975   3.894
  313    HB2  GLU  36           HB2      GLU  36 119.666  12.746   2.168
  314    HB3  GLU  36           HB1      GLU  36 120.923  11.848   2.994
  315    HG2  GLU  36           HG2      GLU  36 121.108  10.404   1.118
  316    HG3  GLU  36           HG1      GLU  36 119.880  11.328   0.255
  317    HA   PRO  37           HA       PRO  37 115.009  11.807   2.381
  318    HB2  PRO  37           HB2      PRO  37 115.788  14.617   2.525
  319    HB3  PRO  37           HB1      PRO  37 114.424  13.784   3.388
  320    HG2  PRO  37           HG2      PRO  37 116.561  14.607   4.728
  321    HG3  PRO  37           HG1      PRO  37 116.056  12.910   4.952
  322    HD2  PRO  37           HD2      PRO  37 118.073  13.945   2.954
  323    HD3  PRO  37           HD1      PRO  37 118.392  12.750   4.189
  324    H    ASP  38           HN       ASP  38 116.364  11.206   0.541
  325    HA   ASP  38           HA       ASP  38 115.865  12.702  -1.866
  326    HB2  ASP  38           HB2      ASP  38 117.730  13.909  -1.169
  327    HB3  ASP  38           HB1      ASP  38 118.619  12.503  -0.641
  328    H    GLU  39           HN       GLU  39 117.606  10.120  -0.170
  329    HA   GLU  39           HA       GLU  39 117.146   8.355  -2.445
  330    HB2  GLU  39           HB2      GLU  39 119.527   8.993  -2.085
  331    HB3  GLU  39           HB1      GLU  39 119.419   8.261  -0.489
  332    HG2  GLU  39           HG2      GLU  39 118.900   6.107  -1.525
  333    HG3  GLU  39           HG1      GLU  39 119.064   6.847  -3.114
  334    H    PHE  40           HN       PHE  40 115.964   6.724  -2.043
  335    HA   PHE  40           HA       PHE  40 114.758   6.068   0.568
  336    HB2  PHE  40           HB2      PHE  40 114.073   4.859  -2.111
  337    HB3  PHE  40           HB1      PHE  40 113.050   5.017  -0.696
  338    HD1  PHE  40           HD1      PHE  40 112.764   7.671  -0.024
  339    HD2  PHE  40           HD2      PHE  40 113.481   6.084  -3.900
  340    HE1  PHE  40           HE1      PHE  40 111.718   9.655  -1.033
  341    HE2  PHE  40           HE2      PHE  40 112.443   8.061  -4.920
  342    HZ   PHE  40           HZ       PHE  40 111.553   9.850  -3.493
  343    H    LEU  41           HN       LEU  41 114.224   3.565   0.868
  344    HA   LEU  41           HA       LEU  41 116.892   2.387   0.708
  345    HB2  LEU  41           HB2      LEU  41 114.517   1.525   2.376
  346    HB3  LEU  41           HB1      LEU  41 116.086   0.743   2.275
  347    HG   LEU  41           HG       LEU  41 116.998   2.987   3.109
  348   HD11  LEU  41          HD11      LEU  41 114.986   4.328   3.021
  349   HD12  LEU  41          HD12      LEU  41 115.459   4.146   4.708
  350   HD13  LEU  41          HD13      LEU  41 114.143   3.182   4.054
  351   HD21  LEU  41          HD21      LEU  41 115.512   1.111   4.926
  352   HD22  LEU  41          HD22      LEU  41 116.852   2.174   5.383
  353   HD23  LEU  41          HD23      LEU  41 117.119   0.852   4.256
  354    H    GLN  42           HN       GLN  42 117.221   0.282  -0.210
  355    HA   GLN  42           HA       GLN  42 114.977  -0.738  -1.783
  356    HB2  GLN  42           HB2      GLN  42 116.449   0.762  -2.932
  357    HB3  GLN  42           HB1      GLN  42 117.825  -0.328  -2.591
  358    HG2  GLN  42           HG2      GLN  42 115.917  -1.916  -3.852
  359    HG3  GLN  42           HG1      GLN  42 115.643  -0.373  -4.591
  360   HE21  GLN  42          HE21      GLN  42 117.961  -2.917  -4.294
  361   HE22  GLN  42          HE22      GLN  42 118.988  -2.363  -5.574
  362    H    ILE  43           HN       ILE  43 115.225  -2.972  -2.102
  363    HA   ILE  43           HA       ILE  43 116.887  -4.344  -0.079
  364    HB   ILE  43           HB       ILE  43 114.900  -5.607  -1.966
  365   HG12  ILE  43          HG12      ILE  43 113.736  -3.937  -0.664
  366   HG13  ILE  43          HG11      ILE  43 113.300  -5.536  -0.086
  367   HG21  ILE  43          HG21      ILE  43 116.429  -7.206  -0.996
  368   HG22  ILE  43          HG22      ILE  43 114.818  -7.429  -0.319
  369   HG23  ILE  43          HG23      ILE  43 116.067  -6.621   0.628
  370   HD11  ILE  43          HD11      ILE  43 113.573  -4.037   1.741
  371   HD12  ILE  43          HD12      ILE  43 115.191  -3.602   1.195
  372   HD13  ILE  43          HD13      ILE  43 114.863  -5.239   1.779
  373    H    LYS  44           HN       LYS  44 118.880  -5.200  -0.575
  374    HA   LYS  44           HA       LYS  44 119.339  -6.038  -3.382
  375    HB2  LYS  44           HB2      LYS  44 121.501  -5.882  -1.289
  376    HB3  LYS  44           HB1      LYS  44 121.687  -6.347  -2.931
  377    HG2  LYS  44           HG2      LYS  44 121.077  -4.020  -3.587
  378    HG3  LYS  44           HG1      LYS  44 121.165  -3.612  -1.867
  379    HD2  LYS  44           HD2      LYS  44 123.417  -4.759  -3.555
  380    HD3  LYS  44           HD1      LYS  44 123.328  -3.124  -2.909
  381    HE2  LYS  44           HE2      LYS  44 123.438  -4.042  -0.607
  382    HE3  LYS  44           HE1      LYS  44 123.497  -5.667  -1.269
  383    HZ1  LYS  44           HZ1      LYS  44 125.605  -3.578  -1.620
  384    HZ2  LYS  44           HZ2      LYS  44 125.629  -5.095  -2.321
  385    HZ3  LYS  44           HZ3      LYS  44 125.684  -4.946  -0.643
  386    H    SER  45           HN       SER  45 118.882  -7.315  -0.215
  387    HA   SER  45           HA       SER  45 119.048  -9.910  -1.465
  388    HB2  SER  45           HB2      SER  45 120.679  -9.253   0.995
  389    HB3  SER  45           HB1      SER  45 120.426 -10.873   0.345
  390    HG   SER  45           HG       SER  45 121.198  -9.261  -1.591
  391    H    LEU  46           HN       LEU  46 117.350 -11.007  -0.914
  392    HA   LEU  46           HA       LEU  46 115.834 -10.290   1.285
  393    HB2  LEU  46           HB2      LEU  46 114.685 -10.966  -0.617
  394    HB3  LEU  46           HB1      LEU  46 115.748 -12.335  -0.844
  395    HG   LEU  46           HG       LEU  46 114.702 -13.500   1.006
  396   HD11  LEU  46          HD11      LEU  46 114.266 -11.551   2.320
  397   HD12  LEU  46          HD12      LEU  46 112.843 -12.591   2.159
  398   HD13  LEU  46          HD13      LEU  46 112.960 -11.072   1.225
  399   HD21  LEU  46          HD21      LEU  46 113.740 -13.715  -1.218
  400   HD22  LEU  46          HD22      LEU  46 112.686 -12.337  -0.883
  401   HD23  LEU  46          HD23      LEU  46 112.501 -13.832   0.037
  402    H    VAL  47           HN       VAL  47 116.620 -11.059   3.332
  403    HA   VAL  47           HA       VAL  47 118.360 -13.330   3.372
  404    HB   VAL  47           HB       VAL  47 117.371 -11.527   5.612
  405   HG11  VAL  47          HG11      VAL  47 117.976 -13.704   6.415
  406   HG12  VAL  47          HG12      VAL  47 119.149 -12.489   6.951
  407   HG13  VAL  47          HG13      VAL  47 119.547 -13.587   5.618
  408   HG21  VAL  47          HG21      VAL  47 119.604 -10.506   5.554
  409   HG22  VAL  47          HG22      VAL  47 118.796 -10.310   4.012
  410   HG23  VAL  47          HG23      VAL  47 120.049 -11.535   4.195
  411    H    LEU  48           HN       LEU  48 117.657 -15.309   3.713
  412    HA   LEU  48           HA       LEU  48 114.877 -15.752   3.977
  413    HB2  LEU  48           HB2      LEU  48 117.134 -17.703   4.092
  414    HB3  LEU  48           HB1      LEU  48 115.440 -18.095   3.895
  415    HG   LEU  48           HG       LEU  48 117.139 -16.580   1.942
  416   HD11  LEU  48          HD11      LEU  48 116.711 -18.490   0.474
  417   HD12  LEU  48          HD12      LEU  48 115.852 -19.288   1.799
  418   HD13  LEU  48          HD13      LEU  48 117.574 -18.931   1.949
  419   HD21  LEU  48          HD21      LEU  48 114.882 -15.637   1.887
  420   HD22  LEU  48          HD22      LEU  48 114.188 -17.249   1.788
  421   HD23  LEU  48          HD23      LEU  48 115.149 -16.625   0.452
  422    H    ASP  49           HN       ASP  49 113.801 -16.953   5.440
  423    HA   ASP  49           HA       ASP  49 112.954 -17.256   7.436
  424    HB2  ASP  49           HB2      ASP  49 115.071 -18.410   7.932
  425    HB3  ASP  49           HB1      ASP  49 115.769 -16.922   8.515
  426    H    GLY  50           HN       GLY  50 113.850 -14.558   6.165
  427    HA2  GLY  50           HA2      GLY  50 113.185 -12.651   8.261
  428    HA3  GLY  50           HA1      GLY  50 113.452 -12.476   6.502
  429    HA   PRO  51           HA       PRO  51 108.911 -13.070   7.453
  430    HB2  PRO  51           HB2      PRO  51 108.012 -10.370   7.784
  431    HB3  PRO  51           HB1      PRO  51 108.212 -11.576   9.015
  432    HG2  PRO  51           HG2      PRO  51 109.767  -9.263   8.768
  433    HG3  PRO  51           HG1      PRO  51 110.084 -10.643   9.826
  434    HD2  PRO  51           HD2      PRO  51 111.174  -9.998   7.140
  435    HD3  PRO  51           HD1      PRO  51 112.047 -10.702   8.475
  436    H    ALA  52           HN       ALA  52 110.587 -10.763   5.612
  437    HA   ALA  52           HA       ALA  52 108.846 -10.348   3.441
  438    HB1  ALA  52           HB1      ALA  52 110.836  -8.988   3.729
  439    HB2  ALA  52           HB2      ALA  52 111.026  -9.898   2.222
  440    HB3  ALA  52           HB3      ALA  52 111.852 -10.415   3.673
  441    H    ALA  53           HN       ALA  53 111.349 -12.728   4.127
  442    HA   ALA  53           HA       ALA  53 111.301 -14.236   1.734
  443    HB1  ALA  53           HB1      ALA  53 113.151 -14.275   3.393
  444    HB2  ALA  53           HB2      ALA  53 112.519 -15.889   3.040
  445    HB3  ALA  53           HB3      ALA  53 112.050 -15.072   4.528
  446    H    LEU  54           HN       LEU  54 109.848 -14.515   4.804
  447    HA   LEU  54           HA       LEU  54 108.841 -17.055   4.489
  448    HB2  LEU  54           HB2      LEU  54 108.393 -14.949   6.422
  449    HB3  LEU  54           HB1      LEU  54 107.904 -16.636   6.600
  450    HG   LEU  54           HG       LEU  54 110.767 -15.668   6.192
  451   HD11  LEU  54          HD11      LEU  54 111.049 -16.537   8.228
  452   HD12  LEU  54          HD12      LEU  54 109.231 -16.894   8.155
  453   HD13  LEU  54          HD13      LEU  54 109.864 -15.182   8.018
  454   HD21  LEU  54          HD21      LEU  54 109.645 -18.472   6.464
  455   HD22  LEU  54          HD22      LEU  54 111.337 -18.045   6.596
  456   HD23  LEU  54          HD23      LEU  54 110.514 -17.835   5.060
  457    H    ASP  55           HN       ASP  55 107.376 -13.828   4.262
  458    HA   ASP  55           HA       ASP  55 104.760 -14.941   3.668
  459    HB2  ASP  55           HB2      ASP  55 105.273 -12.595   4.709
  460    HB3  ASP  55           HB1      ASP  55 105.676 -12.140   3.075
  461    H    GLY  56           HN       GLY  56 107.619 -14.094   2.185
  462    HA2  GLY  56           HA2      GLY  56 108.442 -14.186   0.072
  463    HA3  GLY  56           HA1      GLY  56 107.040 -15.225  -0.319
  464    H    LYS  57           HN       LYS  57 106.659 -12.116   0.866
  465    HA   LYS  57           HA       LYS  57 105.349 -11.360  -1.628
  466    HB2  LYS  57           HB2      LYS  57 104.196 -11.442   0.498
  467    HB3  LYS  57           HB1      LYS  57 105.287 -10.208   1.089
  468    HG2  LYS  57           HG2      LYS  57 103.174  -9.174   0.483
  469    HG3  LYS  57           HG1      LYS  57 104.376  -8.689  -0.715
  470    HD2  LYS  57           HD2      LYS  57 102.426  -9.223  -1.940
  471    HD3  LYS  57           HD1      LYS  57 103.486 -10.605  -2.153
  472    HE2  LYS  57           HE2      LYS  57 101.208 -10.447  -0.165
  473    HE3  LYS  57           HE1      LYS  57 101.107 -11.208  -1.741
  474    HZ1  LYS  57           HZ1      LYS  57 102.875 -12.788  -0.935
  475    HZ2  LYS  57           HZ2      LYS  57 101.416 -12.877  -0.138
  476    HZ3  LYS  57           HZ3      LYS  57 102.694 -12.146   0.626
  477    H    MET  58           HN       MET  58 108.146 -10.702   0.200
  478    HA   MET  58           HA       MET  58 108.683  -8.315  -1.410
  479    HB2  MET  58           HB2      MET  58 108.471  -7.614   0.915
  480    HB3  MET  58           HB1      MET  58 109.554  -8.897   1.437
  481    HG2  MET  58           HG2      MET  58 111.228  -7.778  -0.210
  482    HG3  MET  58           HG1      MET  58 110.152  -6.422  -0.102
  483    HE1  MET  58           HE1      MET  58 109.026  -6.352   2.785
  484    HE2  MET  58           HE2      MET  58 109.687  -4.928   1.965
  485    HE3  MET  58           HE3      MET  58 110.200  -5.315   3.601
  486    H    GLU  59           HN       GLU  59 110.747  -8.326  -2.333
  487    HA   GLU  59           HA       GLU  59 112.436 -10.619  -1.826
  488    HB2  GLU  59           HB2      GLU  59 111.198 -10.088  -4.528
  489    HB3  GLU  59           HB1      GLU  59 112.506 -11.208  -4.225
  490    HG2  GLU  59           HG2      GLU  59 111.086 -12.666  -2.992
  491    HG3  GLU  59           HG1      GLU  59 109.791 -11.469  -2.961
  492    H    THR  60           HN       THR  60 114.439 -10.407  -2.994
  493    HA   THR  60           HA       THR  60 115.683  -8.001  -2.955
  494    HB   THR  60           HB       THR  60 116.203 -10.237  -4.873
  495    HG1  THR  60           HG1      THR  60 117.196 -11.296  -3.127
  496   HG21  THR  60          HG21      THR  60 117.923  -8.507  -3.220
  497   HG22  THR  60          HG22      THR  60 117.616  -8.244  -4.954
  498   HG23  THR  60          HG23      THR  60 118.499  -9.685  -4.393
  499    H    GLY  61           HN       GLY  61 115.269  -6.239  -4.215
  500    HA2  GLY  61           HA2      GLY  61 115.338  -5.467  -6.565
  501    HA3  GLY  61           HA1      GLY  61 114.154  -6.725  -6.898
  502    H    ASP  62           HN       ASP  62 113.175  -5.597  -3.974
  503    HA   ASP  62           HA       ASP  62 111.669  -3.441  -5.245
  504    HB2  ASP  62           HB2      ASP  62 110.233  -3.494  -3.169
  505    HB3  ASP  62           HB1      ASP  62 109.994  -4.790  -4.297
  506    H    VAL  63           HN       VAL  63 111.170  -1.588  -4.198
  507    HA   VAL  63           HA       VAL  63 113.304  -0.772  -2.441
  508    HB   VAL  63           HB       VAL  63 113.726   0.456  -4.416
  509   HG11  VAL  63          HG11      VAL  63 111.756  -0.063  -5.565
  510   HG12  VAL  63          HG12      VAL  63 112.071   1.674  -5.680
  511   HG13  VAL  63          HG13      VAL  63 110.805   1.063  -4.586
  512   HG21  VAL  63          HG21      VAL  63 112.066   2.316  -2.714
  513   HG22  VAL  63          HG22      VAL  63 113.238   2.812  -3.933
  514   HG23  VAL  63          HG23      VAL  63 113.777   1.952  -2.490
  515    H    ILE  64           HN       ILE  64 112.910  -0.111  -0.594
  516    HA   ILE  64           HA       ILE  64 110.313  -0.279   0.433
  517    HB   ILE  64           HB       ILE  64 112.914   0.415   1.810
  518   HG12  ILE  64          HG12      ILE  64 112.912  -1.840   0.914
  519   HG13  ILE  64          HG11      ILE  64 112.814  -1.894   2.668
  520   HG21  ILE  64          HG21      ILE  64 111.766  -0.064   3.934
  521   HG22  ILE  64          HG22      ILE  64 110.249  -0.263   3.060
  522   HG23  ILE  64          HG23      ILE  64 111.044   1.310   3.094
  523   HD11  ILE  64          HD11      ILE  64 111.362  -3.548   1.691
  524   HD12  ILE  64          HD12      ILE  64 110.548  -2.322   0.730
  525   HD13  ILE  64          HD13      ILE  64 110.393  -2.309   2.488
  526    H    VAL  65           HN       VAL  65 108.990   1.314   0.522
  527    HA   VAL  65           HA       VAL  65 109.765   4.093   0.157
  528    HB   VAL  65           HB       VAL  65 107.062   2.744  -0.031
  529   HG11  VAL  65          HG11      VAL  65 106.340   4.712  -1.238
  530   HG12  VAL  65          HG12      VAL  65 107.917   5.445  -1.016
  531   HG13  VAL  65          HG13      VAL  65 106.884   5.135   0.390
  532   HG21  VAL  65          HG21      VAL  65 108.970   3.474  -2.235
  533   HG22  VAL  65          HG22      VAL  65 107.326   2.872  -2.467
  534   HG23  VAL  65          HG23      VAL  65 108.549   1.846  -1.719
  535    H    SER  66           HN       SER  66 107.534   2.114   2.185
  536    HA   SER  66           HA       SER  66 107.941   4.068   4.309
  537    HB2  SER  66           HB2      SER  66 105.147   3.476   3.282
  538    HB3  SER  66           HB1      SER  66 105.552   4.434   4.705
  539    HG   SER  66           HG       SER  66 106.954   5.276   2.592
  540    H    VAL  67           HN       VAL  67 106.895   3.392   6.462
  541    HA   VAL  67           HA       VAL  67 106.579   0.540   6.657
  542    HB   VAL  67           HB       VAL  67 108.993   0.748   6.845
  543   HG11  VAL  67          HG11      VAL  67 110.121   2.070   8.485
  544   HG12  VAL  67          HG12      VAL  67 108.573   2.596   9.146
  545   HG13  VAL  67          HG13      VAL  67 109.045   3.105   7.518
  546   HG21  VAL  67          HG21      VAL  67 107.986  -0.908   8.296
  547   HG22  VAL  67          HG22      VAL  67 107.776   0.304   9.557
  548   HG23  VAL  67          HG23      VAL  67 109.399  -0.189   9.071
  549    H    ASN  68           HN       ASN  68 104.602   0.662   7.389
  550    HA   ASN  68           HA       ASN  68 102.893   0.642   8.843
  551    HB2  ASN  68           HB2      ASN  68 104.656  -0.342  10.296
  552    HB3  ASN  68           HB1      ASN  68 104.912   1.227  11.022
  553   HD21  ASN  68          HD21      ASN  68 104.136  -1.205  12.282
  554   HD22  ASN  68          HD22      ASN  68 102.582  -0.978  12.958
  555    H    ASP  69           HN       ASP  69 104.617   2.939  10.630
  556    HA   ASP  69           HA       ASP  69 102.671   5.042   9.917
  557    HB2  ASP  69           HB2      ASP  69 102.565   5.745  12.248
  558    HB3  ASP  69           HB1      ASP  69 102.079   4.059  12.095
  559    H    THR  70           HN       THR  70 105.840   4.109  10.067
  560    HA   THR  70           HA       THR  70 106.858   6.782  10.598
  561    HB   THR  70           HB       THR  70 108.297   4.124  10.339
  562    HG1  THR  70           HG1      THR  70 106.934   5.229  12.350
  563   HG21  THR  70          HG21      THR  70 110.237   5.325  11.269
  564   HG22  THR  70          HG22      THR  70 109.305   6.824  11.258
  565   HG23  THR  70          HG23      THR  70 109.725   6.036   9.738
  566    H    CYS  71           HN       CYS  71 107.731   7.958   9.023
  567    HA   CYS  71           HA       CYS  71 107.369   6.988   6.342
  568    HB2  CYS  71           HB2      CYS  71 106.594   9.258   7.177
  569    HB3  CYS  71           HB1      CYS  71 108.285   9.714   7.286
  570    HG   CYS  71           HG       CYS  71 106.414   9.136   4.538
  571    H    VAL  72           HN       VAL  72 109.046   5.435   6.447
  572    HA   VAL  72           HA       VAL  72 111.765   6.204   6.948
  573    HB   VAL  72           HB       VAL  72 110.793   3.896   7.256
  574   HG11  VAL  72          HG11      VAL  72 109.613   3.583   5.217
  575   HG12  VAL  72          HG12      VAL  72 110.859   2.340   5.338
  576   HG13  VAL  72          HG13      VAL  72 111.095   3.729   4.273
  577   HG21  VAL  72          HG21      VAL  72 113.336   4.142   5.697
  578   HG22  VAL  72          HG22      VAL  72 112.844   2.707   6.599
  579   HG23  VAL  72          HG23      VAL  72 113.143   4.225   7.445
  580    H    LEU  73           HN       LEU  73 109.741   6.794   4.568
  581    HA   LEU  73           HA       LEU  73 111.088   6.637   2.135
  582    HB2  LEU  73           HB2      LEU  73 108.672   7.065   2.754
  583    HB3  LEU  73           HB1      LEU  73 109.181   8.672   3.199
  584    HG   LEU  73           HG       LEU  73 109.634   9.243   0.955
  585   HD11  LEU  73          HD11      LEU  73 110.542   7.129   0.156
  586   HD12  LEU  73          HD12      LEU  73 109.156   7.584  -0.846
  587   HD13  LEU  73          HD13      LEU  73 108.988   6.357   0.419
  588   HD21  LEU  73          HD21      LEU  73 107.376   8.986   0.106
  589   HD22  LEU  73          HD22      LEU  73 107.381   9.383   1.824
  590   HD23  LEU  73          HD23      LEU  73 107.066   7.728   1.300
  591    H    GLY  74           HN       GLY  74 113.062   7.523   1.958
  592    HA2  GLY  74           HA2      GLY  74 114.771   9.069   1.979
  593    HA3  GLY  74           HA1      GLY  74 113.504  10.271   2.226
  594    H    HIS  75           HN       HIS  75 114.180   7.573   4.359
  595    HA   HIS  75           HA       HIS  75 114.397   9.334   6.606
  596    HB2  HIS  75           HB2      HIS  75 113.746   6.564   6.259
  597    HB3  HIS  75           HB1      HIS  75 115.335   6.631   6.972
  598    HD1  HIS  75           HD1      HIS  75 112.056   8.459   7.810
  599    HD2  HIS  75           HD2      HIS  75 115.231   6.383   9.468
  600    HE1  HIS  75           HE1      HIS  75 111.646   8.465  10.274
  601    H    THR  76           HN       THR  76 116.378   9.636   7.740
  602    HA   THR  76           HA       THR  76 118.736   9.488   6.135
  603    HB   THR  76           HB       THR  76 118.314  10.004   9.074
  604    HG1  THR  76           HG1      THR  76 117.342  11.525   7.679
  605   HG21  THR  76          HG21      THR  76 120.523  11.088   9.078
  606   HG22  THR  76          HG22      THR  76 120.778  10.586   7.401
  607   HG23  THR  76          HG23      THR  76 120.637   9.377   8.684
  608    H    HIS  77           HN       HIS  77 120.345   7.827   6.215
  609    HA   HIS  77           HA       HIS  77 119.680   5.322   6.846
  610    HB2  HIS  77           HB2      HIS  77 121.522   5.900   5.494
  611    HB3  HIS  77           HB1      HIS  77 122.477   6.421   6.890
  612    HD1  HIS  77           HD1      HIS  77 123.967   4.602   7.857
  613    HD2  HIS  77           HD2      HIS  77 120.835   3.090   5.597
  614    HE1  HIS  77           HE1      HIS  77 124.314   2.104   7.744
  615    H    ALA  78           HN       ALA  78 121.459   7.424   8.741
  616    HA   ALA  78           HA       ALA  78 122.040   5.774  10.972
  617    HB1  ALA  78           HB1      ALA  78 122.356   7.812  12.303
  618    HB2  ALA  78           HB2      ALA  78 121.557   8.757  11.045
  619    HB3  ALA  78           HB3      ALA  78 123.098   7.965  10.712
  620    H    GLN  79           HN       GLN  79 119.187   7.603  10.176
  621    HA   GLN  79           HA       GLN  79 117.973   7.207  12.663
  622    HB2  GLN  79           HB2      GLN  79 116.932   8.123  10.036
  623    HB3  GLN  79           HB1      GLN  79 115.891   8.073  11.436
  624    HG2  GLN  79           HG2      GLN  79 118.390   9.714  11.060
  625    HG3  GLN  79           HG1      GLN  79 116.733  10.327  11.089
  626   HE21  GLN  79          HE21      GLN  79 119.013  11.068  12.679
  627   HE22  GLN  79          HE22      GLN  79 118.594  10.803  14.319
  628    H    VAL  80           HN       VAL  80 117.503   5.875   9.394
  629    HA   VAL  80           HA       VAL  80 115.415   4.126  10.076
  630    HB   VAL  80           HB       VAL  80 115.685   4.652   7.693
  631   HG11  VAL  80          HG11      VAL  80 118.060   4.925   7.693
  632   HG12  VAL  80          HG12      VAL  80 117.516   3.901   6.364
  633   HG13  VAL  80          HG13      VAL  80 118.296   3.181   7.783
  634   HG21  VAL  80          HG21      VAL  80 116.291   1.731   8.148
  635   HG22  VAL  80          HG22      VAL  80 115.461   2.443   6.758
  636   HG23  VAL  80          HG23      VAL  80 114.711   2.474   8.344
  637    H    VAL  81           HN       VAL  81 118.872   3.585   9.950
  638    HA   VAL  81           HA       VAL  81 118.661   0.833  10.580
  639    HB   VAL  81           HB       VAL  81 120.750   1.715   9.611
  640   HG11  VAL  81          HG11      VAL  81 122.430   2.856  11.002
  641   HG12  VAL  81          HG12      VAL  81 121.258   2.949  12.318
  642   HG13  VAL  81          HG13      VAL  81 120.963   3.815  10.812
  643   HG21  VAL  81          HG21      VAL  81 120.853  -0.426  10.713
  644   HG22  VAL  81          HG22      VAL  81 121.136   0.355  12.261
  645   HG23  VAL  81          HG23      VAL  81 122.358   0.453  10.993
  646    H    LYS  82           HN       LYS  82 118.935   3.649  12.608
  647    HA   LYS  82           HA       LYS  82 119.234   2.382  15.046
  648    HB2  LYS  82           HB2      LYS  82 119.566   4.723  14.716
  649    HB3  LYS  82           HB1      LYS  82 117.907   4.950  14.242
  650    HG2  LYS  82           HG2      LYS  82 118.548   4.001  17.021
  651    HG3  LYS  82           HG1      LYS  82 118.734   5.704  16.620
  652    HD2  LYS  82           HD2      LYS  82 116.188   4.085  16.366
  653    HD3  LYS  82           HD1      LYS  82 116.548   5.247  17.643
  654    HE2  LYS  82           HE2      LYS  82 116.213   5.865  14.687
  655    HE3  LYS  82           HE1      LYS  82 115.092   6.252  15.979
  656    HZ1  LYS  82           HZ1      LYS  82 116.705   7.751  16.933
  657    HZ2  LYS  82           HZ2      LYS  82 116.476   8.165  15.307
  658    HZ3  LYS  82           HZ3      LYS  82 117.851   7.344  15.779
  659    H    ILE  83           HN       ILE  83 116.267   2.970  13.174
  660    HA   ILE  83           HA       ILE  83 114.517   2.225  15.342
  661    HB   ILE  83           HB       ILE  83 113.982   2.499  12.372
  662   HG12  ILE  83          HG12      ILE  83 113.390   4.394  14.653
  663   HG13  ILE  83          HG11      ILE  83 114.642   4.605  13.435
  664   HG21  ILE  83          HG21      ILE  83 111.594   2.553  12.952
  665   HG22  ILE  83          HG22      ILE  83 111.997   2.238  14.637
  666   HG23  ILE  83          HG23      ILE  83 112.335   1.017  13.411
  667   HD11  ILE  83          HD11      ILE  83 112.679   5.967  12.982
  668   HD12  ILE  83          HD12      ILE  83 111.692   4.507  12.911
  669   HD13  ILE  83          HD13      ILE  83 112.957   4.775  11.709
  670    H    PHE  84           HN       PHE  84 115.597   0.873  12.340
  671    HA   PHE  84           HA       PHE  84 114.171  -1.503  12.475
  672    HB2  PHE  84           HB2      PHE  84 116.344  -0.390  10.820
  673    HB3  PHE  84           HB1      PHE  84 115.959  -2.086  10.656
  674    HD1  PHE  84           HD1      PHE  84 114.117   1.177  10.876
  675    HD2  PHE  84           HD2      PHE  84 114.458  -2.577   8.912
  676    HE1  PHE  84           HE1      PHE  84 112.283   1.803   9.362
  677    HE2  PHE  84           HE2      PHE  84 112.637  -1.958   7.399
  678    HZ   PHE  84           HZ       PHE  84 111.539   0.230   7.619
  679    H    GLN  85           HN       GLN  85 117.383  -0.696  13.664
  680    HA   GLN  85           HA       GLN  85 117.892  -3.465  14.288
  681    HB2  GLN  85           HB2      GLN  85 119.494  -0.970  14.838
  682    HB3  GLN  85           HB1      GLN  85 120.009  -2.581  15.348
  683    HG2  GLN  85           HG2      GLN  85 119.470  -1.726  12.514
  684    HG3  GLN  85           HG1      GLN  85 121.063  -1.820  13.260
  685   HE21  GLN  85          HE21      GLN  85 118.331  -3.661  12.100
  686   HE22  GLN  85          HE22      GLN  85 119.175  -5.155  11.970
  687    H    SER  86           HN       SER  86 116.483  -0.747  15.904
  688    HA   SER  86           HA       SER  86 116.810  -1.866  18.536
  689    HB2  SER  86           HB2      SER  86 115.007   0.346  17.539
  690    HB3  SER  86           HB1      SER  86 115.209  -0.102  19.234
  691    HG   SER  86           HG       SER  86 116.931   1.163  17.466
  692    H    ILE  87           HN       ILE  87 114.763  -2.388  15.920
  693    HA   ILE  87           HA       ILE  87 112.405  -3.001  16.867
  694    HB   ILE  87           HB       ILE  87 113.994  -4.218  14.678
  695   HG12  ILE  87          HG12      ILE  87 111.634  -2.397  14.904
  696   HG13  ILE  87          HG11      ILE  87 113.190  -2.102  14.139
  697   HG21  ILE  87          HG21      ILE  87 111.265  -5.074  15.491
  698   HG22  ILE  87          HG22      ILE  87 112.688  -6.113  15.301
  699   HG23  ILE  87          HG23      ILE  87 111.918  -5.330  13.904
  700   HD11  ILE  87          HD11      ILE  87 110.971  -3.881  13.192
  701   HD12  ILE  87          HD12      ILE  87 112.531  -3.864  12.414
  702   HD13  ILE  87          HD13      ILE  87 111.521  -2.404  12.415
  703    HA   PRO  88           HA       PRO  88 112.941  -6.867  19.280
  704    HB2  PRO  88           HB2      PRO  88 110.492  -6.774  20.380
  705    HB3  PRO  88           HB1      PRO  88 111.747  -5.629  20.855
  706    HG2  PRO  88           HG2      PRO  88 109.290  -5.151  19.332
  707    HG3  PRO  88           HG1      PRO  88 110.356  -3.977  20.121
  708    HD2  PRO  88           HD2      PRO  88 110.277  -4.832  17.319
  709    HD3  PRO  88           HD1      PRO  88 111.081  -3.436  17.980
  710    H    ILE  89           HN       ILE  89 112.156  -8.927  19.236
  711    HA   ILE  89           HA       ILE  89 111.076  -9.949  16.827
  712    HB   ILE  89           HB       ILE  89 111.103 -11.337  19.519
  713   HG12  ILE  89          HG12      ILE  89 113.440 -11.110  17.594
  714   HG13  ILE  89          HG11      ILE  89 113.304 -10.292  19.135
  715   HG21  ILE  89          HG21      ILE  89 111.291 -12.373  16.708
  716   HG22  ILE  89          HG22      ILE  89 109.963 -12.594  17.851
  717   HG23  ILE  89          HG23      ILE  89 111.528 -13.361  18.150
  718   HD11  ILE  89          HD11      ILE  89 113.459 -13.249  18.705
  719   HD12  ILE  89          HD12      ILE  89 113.311 -12.411  20.260
  720   HD13  ILE  89          HD13      ILE  89 114.750 -12.171  19.264
  721    H    GLY  90           HN       GLY  90 108.912 -10.505  16.324
  722    HA2  GLY  90           HA2      GLY  90 106.735 -11.202  16.874
  723    HA3  GLY  90           HA1      GLY  90 106.991 -10.648  18.520
  724    H    ALA  91           HN       ALA  91 107.938  -8.576  16.040
  725    HA   ALA  91           HA       ALA  91 105.783  -6.810  16.981
  726    HB1  ALA  91           HB1      ALA  91 108.368  -5.895  15.691
  727    HB2  ALA  91           HB2      ALA  91 108.087  -6.054  17.414
  728    HB3  ALA  91           HB3      ALA  91 107.147  -4.899  16.482
  729    H    SER  92           HN       SER  92 105.627  -4.839  15.009
  730    HA   SER  92           HA       SER  92 104.767  -6.240  12.503
  731    HB2  SER  92           HB2      SER  92 102.411  -5.398  12.943
  732    HB3  SER  92           HB1      SER  92 102.939  -6.744  13.954
  733    HG   SER  92           HG       SER  92 101.865  -4.946  15.049
  734    H    VAL  93           HN       VAL  93 104.804  -5.073  10.735
  735    HA   VAL  93           HA       VAL  93 104.219  -2.274  10.724
  736    HB   VAL  93           HB       VAL  93 106.228  -1.651   9.411
  737   HG11  VAL  93          HG11      VAL  93 106.038  -0.872  11.650
  738   HG12  VAL  93          HG12      VAL  93 107.728  -1.221  11.289
  739   HG13  VAL  93          HG13      VAL  93 106.779  -2.331  12.290
  740   HG21  VAL  93          HG21      VAL  93 108.294  -2.946   9.664
  741   HG22  VAL  93          HG22      VAL  93 107.037  -3.819   8.793
  742   HG23  VAL  93          HG23      VAL  93 107.382  -4.227  10.468
  743    H    ASP  94           HN       ASP  94 103.731  -1.463   8.829
  744    HA   ASP  94           HA       ASP  94 103.114  -3.410   6.762
  745    HB2  ASP  94           HB2      ASP  94 101.946  -0.771   7.597
  746    HB3  ASP  94           HB1      ASP  94 101.571  -1.488   6.048
  747    H    LEU  95           HN       LEU  95 104.619  -3.374   5.259
  748    HA   LEU  95           HA       LEU  95 106.167  -0.959   4.697
  749    HB2  LEU  95           HB2      LEU  95 106.517  -3.759   3.620
  750    HB3  LEU  95           HB1      LEU  95 107.516  -2.401   3.188
  751    HG   LEU  95           HG       LEU  95 108.773  -3.665   4.666
  752   HD11  LEU  95          HD11      LEU  95 109.097  -2.311   6.627
  753   HD12  LEU  95          HD12      LEU  95 107.567  -1.511   6.319
  754   HD13  LEU  95          HD13      LEU  95 108.903  -1.319   5.175
  755   HD21  LEU  95          HD21      LEU  95 106.415  -3.805   6.524
  756   HD22  LEU  95          HD22      LEU  95 108.045  -4.432   6.829
  757   HD23  LEU  95          HD23      LEU  95 107.073  -5.111   5.525
  758    H    GLU  96           HN       GLU  96 105.682   0.303   3.169
  759    HA   GLU  96           HA       GLU  96 104.115  -0.570   0.846
  760    HB2  GLU  96           HB2      GLU  96 105.030   2.172   1.767
  761    HB3  GLU  96           HB1      GLU  96 104.086   1.883   0.316
  762    HG2  GLU  96           HG2      GLU  96 102.222   1.111   1.582
  763    HG3  GLU  96           HG1      GLU  96 103.165   1.121   3.067
  764    H    LEU  97           HN       LEU  97 105.270  -1.173  -0.912
  765    HA   LEU  97           HA       LEU  97 107.907  -0.033  -1.275
  766    HB2  LEU  97           HB2      LEU  97 108.979  -2.183  -1.526
  767    HB3  LEU  97           HB1      LEU  97 108.339  -1.963   0.084
  768    HG   LEU  97           HG       LEU  97 106.963  -3.658  -2.027
  769   HD11  LEU  97          HD11      LEU  97 108.852  -4.369   0.160
  770   HD12  LEU  97          HD12      LEU  97 109.128  -4.503  -1.577
  771   HD13  LEU  97          HD13      LEU  97 107.922  -5.536  -0.794
  772   HD21  LEU  97          HD21      LEU  97 106.709  -3.595   0.967
  773   HD22  LEU  97          HD22      LEU  97 105.815  -4.634  -0.158
  774   HD23  LEU  97          HD23      LEU  97 105.547  -2.889  -0.157
  775    H    CYS  98           HN       CYS  98 108.832  -0.486  -3.319
  776    HA   CYS  98           HA       CYS  98 106.861  -1.260  -5.341
  777    HB2  CYS  98           HB2      CYS  98 109.039   0.830  -5.639
  778    HB3  CYS  98           HB1      CYS  98 107.868   0.371  -6.868
  779    HG   CYS  98           HG       CYS  98 106.669   2.631  -6.159
  780    H    ARG  99           HN       ARG  99 107.377  -3.121  -6.090
  781    HA   ARG  99           HA       ARG  99 110.104  -4.221  -6.078
  782    HB2  ARG  99           HB2      ARG  99 108.140  -5.593  -5.351
  783    HB3  ARG  99           HB1      ARG  99 107.468  -5.451  -6.959
  784    HG2  ARG  99           HG2      ARG  99 108.427  -7.497  -7.082
  785    HG3  ARG  99           HG1      ARG  99 109.750  -6.496  -7.674
  786    HD2  ARG  99           HD2      ARG  99 111.024  -7.491  -6.096
  787    HD3  ARG  99           HD1      ARG  99 110.140  -6.551  -4.902
  788    HE   ARG  99           HE       ARG  99 109.907  -9.324  -5.489
  789   HH11  ARG  99          HH11      ARG  99 108.790  -6.776  -3.466
  790   HH12  ARG  99          HH12      ARG  99 107.415  -7.621  -2.876
  791   HH21  ARG  99          HH21      ARG  99 108.130 -10.551  -4.698
  792   HH22  ARG  99          HH22      ARG  99 107.038  -9.791  -3.595
  793    H    GLY 100           HN       GLY 100 111.253  -4.678  -7.921
  794    HA2  GLY 100           HA2      GLY 100 111.153  -5.138 -10.322
  795    HA3  GLY 100           HA1      GLY 100 109.953  -3.857 -10.441
  796    H    TYR 101           HN       TYR 101 112.332  -3.159  -8.238
  797    HA   TYR 101           HA       TYR 101 113.486  -1.174  -9.984
  798    HB2  TYR 101           HB2      TYR 101 112.664  -1.074  -7.415
  799    HB3  TYR 101           HB1      TYR 101 114.321  -1.603  -7.146
  800    HD1  TYR 101           HD1      TYR 101 112.357   0.976  -8.940
  801    HD2  TYR 101           HD2      TYR 101 116.003   0.018  -6.998
  802    HE1  TYR 101           HE1      TYR 101 113.063   3.306  -9.155
  803    HE2  TYR 101           HE2      TYR 101 116.729   2.360  -7.208
  804    HH   TYR 101           HH       TYR 101 116.254   4.237  -8.647
  805    HA   PRO 102           HA       PRO 102 116.559  -4.164 -11.046
  806    HB2  PRO 102           HB2      PRO 102 118.546  -2.453 -11.880
  807    HB3  PRO 102           HB1      PRO 102 117.154  -2.931 -12.858
  808    HG2  PRO 102           HG2      PRO 102 117.570  -0.450 -11.246
  809    HG3  PRO 102           HG1      PRO 102 116.843  -0.635 -12.852
  810    HD2  PRO 102           HD2      PRO 102 115.352  -0.299 -10.650
  811    HD3  PRO 102           HD1      PRO 102 114.814  -1.339 -11.986
  812    H    LEU 103           HN       LEU 103 118.455  -5.076 -10.350
  813    HA   LEU 103           HA       LEU 103 119.673  -3.952  -7.911
  814    HB2  LEU 103           HB2      LEU 103 118.596  -6.523  -8.457
  815    HB3  LEU 103           HB1      LEU 103 120.334  -6.717  -8.463
  816    HG   LEU 103           HG       LEU 103 119.300  -7.273  -6.301
  817   HD11  LEU 103          HD11      LEU 103 121.624  -6.541  -6.227
  818   HD12  LEU 103          HD12      LEU 103 120.794  -5.943  -4.806
  819   HD13  LEU 103          HD13      LEU 103 121.120  -4.859  -6.154
  820   HD21  LEU 103          HD21      LEU 103 117.446  -5.724  -6.463
  821   HD22  LEU 103          HD22      LEU 103 118.540  -4.362  -6.208
  822   HD23  LEU 103          HD23      LEU 103 118.289  -5.546  -4.934
  823    HA   PRO 104           HA       PRO 104 123.040  -4.046 -11.081
  824    HB2  PRO 104           HB2      PRO 104 123.534  -1.334 -11.141
  825    HB3  PRO 104           HB1      PRO 104 122.395  -2.151 -12.214
  826    HG2  PRO 104           HG2      PRO 104 121.818  -0.268 -10.115
  827    HG3  PRO 104           HG1      PRO 104 120.686  -1.051 -11.229
  828    HD2  PRO 104           HD2      PRO 104 121.375  -1.755  -8.442
  829    HD3  PRO 104           HD1      PRO 104 119.921  -2.151  -9.379
  830    H    PHE 105           HN       PHE 105 123.081  -4.482  -8.316
  831    HA   PHE 105           HA       PHE 105 125.668  -3.372  -7.517
  832    HB2  PHE 105           HB2      PHE 105 123.289  -3.689  -5.653
  833    HB3  PHE 105           HB1      PHE 105 124.875  -3.079  -5.233
  834    HD1  PHE 105           HD1      PHE 105 125.565  -0.879  -6.544
  835    HD2  PHE 105           HD2      PHE 105 121.574  -2.228  -5.977
  836    HE1  PHE 105           HE1      PHE 105 124.744   1.420  -6.870
  837    HE2  PHE 105           HE2      PHE 105 120.744   0.062  -6.309
  838    HZ   PHE 105           HZ       PHE 105 122.330   1.891  -6.758
  839    H    ASP 106           HN       ASP 106 126.777  -4.955  -6.273
  840    HA   ASP 106           HA       ASP 106 125.781  -7.655  -6.534
  841    HB2  ASP 106           HB2      ASP 106 128.149  -7.083  -6.779
  842    HB3  ASP 106           HB1      ASP 106 128.121  -6.569  -5.048
  843    HA   PRO 107           HA       PRO 107 123.728  -7.269  -2.819
  844    HB2  PRO 107           HB2      PRO 107 122.957 -10.024  -2.974
  845    HB3  PRO 107           HB1      PRO 107 122.073  -8.629  -3.600
  846    HG2  PRO 107           HG2      PRO 107 123.199 -10.550  -5.259
  847    HG3  PRO 107           HG1      PRO 107 122.979  -8.846  -5.737
  848    HD2  PRO 107           HD2      PRO 107 125.341 -10.064  -4.417
  849    HD3  PRO 107           HD1      PRO 107 125.429  -9.291  -5.907
  850    H    ASP 108           HN       ASP 108 126.481  -9.233  -3.224
  851    HA   ASP 108           HA       ASP 108 126.138 -10.303  -0.767
  852    HB2  ASP 108           HB2      ASP 108 128.226 -10.730  -2.855
  853    HB3  ASP 108           HB1      ASP 108 128.457 -11.390  -1.247
  854    H    ASP 109           HN       ASP 109 127.742  -7.952  -2.497
  855    HA   ASP 109           HA       ASP 109 130.036  -7.058  -1.395
  856    HB2  ASP 109           HB2      ASP 109 129.201  -6.159  -3.395
  857    HB3  ASP 109           HB1      ASP 109 127.789  -5.481  -2.596
  858    HA   PRO 110           HA       PRO 110 128.924  -5.133   2.627
  859    HB2  PRO 110           HB2      PRO 110 131.682  -5.832   3.093
  860    HB3  PRO 110           HB1      PRO 110 130.335  -6.316   4.076
  861    HG2  PRO 110           HG2      PRO 110 131.686  -8.086   2.626
  862    HG3  PRO 110           HG1      PRO 110 129.909  -8.176   2.584
  863    HD2  PRO 110           HD2      PRO 110 131.750  -6.805   0.623
  864    HD3  PRO 110           HD1      PRO 110 130.491  -8.031   0.299
  865    H    ASN 111           HN       ASN 111 131.211  -4.207   3.838
  866    HA   ASN 111           HA       ASN 111 132.860  -3.019   3.988
  867    HB2  ASN 111           HB2      ASN 111 133.035  -2.790   1.004
  868    HB3  ASN 111           HB1      ASN 111 134.227  -2.196   2.152
  869   HD21  ASN 111          HD21      ASN 111 133.894  -4.577   3.920
  870   HD22  ASN 111          HD22      ASN 111 134.711  -5.844   3.104
  871    H    THR 112           HN       THR 112 131.724  -1.455   5.015
  872    HA   THR 112           HA       THR 112 131.063   0.936   3.460
  873    HB   THR 112           HB       THR 112 129.010  -0.370   4.243
  874    HG1  THR 112           HG1      THR 112 129.427   2.228   4.279
  875   HG21  THR 112          HG21      THR 112 128.424  -0.159   6.649
  876   HG22  THR 112          HG22      THR 112 130.044   0.514   6.921
  877   HG23  THR 112          HG23      THR 112 129.866  -1.156   6.385
  878    H    SER 113           HN       SER 113 131.300   2.906   4.730
  879    HA   SER 113           HA       SER 113 132.467   2.628   7.333
  880    HB2  SER 113           HB2      SER 113 133.200   4.606   5.193
  881    HB3  SER 113           HB1      SER 113 133.825   4.371   6.837
  882    HG   SER 113           HG       SER 113 134.669   2.440   6.266
  883    H    LEU 114           HN       LEU 114 130.639   3.330   8.422
  884    HA   LEU 114           HA       LEU 114 128.873   5.129   7.091
  885    HB2  LEU 114           HB2      LEU 114 128.709   3.956   9.846
  886    HB3  LEU 114           HB1      LEU 114 127.453   4.869   9.037
  887    HG   LEU 114           HG       LEU 114 128.455   2.120   8.302
  888   HD11  LEU 114          HD11      LEU 114 125.830   3.196   9.134
  889   HD12  LEU 114          HD12      LEU 114 126.944   2.298  10.190
  890   HD13  LEU 114          HD13      LEU 114 126.185   1.501   8.781
  891   HD21  LEU 114          HD21      LEU 114 127.985   3.362   6.261
  892   HD22  LEU 114          HD22      LEU 114 126.418   3.842   6.914
  893   HD23  LEU 114          HD23      LEU 114 126.744   2.144   6.559
  894    H    VAL 115           HN       VAL 115 128.939   7.127   7.214
  895    HA   VAL 115           HA       VAL 115 130.184   8.350   9.528
  896    HB   VAL 115           HB       VAL 115 130.244   9.433   6.682
  897   HG11  VAL 115          HG11      VAL 115 131.535  10.504   9.190
  898   HG12  VAL 115          HG12      VAL 115 130.168  11.214   8.333
  899   HG13  VAL 115          HG13      VAL 115 131.755  11.151   7.564
  900   HG21  VAL 115          HG21      VAL 115 132.492   8.276   8.329
  901   HG22  VAL 115          HG22      VAL 115 132.672   9.031   6.744
  902   HG23  VAL 115          HG23      VAL 115 131.757   7.532   6.910
  903    H    THR 116           HN       THR 116 128.516   9.170  10.613
  904    HA   THR 116           HA       THR 116 126.063   9.825   9.320
  905    HB   THR 116           HB       THR 116 126.243   8.924  11.695
  906    HG1  THR 116           HG1      THR 116 124.338   9.664  11.627
  907   HG21  THR 116          HG21      THR 116 128.112  10.315  12.452
  908   HG22  THR 116          HG22      THR 116 126.710  10.528  13.511
  909   HG23  THR 116          HG23      THR 116 127.105  11.754  12.299
  910    H    SER 117           HN       SER 117 125.207  11.972   9.155
  911    HA   SER 117           HA       SER 117 127.377  13.869   8.686
  912    HB2  SER 117           HB2      SER 117 124.555  13.948   7.653
  913    HB3  SER 117           HB1      SER 117 125.929  14.924   7.114
  914    HG   SER 117           HG       SER 117 126.961  12.841   6.689
  915    H    VAL 118           HN       VAL 118 127.550  15.697   9.636
  916    HA   VAL 118           HA       VAL 118 125.362  16.734  11.202
  917    HB   VAL 118           HB       VAL 118 126.808  15.556  12.793
  918   HG11  VAL 118          HG11      VAL 118 128.866  15.520  11.536
  919   HG12  VAL 118          HG12      VAL 118 129.141  16.148  13.164
  920   HG13  VAL 118          HG13      VAL 118 129.081  17.253  11.790
  921   HG21  VAL 118          HG21      VAL 118 127.400  17.439  14.297
  922   HG22  VAL 118          HG22      VAL 118 125.781  17.563  13.612
  923   HG23  VAL 118          HG23      VAL 118 127.086  18.549  12.961
  924    H    ALA 119           HN       ALA 119 125.020  18.777  10.690
  925    HA   ALA 119           HA       ALA 119 127.007  20.061   8.992
  926    HB1  ALA 119           HB1      ALA 119 125.194  21.401   8.109
  927    HB2  ALA 119           HB2      ALA 119 124.083  20.724   9.294
  928    HB3  ALA 119           HB3      ALA 119 124.760  19.693   8.034
  929    H    ILE 120           HN       ILE 120 128.315  20.721  10.747
  930    HA   ILE 120           HA       ILE 120 127.214  22.962  12.299
  931    HB   ILE 120           HB       ILE 120 130.020  21.801  12.353
  932   HG12  ILE 120          HG12      ILE 120 128.488  20.034  13.031
  933   HG13  ILE 120          HG11      ILE 120 129.414  20.593  14.414
  934   HG21  ILE 120          HG21      ILE 120 128.569  23.583  14.305
  935   HG22  ILE 120          HG22      ILE 120 129.908  24.039  13.249
  936   HG23  ILE 120          HG23      ILE 120 130.170  22.898  14.569
  937   HD11  ILE 120          HD11      ILE 120 127.495  21.899  15.171
  938   HD12  ILE 120          HD12      ILE 120 127.097  20.187  15.008
  939   HD13  ILE 120          HD13      ILE 120 126.567  21.337  13.780
  940    H    LEU 121           HN       LEU 121 129.500  21.908   9.957
  941    HA   LEU 121           HA       LEU 121 129.819  24.596   8.884
  942    HB2  LEU 121           HB2      LEU 121 131.804  22.442   9.365
  943    HB3  LEU 121           HB1      LEU 121 132.117  23.718   8.194
  944    HG   LEU 121           HG       LEU 121 131.655  24.123  11.152
  945   HD11  LEU 121          HD11      LEU 121 134.200  24.203   9.527
  946   HD12  LEU 121          HD12      LEU 121 133.766  22.958  10.700
  947   HD13  LEU 121          HD13      LEU 121 134.054  24.610  11.234
  948   HD21  LEU 121          HD21      LEU 121 130.986  26.046   9.809
  949   HD22  LEU 121          HD22      LEU 121 132.541  26.017   8.980
  950   HD23  LEU 121          HD23      LEU 121 132.467  26.398  10.698
  951    H    ASP 122           HN       ASP 122 130.674  24.369   6.674
  952    HA   ASP 122           HA       ASP 122 130.367  23.855   4.553
  953    HB2  ASP 122           HB2      ASP 122 131.828  22.065   4.982
  954    HB3  ASP 122           HB1      ASP 122 130.541  21.007   5.562
  955    H    LYS 123           HN       LYS 123 128.442  24.883   4.821
  956    HA   LYS 123           HA       LYS 123 126.232  23.213   3.903
  957    HB2  LYS 123           HB2      LYS 123 126.107  25.783   5.509
  958    HB3  LYS 123           HB1      LYS 123 124.741  25.140   4.639
  959    HG2  LYS 123           HG2      LYS 123 124.381  24.510   6.867
  960    HG3  LYS 123           HG1      LYS 123 124.999  23.056   6.097
  961    HD2  LYS 123           HD2      LYS 123 126.017  23.355   8.285
  962    HD3  LYS 123           HD1      LYS 123 127.232  23.545   7.023
  963    HE2  LYS 123           HE2      LYS 123 127.454  25.223   8.811
  964    HE3  LYS 123           HE1      LYS 123 127.132  25.961   7.251
  965    HZ1  LYS 123           HZ1      LYS 123 125.887  26.955   9.044
  966    HZ2  LYS 123           HZ2      LYS 123 125.075  25.513   9.369
  967    HZ3  LYS 123           HZ3      LYS 123 124.855  26.315   7.895
  968    H    GLU 124           HN       GLU 124 125.522  23.754   1.961
  969    HA   GLU 124           HA       GLU 124 127.030  25.706   0.524
  970    HB2  GLU 124           HB2      GLU 124 125.781  24.932  -1.467
  971    HB3  GLU 124           HB1      GLU 124 126.567  23.621  -0.618
  972    HG2  GLU 124           HG2      GLU 124 123.651  24.238  -0.197
  973    HG3  GLU 124           HG1      GLU 124 124.192  23.254  -1.547
  974    HA   PRO 125           HA       PRO 125 123.707  28.687   0.890
  975    HB2  PRO 125           HB2      PRO 125 125.239  30.887   0.657
  976    HB3  PRO 125           HB1      PRO 125 125.201  29.957   2.158
  977    HG2  PRO 125           HG2      PRO 125 127.333  30.143   0.122
  978    HG3  PRO 125           HG1      PRO 125 127.441  29.716   1.834
  979    HD2  PRO 125           HD2      PRO 125 127.394  27.950  -0.425
  980    HD3  PRO 125           HD1      PRO 125 127.479  27.537   1.298
  981    H1   ARG 151           HT1      ARG 151 130.059   1.163  -6.303
  982    H2   ARG 151           HT2      ARG 151 129.816   0.179  -4.956
  983    H3   ARG 151           HT3      ARG 151 130.793  -0.343  -6.220
  984    HA   ARG 151           HA       ARG 151 131.526   1.143  -3.966
  985    HB2  ARG 151           HB2      ARG 151 133.069   0.255  -6.418
  986    HB3  ARG 151           HB1      ARG 151 133.795   0.824  -4.922
  987    HG2  ARG 151           HG2      ARG 151 131.994  -1.576  -5.085
  988    HG3  ARG 151           HG1      ARG 151 133.751  -1.666  -5.166
  989    HD2  ARG 151           HD2      ARG 151 133.956  -0.750  -2.967
  990    HD3  ARG 151           HD1      ARG 151 132.231  -0.421  -2.869
  991    HE   ARG 151           HE       ARG 151 131.933  -2.891  -2.975
  992   HH11  ARG 151          HH11      ARG 151 134.997  -1.601  -1.753
  993   HH12  ARG 151          HH12      ARG 151 135.278  -2.949  -0.747
  994   HH21  ARG 151          HH21      ARG 151 132.285  -4.600  -1.651
  995   HH22  ARG 151          HH22      ARG 151 133.681  -4.708  -0.641
  996    H    SER 152           HN       SER 152 131.083   3.188  -3.760
  997    HA   SER 152           HA       SER 152 132.347   5.130  -5.440
  998    HB2  SER 152           HB2      SER 152 129.314   5.192  -5.180
  999    HB3  SER 152           HB1      SER 152 130.317   6.370  -6.020
 1000    HG   SER 152           HG       SER 152 130.929   4.063  -7.070
 1001    H    SER 153           HN       SER 153 129.626   4.808  -3.129
 1002    HA   SER 153           HA       SER 153 131.133   6.072  -1.094
 1003    HB2  SER 153           HB2      SER 153 129.213   7.773  -0.751
 1004    HB3  SER 153           HB1      SER 153 130.369   8.094  -2.042
 1005    HG   SER 153           HG       SER 153 128.452   8.383  -2.966
 1006    H    ARG 154           HN       ARG 154 130.777   4.828   0.593
 1007    HA   ARG 154           HA       ARG 154 128.057   3.887   1.008
 1008    HB2  ARG 154           HB2      ARG 154 129.553   2.073   0.035
 1009    HB3  ARG 154           HB1      ARG 154 130.493   2.164   1.519
 1010    HG2  ARG 154           HG2      ARG 154 128.997   0.329   1.730
 1011    HG3  ARG 154           HG1      ARG 154 128.416   1.617   2.782
 1012    HD2  ARG 154           HD2      ARG 154 126.485   0.829   1.727
 1013    HD3  ARG 154           HD1      ARG 154 126.898   2.277   0.822
 1014    HE   ARG 154           HE       ARG 154 127.545  -0.443  -0.026
 1015   HH11  ARG 154          HH11      ARG 154 126.848   2.891  -0.940
 1016   HH12  ARG 154          HH12      ARG 154 126.311   2.527  -2.509
 1017   HH21  ARG 154          HH21      ARG 154 126.816  -0.978  -2.203
 1018   HH22  ARG 154          HH22      ARG 154 126.302   0.253  -3.262
 1019    H    THR 155           HN       THR 155 128.178   5.854   2.300
 1020    HA   THR 155           HA       THR 155 129.361   5.501   5.002
 1021    HB   THR 155           HB       THR 155 128.842   8.000   5.074
 1022    HG1  THR 155           HG1      THR 155 128.457   8.979   3.074
 1023   HG21  THR 155          HG21      THR 155 130.828   8.653   3.784
 1024   HG22  THR 155          HG22      THR 155 130.808   7.095   2.958
 1025   HG23  THR 155          HG23      THR 155 131.144   7.171   4.688
 1026    H    ARG 156           HN       ARG 156 126.593   5.368   3.226
 1027    HA   ARG 156           HA       ARG 156 125.009   4.971   5.632
 1028    HB2  ARG 156           HB2      ARG 156 124.097   6.500   3.166
 1029    HB3  ARG 156           HB1      ARG 156 123.074   6.049   4.498
 1030    HG2  ARG 156           HG2      ARG 156 123.391   8.285   4.950
 1031    HG3  ARG 156           HG1      ARG 156 124.744   7.604   5.849
 1032    HD2  ARG 156           HD2      ARG 156 126.276   8.149   4.100
 1033    HD3  ARG 156           HD1      ARG 156 124.964   8.583   3.009
 1034    HE   ARG 156           HE       ARG 156 125.821  10.118   5.367
 1035   HH11  ARG 156          HH11      ARG 156 123.946   9.980   2.303
 1036   HH12  ARG 156          HH12      ARG 156 123.832  11.611   2.120
 1037   HH21  ARG 156          HH21      ARG 156 125.619  12.497   5.070
 1038   HH22  ARG 156          HH22      ARG 156 124.841  13.082   3.676
 1039    H    ARG 157           HN       ARG 157 122.594   4.343   3.703
 1040    HA   ARG 157           HA       ARG 157 121.952   3.123   2.222
 1041    HB2  ARG 157           HB2      ARG 157 124.791   2.782   1.345
 1042    HB3  ARG 157           HB1      ARG 157 123.434   2.027   0.507
 1043    HG2  ARG 157           HG2      ARG 157 122.440   4.159   0.062
 1044    HG3  ARG 157           HG1      ARG 157 123.632   4.975   1.063
 1045    HD2  ARG 157           HD2      ARG 157 125.376   4.409  -0.505
 1046    HD3  ARG 157           HD1      ARG 157 124.236   3.462  -1.465
 1047    HE   ARG 157           HE       ARG 157 122.988   5.683  -1.553
 1048   HH11  ARG 157          HH11      ARG 157 126.547   5.462  -1.629
 1049   HH12  ARG 157          HH12      ARG 157 126.755   6.784  -2.642
 1050   HH21  ARG 157          HH21      ARG 157 123.276   7.466  -2.918
 1051   HH22  ARG 157          HH22      ARG 157 124.831   7.990  -3.438
 1052    H    GLU 158           HN       GLU 158 124.666   1.154   3.524
 1053    HA   GLU 158           HA       GLU 158 122.784  -0.993   3.178
 1054    HB2  GLU 158           HB2      GLU 158 124.640  -2.561   3.767
 1055    HB3  GLU 158           HB1      GLU 158 124.862  -1.606   2.319
 1056    HG2  GLU 158           HG2      GLU 158 126.365  -0.107   3.574
 1057    HG3  GLU 158           HG1      GLU 158 126.153  -1.136   4.992
 1058    H    THR 159           HN       THR 159 121.278  -1.005   4.543
 1059    HA   THR 159           HA       THR 159 121.864  -1.203   7.403
 1060    HB   THR 159           HB       THR 159 119.116  -1.165   6.127
 1061    HG1  THR 159           HG1      THR 159 120.975   0.892   6.272
 1062   HG21  THR 159          HG21      THR 159 120.150  -0.172   8.790
 1063   HG22  THR 159          HG22      THR 159 119.215  -1.641   8.547
 1064   HG23  THR 159          HG23      THR 159 118.482  -0.064   8.260
 1065    H    GLN 160           HN       GLN 160 122.060  -3.278   8.128
 1066    HA   GLN 160           HA       GLN 160 120.746  -5.398   6.622
 1067    HB2  GLN 160           HB2      GLN 160 123.041  -5.887   6.940
 1068    HB3  GLN 160           HB1      GLN 160 122.999  -5.404   8.636
 1069    HG2  GLN 160           HG2      GLN 160 121.706  -7.387   9.150
 1070    HG3  GLN 160           HG1      GLN 160 121.673  -7.837   7.446
 1071   HE21  GLN 160          HE21      GLN 160 123.663  -7.460  10.250
 1072   HE22  GLN 160          HE22      GLN 160 124.976  -8.438   9.701
 1073    H    VAL 161           HN       VAL 161 118.812  -6.080   7.333
 1074    HA   VAL 161           HA       VAL 161 118.305  -5.693  10.139
 1075    HB   VAL 161           HB       VAL 161 115.990  -5.022   9.675
 1076   HG11  VAL 161          HG11      VAL 161 116.354  -2.874   8.689
 1077   HG12  VAL 161          HG12      VAL 161 117.950  -3.377   8.148
 1078   HG13  VAL 161          HG13      VAL 161 117.605  -3.238   9.892
 1079   HG21  VAL 161          HG21      VAL 161 116.776  -5.021   6.782
 1080   HG22  VAL 161          HG22      VAL 161 115.253  -4.445   7.438
 1081   HG23  VAL 161          HG23      VAL 161 115.670  -6.163   7.541
  Start of MODEL    8
    1    H1   GLY  -3           HT1      GLY  -3 119.499  14.312 -23.252
    2    H2   GLY  -3           HT2      GLY  -3 120.694  14.717 -22.108
    3    H3   GLY  -3           HT3      GLY  -3 119.636  15.903 -22.698
    4    HA2  GLY  -3           HA1      GLY  -3 117.796  14.854 -21.643
    5    HA3  GLY  -3           HA2      GLY  -3 118.877  13.592 -21.054
    6    H    ALA  -2           HN       ALA  -2 117.634  16.722 -20.552
    7    HA   ALA  -2           HA       ALA  -2 119.651  17.604 -18.731
    8    HB1  ALA  -2           HB1      ALA  -2 118.113  19.443 -18.243
    9    HB2  ALA  -2           HB2      ALA  -2 116.839  18.625 -19.144
   10    HB3  ALA  -2           HB3      ALA  -2 118.280  19.204 -19.981
   11    H    MET  -1           HN       MET  -1 116.715  15.770 -18.525
   12    HA   MET  -1           HA       MET  -1 116.802  15.856 -15.613
   13    HB2  MET  -1           HB2      MET  -1 114.666  14.829 -17.509
   14    HB3  MET  -1           HB1      MET  -1 114.604  14.587 -15.779
   15    HG2  MET  -1           HG2      MET  -1 113.176  16.418 -16.340
   16    HG3  MET  -1           HG1      MET  -1 114.564  17.048 -15.474
   17    HE1  MET  -1           HE1      MET  -1 113.905  17.490 -20.030
   18    HE2  MET  -1           HE2      MET  -1 112.754  16.736 -18.930
   19    HE3  MET  -1           HE3      MET  -1 114.299  15.952 -19.261
   20    H    GLY   0           HN       GLY   0 118.917  14.676 -16.342
   21    HA2  GLY   0           HA2      GLY   0 118.335  11.833 -16.452
   22    HA3  GLY   0           HA1      GLY   0 119.859  12.549 -16.979
   23    H    LYS   1           HN       LYS   1 118.061  13.198 -14.021
   24    HA   LYS   1           HA       LYS   1 120.386  12.324 -12.472
   25    HB2  LYS   1           HB2      LYS   1 118.236  14.378 -11.835
   26    HB3  LYS   1           HB1      LYS   1 119.378  13.805 -10.655
   27    HG2  LYS   1           HG2      LYS   1 120.248  15.861 -11.333
   28    HG3  LYS   1           HG1      LYS   1 121.190  14.674 -12.218
   29    HD2  LYS   1           HD2      LYS   1 120.587  16.564 -13.650
   30    HD3  LYS   1           HD1      LYS   1 119.828  15.077 -14.214
   31    HE2  LYS   1           HE2      LYS   1 118.299  17.006 -14.285
   32    HE3  LYS   1           HE1      LYS   1 117.710  15.735 -13.232
   33    HZ1  LYS   1           HZ1      LYS   1 117.405  17.889 -12.269
   34    HZ2  LYS   1           HZ2      LYS   1 119.024  18.262 -12.397
   35    HZ3  LYS   1           HZ3      LYS   1 118.526  17.056 -11.322
   36    HA   PRO   2           HA       PRO   2 117.800   9.269 -10.548
   37    HB2  PRO   2           HB2      PRO   2 118.395   9.603  -7.878
   38    HB3  PRO   2           HB1      PRO   2 119.363   8.658  -9.016
   39    HG2  PRO   2           HG2      PRO   2 119.737  11.433  -8.016
   40    HG3  PRO   2           HG1      PRO   2 120.987  10.205  -8.341
   41    HD2  PRO   2           HD2      PRO   2 120.481  12.279 -10.006
   42    HD3  PRO   2           HD1      PRO   2 121.004  10.726 -10.649
   43    H    PHE   3           HN       PHE   3 115.789   9.259  -9.947
   44    HA   PHE   3           HA       PHE   3 114.598  11.801  -9.567
   45    HB2  PHE   3           HB2      PHE   3 112.470  10.617  -9.969
   46    HB3  PHE   3           HB1      PHE   3 113.634  10.450 -11.277
   47    HD1  PHE   3           HD2      PHE   3 114.760   8.278 -11.603
   48    HD2  PHE   3           HD1      PHE   3 111.701   8.848  -8.765
   49    HE1  PHE   3           HE2      PHE   3 114.443   5.824 -11.487
   50    HE2  PHE   3           HE1      PHE   3 111.336   6.444  -8.612
   51    HZ   PHE   3           HZ       PHE   3 112.721   4.893  -9.979
   52    H    PHE   4           HN       PHE   4 113.713  12.551  -7.945
   53    HA   PHE   4           HA       PHE   4 112.824  10.987  -5.706
   54    HB2  PHE   4           HB2      PHE   4 114.991  11.413  -4.809
   55    HB3  PHE   4           HB1      PHE   4 114.982  13.037  -5.520
   56    HD1  PHE   4           HD2      PHE   4 113.422  11.004  -2.835
   57    HD2  PHE   4           HD1      PHE   4 114.165  14.884  -4.391
   58    HE1  PHE   4           HE2      PHE   4 112.434  12.020  -0.825
   59    HE2  PHE   4           HE1      PHE   4 113.174  15.893  -2.442
   60    HZ   PHE   4           HZ       PHE   4 112.308  14.452  -0.609
   61    H    THR   5           HN       THR   5 111.010  11.731  -5.113
   62    HA   THR   5           HA       THR   5 110.695  14.368  -4.237
   63    HB   THR   5           HB       THR   5 110.266  14.744  -6.598
   64    HG1  THR   5           HG1      THR   5 109.183  16.086  -5.205
   65   HG21  THR   5          HG21      THR   5 107.866  12.920  -6.294
   66   HG22  THR   5          HG22      THR   5 109.314  12.564  -7.212
   67   HG23  THR   5          HG23      THR   5 108.237  13.868  -7.740
   68    H    ARG   6           HN       ARG   6 110.742  11.829  -3.166
   69    HA   ARG   6           HA       ARG   6 109.804  10.424  -1.608
   70    HB2  ARG   6           HB2      ARG   6 108.720  11.515   0.157
   71    HB3  ARG   6           HB1      ARG   6 109.879  12.600  -0.602
   72    HG2  ARG   6           HG2      ARG   6 108.122  13.813  -1.697
   73    HG3  ARG   6           HG1      ARG   6 106.907  12.715  -1.029
   74    HD2  ARG   6           HD2      ARG   6 107.771  13.185   1.124
   75    HD3  ARG   6           HD1      ARG   6 108.827  14.399   0.349
   76    HE   ARG   6           HE       ARG   6 106.379  15.191  -0.452
   77   HH11  ARG   6          HH11      ARG   6 107.585  14.555   2.809
   78   HH12  ARG   6          HH12      ARG   6 106.457  15.555   3.582
   79   HH21  ARG   6          HH21      ARG   6 104.856  16.586   0.607
   80   HH22  ARG   6          HH22      ARG   6 104.889  16.778   2.298
   81    H    ASN   7           HN       ASN   7 108.584  10.627  -3.995
   82    HA   ASN   7           HA       ASN   7 105.873   9.633  -3.430
   83    HB2  ASN   7           HB2      ASN   7 107.076  10.750  -5.865
   84    HB3  ASN   7           HB1      ASN   7 105.863   9.502  -6.100
   85   HD21  ASN   7          HD21      ASN   7 106.500  12.638  -4.923
   86   HD22  ASN   7          HD22      ASN   7 104.859  13.174  -4.774
   87    HA   PRO   8           HA       PRO   8 107.142   5.232  -3.892
   88    HB2  PRO   8           HB2      PRO   8 104.320   5.059  -4.149
   89    HB3  PRO   8           HB1      PRO   8 105.260   4.219  -2.996
   90    HG2  PRO   8           HG2      PRO   8 103.583   6.445  -2.724
   91    HG3  PRO   8           HG1      PRO   8 104.597   5.794  -1.410
   92    HD2  PRO   8           HD2      PRO   8 104.758   8.247  -2.616
   93    HD3  PRO   8           HD1      PRO   8 106.063   7.529  -1.654
   94    H    SER   9           HN       SER   9 104.674   7.170  -5.213
   95    HA   SER   9           HA       SER   9 103.963   5.586  -7.159
   96    HB2  SER   9           HB2      SER   9 102.610   7.269  -6.280
   97    HB3  SER   9           HB1      SER   9 103.656   8.551  -6.885
   98    HG   SER   9           HG       SER   9 102.486   6.693  -8.662
   99    H    GLU  10           HN       GLU  10 106.668   7.900  -6.945
  100    HA   GLU  10           HA       GLU  10 107.049   8.202  -9.782
  101    HB2  GLU  10           HB2      GLU  10 109.032   9.470  -9.272
  102    HB3  GLU  10           HB1      GLU  10 107.798   9.989  -8.123
  103    HG2  GLU  10           HG2      GLU  10 108.899   8.391  -6.493
  104    HG3  GLU  10           HG1      GLU  10 110.192   8.227  -7.668
  105    H    LEU  11           HN       LEU  11 108.185   6.257  -7.162
  106    HA   LEU  11           HA       LEU  11 110.173   4.832  -8.534
  107    HB2  LEU  11           HB2      LEU  11 108.356   4.043  -6.269
  108    HB3  LEU  11           HB1      LEU  11 109.648   3.019  -6.863
  109    HG   LEU  11           HG       LEU  11 110.088   5.789  -5.732
  110   HD11  LEU  11          HD11      LEU  11 109.216   4.269  -4.044
  111   HD12  LEU  11          HD12      LEU  11 110.925   4.628  -3.761
  112   HD13  LEU  11          HD13      LEU  11 110.448   3.085  -4.479
  113   HD21  LEU  11          HD21      LEU  11 111.982   3.534  -6.376
  114   HD22  LEU  11          HD22      LEU  11 112.428   5.076  -5.645
  115   HD23  LEU  11          HD23      LEU  11 111.823   5.021  -7.298
  116    H    LYS  12           HN       LYS  12 110.129   3.261  -9.782
  117    HA   LYS  12           HA       LYS  12 107.747   2.829 -11.379
  118    HB2  LYS  12           HB2      LYS  12 109.195   1.661 -12.909
  119    HB3  LYS  12           HB1      LYS  12 109.879   3.217 -12.461
  120    HG2  LYS  12           HG2      LYS  12 111.502   2.285 -11.123
  121    HG3  LYS  12           HG1      LYS  12 110.593   0.775 -10.979
  122    HD2  LYS  12           HD2      LYS  12 111.654   1.779 -13.566
  123    HD3  LYS  12           HD1      LYS  12 112.675   0.753 -12.499
  124    HE2  LYS  12           HE2      LYS  12 110.953  -0.999 -12.725
  125    HE3  LYS  12           HE1      LYS  12 110.011   0.053 -13.773
  126    HZ1  LYS  12           HZ1      LYS  12 111.847   0.069 -15.330
  127    HZ2  LYS  12           HZ2      LYS  12 111.317  -1.504 -15.073
  128    HZ3  LYS  12           HZ3      LYS  12 112.744  -0.969 -14.371
  129    H    GLY  13           HN       GLY  13 107.808   0.532 -12.390
  130    HA2  GLY  13           HA2      GLY  13 107.493  -1.767 -12.103
  131    HA3  GLY  13           HA1      GLY  13 108.016  -1.586 -10.435
  132    H    LYS  14           HN       LYS  14 106.560  -1.843  -8.949
  133    HA   LYS  14           HA       LYS  14 103.736  -1.195  -9.345
  134    HB2  LYS  14           HB2      LYS  14 103.110  -3.444  -8.470
  135    HB3  LYS  14           HB1      LYS  14 103.831  -3.495 -10.084
  136    HG2  LYS  14           HG2      LYS  14 105.955  -3.734  -8.385
  137    HG3  LYS  14           HG1      LYS  14 104.704  -4.707  -7.596
  138    HD2  LYS  14           HD2      LYS  14 105.542  -4.901 -10.456
  139    HD3  LYS  14           HD1      LYS  14 106.161  -5.963  -9.190
  140    HE2  LYS  14           HE2      LYS  14 103.829  -6.728  -8.770
  141    HE3  LYS  14           HE1      LYS  14 103.281  -5.732 -10.113
  142    HZ1  LYS  14           HZ1      LYS  14 104.687  -7.068 -11.600
  143    HZ2  LYS  14           HZ2      LYS  14 103.584  -8.035 -10.791
  144    HZ3  LYS  14           HZ3      LYS  14 105.173  -8.023 -10.307
  145    H    PHE  15           HN       PHE  15 102.616  -0.996  -7.347
  146    HA   PHE  15           HA       PHE  15 104.419  -0.426  -5.130
  147    HB2  PHE  15           HB2      PHE  15 103.490   1.495  -6.332
  148    HB3  PHE  15           HB1      PHE  15 101.884   0.846  -6.078
  149    HD1  PHE  15           HD1      PHE  15 104.056   0.532  -3.239
  150    HD2  PHE  15           HD2      PHE  15 101.468   3.157  -5.301
  151    HE1  PHE  15           HE1      PHE  15 103.925   1.969  -1.213
  152    HE2  PHE  15           HE2      PHE  15 101.313   4.615  -3.317
  153    HZ   PHE  15           HZ       PHE  15 102.538   4.040  -1.278
  154    H    ILE  16           HN       ILE  16 104.058  -1.804  -3.501
  155    HA   ILE  16           HA       ILE  16 101.355  -2.705  -3.008
  156    HB   ILE  16           HB       ILE  16 102.264  -4.883  -2.229
  157   HG12  ILE  16          HG12      ILE  16 104.690  -4.265  -2.318
  158   HG13  ILE  16          HG11      ILE  16 104.311  -5.806  -3.051
  159   HG21  ILE  16          HG21      ILE  16 102.218  -4.327  -5.156
  160   HG22  ILE  16          HG22      ILE  16 100.873  -4.720  -4.079
  161   HG23  ILE  16          HG23      ILE  16 102.109  -5.940  -4.422
  162   HD11  ILE  16          HD11      ILE  16 104.508  -4.851  -5.282
  163   HD12  ILE  16          HD12      ILE  16 105.981  -4.501  -4.380
  164   HD13  ILE  16          HD13      ILE  16 104.755  -3.248  -4.621
  165    H    HIS  17           HN       HIS  17 100.891  -3.294  -0.941
  166    HA   HIS  17           HA       HIS  17 102.914  -2.577   0.990
  167    HB2  HIS  17           HB2      HIS  17 101.279  -1.393   2.394
  168    HB3  HIS  17           HB1      HIS  17 101.371  -0.706   0.774
  169    HD1  HIS  17           HD1      HIS  17  98.937  -0.329   2.801
  170    HD2  HIS  17           HD2      HIS  17  99.109  -2.957  -0.389
  171    HE1  HIS  17           HE1      HIS  17  96.546  -0.786   2.169
  172    H    THR  18           HN       THR  18 103.415  -4.245   2.009
  173    HA   THR  18           HA       THR  18 101.307  -6.139   2.754
  174    HB   THR  18           HB       THR  18 102.610  -6.941   0.760
  175    HG1  THR  18           HG1      THR  18 102.901  -8.573   3.090
  176   HG21  THR  18          HG21      THR  18 104.910  -7.132   2.718
  177   HG22  THR  18          HG22      THR  18 104.826  -6.059   1.321
  178   HG23  THR  18          HG23      THR  18 104.900  -7.807   1.088
  179    H    LYS  19           HN       LYS  19 101.523  -7.087   4.740
  180    HA   LYS  19           HA       LYS  19 103.024  -5.658   6.692
  181    HB2  LYS  19           HB2      LYS  19 100.758  -6.451   7.129
  182    HB3  LYS  19           HB1      LYS  19 101.238  -8.099   6.825
  183    HG2  LYS  19           HG2      LYS  19 102.261  -6.488   9.181
  184    HG3  LYS  19           HG1      LYS  19 100.795  -7.455   9.246
  185    HD2  LYS  19           HD2      LYS  19 102.375  -9.402   8.435
  186    HD3  LYS  19           HD1      LYS  19 103.659  -8.352   9.023
  187    HE2  LYS  19           HE2      LYS  19 103.102  -9.869  10.750
  188    HE3  LYS  19           HE1      LYS  19 102.536  -8.273  11.216
  189    HZ1  LYS  19           HZ1      LYS  19 100.817 -10.380  10.016
  190    HZ2  LYS  19           HZ2      LYS  19 100.275  -8.913  10.613
  191    HZ3  LYS  19           HZ3      LYS  19 100.909 -10.073  11.661
  192    H    LEU  20           HN       LEU  20 104.918  -6.167   7.628
  193    HA   LEU  20           HA       LEU  20 105.900  -8.854   7.145
  194    HB2  LEU  20           HB2      LEU  20 107.264  -6.435   6.426
  195    HB3  LEU  20           HB1      LEU  20 108.125  -7.172   7.782
  196    HG   LEU  20           HG       LEU  20 108.413  -9.228   6.594
  197   HD11  LEU  20          HD11      LEU  20 106.395  -9.277   5.251
  198   HD12  LEU  20          HD12      LEU  20 107.841  -9.541   4.311
  199   HD13  LEU  20          HD13      LEU  20 107.027  -7.965   4.242
  200   HD21  LEU  20          HD21      LEU  20 109.941  -8.461   4.888
  201   HD22  LEU  20          HD22      LEU  20 110.057  -7.502   6.366
  202   HD23  LEU  20          HD23      LEU  20 109.218  -6.851   4.955
  203    H    ARG  21           HN       ARG  21 106.324  -9.953   8.793
  204    HA   ARG  21           HA       ARG  21 105.670  -8.883  11.336
  205    HB2  ARG  21           HB2      ARG  21 104.932 -11.118  10.650
  206    HB3  ARG  21           HB1      ARG  21 106.605 -11.631  10.515
  207    HG2  ARG  21           HG2      ARG  21 106.772 -10.988  13.014
  208    HG3  ARG  21           HG1      ARG  21 105.021 -11.017  12.970
  209    HD2  ARG  21           HD2      ARG  21 105.004 -13.299  12.172
  210    HD3  ARG  21           HD1      ARG  21 106.765 -13.322  12.113
  211    HE   ARG  21           HE       ARG  21 105.126 -13.179  14.550
  212   HH11  ARG  21          HH11      ARG  21 108.278 -13.903  13.024
  213   HH12  ARG  21          HH12      ARG  21 108.842 -14.808  14.338
  214   HH21  ARG  21          HH21      ARG  21 105.960 -14.374  16.366
  215   HH22  ARG  21          HH22      ARG  21 107.516 -15.051  16.306
  216    H    LYS  22           HN       LYS  22 107.400  -7.629  12.211
  217    HA   LYS  22           HA       LYS  22 110.031  -7.677  12.164
  218    HB2  LYS  22           HB2      LYS  22 108.134  -7.600  14.425
  219    HB3  LYS  22           HB1      LYS  22 109.856  -7.464  14.693
  220    HG2  LYS  22           HG2      LYS  22 108.879  -5.308  14.695
  221    HG3  LYS  22           HG1      LYS  22 109.929  -5.634  13.310
  222    HD2  LYS  22           HD2      LYS  22 108.169  -5.439  11.841
  223    HD3  LYS  22           HD1      LYS  22 107.085  -6.040  13.119
  224    HE2  LYS  22           HE2      LYS  22 106.641  -3.686  12.570
  225    HE3  LYS  22           HE1      LYS  22 107.068  -3.953  14.246
  226    HZ1  LYS  22           HZ1      LYS  22 108.107  -1.986  13.309
  227    HZ2  LYS  22           HZ2      LYS  22 108.971  -2.872  12.190
  228    HZ3  LYS  22           HZ3      LYS  22 109.227  -3.068  13.854
  229    H    SER  23           HN       SER  23 111.204  -9.428  11.972
  230    HA   SER  23           HA       SER  23 110.994 -11.521  13.992
  231    HB2  SER  23           HB2      SER  23 111.435 -11.854  11.009
  232    HB3  SER  23           HB1      SER  23 111.586 -13.173  12.184
  233    HG   SER  23           HG       SER  23 109.326 -11.603  11.542
  234    H    SER  24           HN       SER  24 112.900 -12.326  14.737
  235    HA   SER  24           HA       SER  24 114.969 -12.255  15.551
  236    HB2  SER  24           HB2      SER  24 115.754 -11.890  12.663
  237    HB3  SER  24           HB1      SER  24 116.753 -12.519  13.986
  238    HG   SER  24           HG       SER  24 114.696 -13.696  12.568
  239    H    ARG  25           HN       ARG  25 113.715  -9.583  15.505
  240    HA   ARG  25           HA       ARG  25 114.260  -7.623  16.408
  241    HB2  ARG  25           HB2      ARG  25 117.022  -8.827  16.451
  242    HB3  ARG  25           HB1      ARG  25 116.808  -7.121  16.810
  243    HG2  ARG  25           HG2      ARG  25 115.170  -9.126  18.282
  244    HG3  ARG  25           HG1      ARG  25 116.865  -8.854  18.763
  245    HD2  ARG  25           HD2      ARG  25 116.321  -6.461  18.976
  246    HD3  ARG  25           HD1      ARG  25 114.654  -6.823  18.541
  247    HE   ARG  25           HE       ARG  25 115.672  -8.293  20.777
  248   HH11  ARG  25          HH11      ARG  25 114.017  -5.340  19.729
  249   HH12  ARG  25          HH12      ARG  25 113.318  -5.012  21.257
  250   HH21  ARG  25          HH21      ARG  25 114.679  -7.839  22.880
  251   HH22  ARG  25          HH22      ARG  25 113.678  -6.471  23.065
  252    H    GLY  26           HN       GLY  26 113.519  -7.639  14.084
  253    HA2  GLY  26           HA2      GLY  26 113.966  -5.418  12.805
  254    HA3  GLY  26           HA1      GLY  26 115.331  -6.410  12.247
  255    H    PHE  27           HN       PHE  27 114.961  -7.416  10.510
  256    HA   PHE  27           HA       PHE  27 112.280  -8.449   9.981
  257    HB2  PHE  27           HB2      PHE  27 113.910  -6.510   8.571
  258    HB3  PHE  27           HB1      PHE  27 112.848  -7.506   7.545
  259    HD1  PHE  27           HD2      PHE  27 110.317  -7.465   8.732
  260    HD2  PHE  27           HD1      PHE  27 113.403  -4.595   9.250
  261    HE1  PHE  27           HE2      PHE  27 108.663  -5.796   9.586
  262    HE2  PHE  27           HE1      PHE  27 111.805  -3.013  10.103
  263    HZ   PHE  27           HZ       PHE  27 109.462  -3.600  10.307
  264    H    GLY  28           HN       GLY  28 115.407  -8.311   8.180
  265    HA2  GLY  28           HA2      GLY  28 116.549 -10.489   7.954
  266    HA3  GLY  28           HA1      GLY  28 114.959 -11.186   7.685
  267    H    PHE  29           HN       PHE  29 116.458  -8.251   6.407
  268    HA   PHE  29           HA       PHE  29 117.080  -9.379   3.912
  269    HB2  PHE  29           HB2      PHE  29 115.657  -7.922   2.491
  270    HB3  PHE  29           HB1      PHE  29 114.731  -9.098   3.379
  271    HD1  PHE  29           HD1      PHE  29 115.513  -5.610   2.983
  272    HD2  PHE  29           HD2      PHE  29 113.204  -8.408   5.100
  273    HE1  PHE  29           HE1      PHE  29 114.035  -3.768   3.756
  274    HE2  PHE  29           HE2      PHE  29 111.717  -6.597   5.901
  275    HZ   PHE  29           HZ       PHE  29 112.134  -4.280   5.222
  276    H    THR  30           HN       THR  30 118.557  -7.957   2.808
  277    HA   THR  30           HA       THR  30 119.268  -5.789   4.593
  278    HB   THR  30           HB       THR  30 121.584  -5.988   3.587
  279    HG1  THR  30           HG1      THR  30 122.000  -7.876   2.435
  280   HG21  THR  30          HG21      THR  30 120.932  -7.033   5.771
  281   HG22  THR  30          HG22      THR  30 122.160  -7.966   4.922
  282   HG23  THR  30          HG23      THR  30 120.476  -8.479   4.892
  283    H    VAL  31           HN       VAL  31 119.561  -3.787   3.892
  284    HA   VAL  31           HA       VAL  31 118.590  -3.321   1.180
  285    HB   VAL  31           HB       VAL  31 117.427  -1.264   2.076
  286   HG11  VAL  31          HG11      VAL  31 116.590  -3.866   3.265
  287   HG12  VAL  31          HG12      VAL  31 116.219  -3.302   1.629
  288   HG13  VAL  31          HG13      VAL  31 115.575  -2.443   3.031
  289   HG21  VAL  31          HG21      VAL  31 116.958  -1.221   4.393
  290   HG22  VAL  31          HG22      VAL  31 118.701  -1.023   4.020
  291   HG23  VAL  31          HG23      VAL  31 118.070  -2.593   4.612
  292    H    VAL  32           HN       VAL  32 119.207  -1.561   0.118
  293    HA   VAL  32           HA       VAL  32 121.631  -0.260   1.026
  294    HB   VAL  32           HB       VAL  32 122.564  -0.372  -1.189
  295   HG11  VAL  32          HG11      VAL  32 122.994  -2.275   0.199
  296   HG12  VAL  32          HG12      VAL  32 122.882  -2.764  -1.488
  297   HG13  VAL  32          HG13      VAL  32 121.536  -3.071  -0.389
  298   HG21  VAL  32          HG21      VAL  32 120.474  -0.120  -2.466
  299   HG22  VAL  32          HG22      VAL  32 120.024  -1.773  -2.066
  300   HG23  VAL  32          HG23      VAL  32 121.451  -1.450  -3.070
  301    H    GLY  33           HN       GLY  33 121.685   1.837   0.838
  302    HA2  GLY  33           HA2      GLY  33 121.072   3.790  -0.600
  303    HA3  GLY  33           HA1      GLY  33 119.424   3.157  -0.515
  304    H    GLY  34           HN       GLY  34 118.372   4.507   0.611
  305    HA2  GLY  34           HA2      GLY  34 117.701   5.988   2.211
  306    HA3  GLY  34           HA1      GLY  34 117.918   4.652   3.269
  307    H    ASP  35           HN       ASP  35 119.743   7.114   1.677
  308    HA   ASP  35           HA       ASP  35 121.275   7.392   4.177
  309    HB2  ASP  35           HB2      ASP  35 122.218   6.531   1.935
  310    HB3  ASP  35           HB1      ASP  35 122.279   8.230   1.517
  311    H    GLU  36           HN       GLU  36 119.084   8.857   2.036
  312    HA   GLU  36           HA       GLU  36 119.228  11.415   3.355
  313    HB2  GLU  36           HB2      GLU  36 119.873  12.490   1.089
  314    HB3  GLU  36           HB1      GLU  36 121.177  11.905   2.109
  315    HG2  GLU  36           HG2      GLU  36 121.083   9.807   0.841
  316    HG3  GLU  36           HG1      GLU  36 119.988  10.646  -0.296
  317    HA   PRO  37           HA       PRO  37 115.192  11.708   2.350
  318    HB2  PRO  37           HB2      PRO  37 115.911  14.195   0.937
  319    HB3  PRO  37           HB1      PRO  37 114.650  14.031   2.214
  320    HG2  PRO  37           HG2      PRO  37 116.905  15.220   2.822
  321    HG3  PRO  37           HG1      PRO  37 116.441  13.848   3.856
  322    HD2  PRO  37           HD2      PRO  37 118.236  13.866   1.463
  323    HD3  PRO  37           HD1      PRO  37 118.698  13.307   3.051
  324    H    ASP  38           HN       ASP  38 117.364  12.721  -0.002
  325    HA   ASP  38           HA       ASP  38 115.771  12.371  -2.258
  326    HB2  ASP  38           HB2      ASP  38 117.413  14.037  -2.112
  327    HB3  ASP  38           HB1      ASP  38 118.662  12.871  -1.735
  328    H    GLU  39           HN       GLU  39 117.513  10.142  -0.302
  329    HA   GLU  39           HA       GLU  39 117.132   8.175  -2.388
  330    HB2  GLU  39           HB2      GLU  39 119.523   8.520  -2.410
  331    HB3  GLU  39           HB1      GLU  39 119.604   8.301  -0.666
  332    HG2  GLU  39           HG2      GLU  39 119.055   6.008  -0.823
  333    HG3  GLU  39           HG1      GLU  39 118.594   6.164  -2.514
  334    H    PHE  40           HN       PHE  40 115.888   6.810  -1.898
  335    HA   PHE  40           HA       PHE  40 114.831   6.140   0.740
  336    HB2  PHE  40           HB2      PHE  40 114.082   4.830  -1.874
  337    HB3  PHE  40           HB1      PHE  40 113.088   5.072  -0.453
  338    HD1  PHE  40           HD1      PHE  40 112.917   7.824   0.059
  339    HD2  PHE  40           HD2      PHE  40 113.345   5.906  -3.714
  340    HE1  PHE  40           HE1      PHE  40 111.858   9.754  -1.042
  341    HE2  PHE  40           HE2      PHE  40 112.297   7.836  -4.825
  342    HZ   PHE  40           HZ       PHE  40 111.548   9.762  -3.497
  343    H    LEU  41           HN       LEU  41 114.416   3.627   1.058
  344    HA   LEU  41           HA       LEU  41 117.124   2.558   0.667
  345    HB2  LEU  41           HB2      LEU  41 115.000   1.375   2.490
  346    HB3  LEU  41           HB1      LEU  41 116.654   0.871   2.185
  347    HG   LEU  41           HG       LEU  41 117.463   2.895   3.192
  348   HD11  LEU  41          HD11      LEU  41 115.498   4.361   3.016
  349   HD12  LEU  41          HD12      LEU  41 115.945   4.174   4.717
  350   HD13  LEU  41          HD13      LEU  41 114.582   3.272   4.056
  351   HD21  LEU  41          HD21      LEU  41 117.398   0.816   4.326
  352   HD22  LEU  41          HD22      LEU  41 115.756   1.136   4.907
  353   HD23  LEU  41          HD23      LEU  41 117.116   2.140   5.439
  354    H    GLN  42           HN       GLN  42 117.428   0.534  -0.289
  355    HA   GLN  42           HA       GLN  42 115.079  -0.434  -1.732
  356    HB2  GLN  42           HB2      GLN  42 116.669   0.925  -3.028
  357    HB3  GLN  42           HB1      GLN  42 117.953  -0.235  -2.621
  358    HG2  GLN  42           HG2      GLN  42 116.109  -1.854  -3.785
  359    HG3  GLN  42           HG1      GLN  42 115.677  -0.348  -4.513
  360   HE21  GLN  42          HE21      GLN  42 116.959  -2.723  -5.703
  361   HE22  GLN  42          HE22      GLN  42 118.338  -2.108  -6.523
  362    H    ILE  43           HN       ILE  43 115.492  -2.785  -2.263
  363    HA   ILE  43           HA       ILE  43 117.134  -4.004  -0.129
  364    HB   ILE  43           HB       ILE  43 114.913  -5.322  -1.784
  365   HG12  ILE  43          HG12      ILE  43 113.725  -5.586   0.237
  366   HG13  ILE  43          HG11      ILE  43 115.027  -4.885   1.190
  367   HG21  ILE  43          HG21      ILE  43 115.198  -7.336  -0.425
  368   HG22  ILE  43          HG22      ILE  43 116.532  -6.593   0.432
  369   HG23  ILE  43          HG23      ILE  43 116.693  -6.957  -1.285
  370   HD11  ILE  43          HD11      ILE  43 113.226  -3.347   0.927
  371   HD12  ILE  43          HD12      ILE  43 113.336  -3.533  -0.852
  372   HD13  ILE  43          HD13      ILE  43 114.700  -2.858   0.061
  373    H    LYS  44           HN       LYS  44 118.855  -4.997  -0.773
  374    HA   LYS  44           HA       LYS  44 118.936  -6.079  -3.510
  375    HB2  LYS  44           HB2      LYS  44 121.527  -5.142  -2.219
  376    HB3  LYS  44           HB1      LYS  44 121.381  -6.098  -3.657
  377    HG2  LYS  44           HG2      LYS  44 119.940  -4.159  -4.564
  378    HG3  LYS  44           HG1      LYS  44 120.687  -3.232  -3.268
  379    HD2  LYS  44           HD2      LYS  44 122.173  -4.718  -5.472
  380    HD3  LYS  44           HD1      LYS  44 121.922  -2.983  -5.408
  381    HE2  LYS  44           HE2      LYS  44 123.343  -2.820  -3.450
  382    HE3  LYS  44           HE1      LYS  44 123.505  -4.580  -3.377
  383    HZ1  LYS  44           HZ1      LYS  44 124.708  -4.509  -5.511
  384    HZ2  LYS  44           HZ2      LYS  44 125.470  -3.506  -4.433
  385    HZ3  LYS  44           HZ3      LYS  44 124.495  -2.850  -5.615
  386    H    SER  45           HN       SER  45 118.947  -7.116  -0.345
  387    HA   SER  45           HA       SER  45 119.233  -9.737  -1.517
  388    HB2  SER  45           HB2      SER  45 120.934  -8.879   0.829
  389    HB3  SER  45           HB1      SER  45 120.690 -10.558   0.350
  390    HG   SER  45           HG       SER  45 121.362  -8.990  -1.734
  391    H    LEU  46           HN       LEU  46 117.635 -10.987  -0.910
  392    HA   LEU  46           HA       LEU  46 116.061 -10.436   1.354
  393    HB2  LEU  46           HB2      LEU  46 114.967 -11.165  -0.608
  394    HB3  LEU  46           HB1      LEU  46 116.116 -12.458  -0.841
  395    HG   LEU  46           HG       LEU  46 115.140 -13.729   0.961
  396   HD11  LEU  46          HD11      LEU  46 113.232 -12.915   2.180
  397   HD12  LEU  46          HD12      LEU  46 113.385 -11.332   1.355
  398   HD13  LEU  46          HD13      LEU  46 114.678 -11.925   2.416
  399   HD21  LEU  46          HD21      LEU  46 113.019 -12.548  -0.804
  400   HD22  LEU  46          HD22      LEU  46 112.908 -14.085   0.065
  401   HD23  LEU  46          HD23      LEU  46 114.093 -13.879  -1.233
  402    H    VAL  47           HN       VAL  47 116.671 -11.193   3.308
  403    HA   VAL  47           HA       VAL  47 118.681 -13.243   3.452
  404    HB   VAL  47           HB       VAL  47 117.355 -11.551   5.596
  405   HG11  VAL  47          HG11      VAL  47 119.091 -12.357   7.079
  406   HG12  VAL  47          HG12      VAL  47 119.711 -13.396   5.785
  407   HG13  VAL  47          HG13      VAL  47 118.095 -13.680   6.455
  408   HG21  VAL  47          HG21      VAL  47 118.777 -10.250   4.086
  409   HG22  VAL  47          HG22      VAL  47 120.126 -11.341   4.411
  410   HG23  VAL  47          HG23      VAL  47 119.455 -10.346   5.705
  411    H    LEU  48           HN       LEU  48 118.192 -15.276   3.958
  412    HA   LEU  48           HA       LEU  48 115.422 -15.977   4.001
  413    HB2  LEU  48           HB2      LEU  48 117.853 -17.689   4.294
  414    HB3  LEU  48           HB1      LEU  48 116.231 -18.249   3.943
  415    HG   LEU  48           HG       LEU  48 117.909 -16.519   2.145
  416   HD11  LEU  48          HD11      LEU  48 118.624 -18.830   2.143
  417   HD12  LEU  48          HD12      LEU  48 117.881 -18.396   0.605
  418   HD13  LEU  48          HD13      LEU  48 116.978 -19.352   1.779
  419   HD21  LEU  48          HD21      LEU  48 115.082 -17.521   1.731
  420   HD22  LEU  48          HD22      LEU  48 116.067 -16.757   0.490
  421   HD23  LEU  48          HD23      LEU  48 115.580 -15.836   1.903
  422    H    ASP  49           HN       ASP  49 114.367 -17.087   5.509
  423    HA   ASP  49           HA       ASP  49 113.556 -17.419   7.564
  424    HB2  ASP  49           HB2      ASP  49 115.806 -18.257   8.160
  425    HB3  ASP  49           HB1      ASP  49 116.288 -16.646   8.616
  426    H    GLY  50           HN       GLY  50 114.388 -14.773   6.121
  427    HA2  GLY  50           HA2      GLY  50 113.635 -12.681   7.972
  428    HA3  GLY  50           HA1      GLY  50 113.815 -12.697   6.190
  429    HA   PRO  51           HA       PRO  51 109.372 -13.312   7.507
  430    HB2  PRO  51           HB2      PRO  51 108.307 -10.744   7.754
  431    HB3  PRO  51           HB1      PRO  51 108.979 -11.683   9.052
  432    HG2  PRO  51           HG2      PRO  51 110.070  -9.324   7.803
  433    HG3  PRO  51           HG1      PRO  51 110.535 -10.117   9.308
  434    HD2  PRO  51           HD2      PRO  51 111.692 -10.267   6.663
  435    HD3  PRO  51           HD1      PRO  51 112.417 -10.761   8.176
  436    H    ALA  52           HN       ALA  52 110.818 -11.142   5.360
  437    HA   ALA  52           HA       ALA  52 108.903 -10.944   3.308
  438    HB1  ALA  52           HB1      ALA  52 111.925 -10.918   3.274
  439    HB2  ALA  52           HB2      ALA  52 110.872  -9.520   3.421
  440    HB3  ALA  52           HB3      ALA  52 110.904 -10.448   1.926
  441    H    ALA  53           HN       ALA  53 111.536 -13.146   3.992
  442    HA   ALA  53           HA       ALA  53 111.465 -14.779   1.696
  443    HB1  ALA  53           HB1      ALA  53 113.391 -14.576   3.276
  444    HB2  ALA  53           HB2      ALA  53 112.879 -16.239   3.002
  445    HB3  ALA  53           HB3      ALA  53 112.406 -15.411   4.490
  446    H    LEU  54           HN       LEU  54 110.315 -15.049   4.895
  447    HA   LEU  54           HA       LEU  54 109.341 -17.625   4.811
  448    HB2  LEU  54           HB2      LEU  54 109.007 -15.363   6.557
  449    HB3  LEU  54           HB1      LEU  54 108.535 -17.009   6.941
  450    HG   LEU  54           HG       LEU  54 111.346 -16.065   6.286
  451   HD11  LEU  54          HD11      LEU  54 109.918 -17.142   8.456
  452   HD12  LEU  54          HD12      LEU  54 110.456 -15.435   8.050
  453   HD13  LEU  54          HD13      LEU  54 111.697 -16.727   8.413
  454   HD21  LEU  54          HD21      LEU  54 110.290 -18.857   6.873
  455   HD22  LEU  54          HD22      LEU  54 111.978 -18.394   6.859
  456   HD23  LEU  54          HD23      LEU  54 111.059 -18.342   5.367
  457    H    ASP  55           HN       ASP  55 107.782 -14.423   4.617
  458    HA   ASP  55           HA       ASP  55 105.154 -15.579   4.512
  459    HB2  ASP  55           HB2      ASP  55 105.734 -13.219   5.377
  460    HB3  ASP  55           HB1      ASP  55 105.964 -12.795   3.708
  461    H    GLY  56           HN       GLY  56 107.690 -14.929   2.453
  462    HA2  GLY  56           HA2      GLY  56 108.089 -15.310   0.232
  463    HA3  GLY  56           HA1      GLY  56 106.646 -16.336   0.266
  464    H    LYS  57           HN       LYS  57 107.074 -12.958   0.793
  465    HA   LYS  57           HA       LYS  57 105.096 -12.404  -1.349
  466    HB2  LYS  57           HB2      LYS  57 104.154 -12.479   0.888
  467    HB3  LYS  57           HB1      LYS  57 105.305 -11.273   1.409
  468    HG2  LYS  57           HG2      LYS  57 103.225 -10.182   1.113
  469    HG3  LYS  57           HG1      LYS  57 104.222  -9.717  -0.262
  470    HD2  LYS  57           HD2      LYS  57 103.077 -11.216  -1.706
  471    HD3  LYS  57           HD1      LYS  57 102.247 -11.988  -0.354
  472    HE2  LYS  57           HE2      LYS  57 101.884  -9.135  -1.267
  473    HE3  LYS  57           HE1      LYS  57 100.760 -10.463  -1.548
  474    HZ1  LYS  57           HZ1      LYS  57 100.041  -9.126   0.328
  475    HZ2  LYS  57           HZ2      LYS  57 101.509  -9.357   1.118
  476    HZ3  LYS  57           HZ3      LYS  57 100.484 -10.659   0.870
  477    H    MET  58           HN       MET  58 107.996 -11.449   0.338
  478    HA   MET  58           HA       MET  58 108.170  -8.995  -1.246
  479    HB2  MET  58           HB2      MET  58 107.638  -8.539   1.102
  480    HB3  MET  58           HB1      MET  58 108.983  -9.500   1.639
  481    HG2  MET  58           HG2      MET  58 109.366  -7.107  -0.059
  482    HG3  MET  58           HG1      MET  58 109.154  -6.977   1.693
  483    HE1  MET  58           HE1      MET  58 111.619  -5.658   0.573
  484    HE2  MET  58           HE2      MET  58 112.788  -6.294   1.758
  485    HE3  MET  58           HE3      MET  58 111.156  -5.896   2.252
  486    H    GLU  59           HN       GLU  59 110.378  -8.485  -1.974
  487    HA   GLU  59           HA       GLU  59 112.163 -10.803  -1.963
  488    HB2  GLU  59           HB2      GLU  59 110.846  -9.661  -4.405
  489    HB3  GLU  59           HB1      GLU  59 112.298 -10.640  -4.467
  490    HG2  GLU  59           HG2      GLU  59 111.091 -12.489  -3.465
  491    HG3  GLU  59           HG1      GLU  59 109.642 -11.490  -3.369
  492    H    THR  60           HN       THR  60 114.163 -10.407  -3.078
  493    HA   THR  60           HA       THR  60 115.458  -7.982  -2.673
  494    HB   THR  60           HB       THR  60 116.007 -10.172  -4.670
  495    HG1  THR  60           HG1      THR  60 116.293 -11.400  -3.021
  496   HG21  THR  60          HG21      THR  60 117.366  -8.154  -4.828
  497   HG22  THR  60          HG22      THR  60 118.298  -9.577  -4.298
  498   HG23  THR  60          HG23      THR  60 117.774  -8.367  -3.118
  499    H    GLY  61           HN       GLY  61 115.241  -6.155  -3.918
  500    HA2  GLY  61           HA2      GLY  61 115.192  -5.268  -6.230
  501    HA3  GLY  61           HA1      GLY  61 113.969  -6.491  -6.549
  502    H    ASP  62           HN       ASP  62 113.044  -5.843  -3.632
  503    HA   ASP  62           HA       ASP  62 111.130  -3.870  -4.371
  504    HB2  ASP  62           HB2      ASP  62 111.791  -5.236  -1.759
  505    HB3  ASP  62           HB1      ASP  62 110.732  -3.837  -1.795
  506    H    VAL  63           HN       VAL  63 110.945  -1.840  -3.411
  507    HA   VAL  63           HA       VAL  63 113.314  -0.903  -2.078
  508    HB   VAL  63           HB       VAL  63 113.677   0.126  -4.179
  509   HG11  VAL  63          HG11      VAL  63 111.639  -0.372  -5.205
  510   HG12  VAL  63          HG12      VAL  63 112.015   1.346  -5.437
  511   HG13  VAL  63          HG13      VAL  63 110.785   0.851  -4.249
  512   HG21  VAL  63          HG21      VAL  63 113.332   2.537  -3.895
  513   HG22  VAL  63          HG22      VAL  63 113.904   1.783  -2.406
  514   HG23  VAL  63          HG23      VAL  63 112.204   2.215  -2.578
  515    H    ILE  64           HN       ILE  64 113.102   0.073  -0.317
  516    HA   ILE  64           HA       ILE  64 110.618  -0.094   0.941
  517    HB   ILE  64           HB       ILE  64 113.272   0.866   1.983
  518   HG12  ILE  64          HG12      ILE  64 113.243  -1.465   1.370
  519   HG13  ILE  64          HG11      ILE  64 113.410  -1.293   3.108
  520   HG21  ILE  64          HG21      ILE  64 111.509   1.856   3.320
  521   HG22  ILE  64          HG22      ILE  64 112.351   0.616   4.251
  522   HG23  ILE  64          HG23      ILE  64 110.768   0.272   3.556
  523   HD11  ILE  64          HD11      ILE  64 111.892  -3.114   2.617
  524   HD12  ILE  64          HD12      ILE  64 110.910  -2.071   1.598
  525   HD13  ILE  64          HD13      ILE  64 110.980  -1.789   3.338
  526    H    VAL  65           HN       VAL  65 109.186   1.424   0.868
  527    HA   VAL  65           HA       VAL  65 109.850   4.218   0.346
  528    HB   VAL  65           HB       VAL  65 107.209   2.769   0.076
  529   HG11  VAL  65          HG11      VAL  65 108.082   5.438  -0.969
  530   HG12  VAL  65          HG12      VAL  65 106.973   5.166   0.379
  531   HG13  VAL  65          HG13      VAL  65 106.519   4.681  -1.258
  532   HG21  VAL  65          HG21      VAL  65 108.808   1.829  -1.488
  533   HG22  VAL  65          HG22      VAL  65 109.218   3.443  -2.060
  534   HG23  VAL  65          HG23      VAL  65 107.602   2.791  -2.345
  535    H    SER  66           HN       SER  66 107.554   2.198   2.273
  536    HA   SER  66           HA       SER  66 107.703   4.154   4.397
  537    HB2  SER  66           HB2      SER  66 105.967   5.126   3.033
  538    HB3  SER  66           HB1      SER  66 105.116   3.605   2.887
  539    HG   SER  66           HG       SER  66 104.108   4.111   4.564
  540    H    VAL  67           HN       VAL  67 106.606   3.403   6.388
  541    HA   VAL  67           HA       VAL  67 106.030   0.594   6.472
  542    HB   VAL  67           HB       VAL  67 108.450   0.635   6.846
  543   HG11  VAL  67          HG11      VAL  67 107.959   2.472   9.149
  544   HG12  VAL  67          HG12      VAL  67 108.770   2.872   7.633
  545   HG13  VAL  67          HG13      VAL  67 109.502   1.711   8.749
  546   HG21  VAL  67          HG21      VAL  67 107.243  -1.046   8.050
  547   HG22  VAL  67          HG22      VAL  67 106.957   0.070   9.383
  548   HG23  VAL  67          HG23      VAL  67 108.597  -0.477   9.028
  549    H    ASN  68           HN       ASN  68 104.049   0.925   6.963
  550    HA   ASN  68           HA       ASN  68 102.210   1.992   7.611
  551    HB2  ASN  68           HB2      ASN  68 101.347   1.300   9.834
  552    HB3  ASN  68           HB1      ASN  68 102.106   0.003   8.946
  553   HD21  ASN  68          HD21      ASN  68 102.049  -1.096  10.936
  554   HD22  ASN  68          HD22      ASN  68 103.245  -0.813  12.133
  555    H    ASP  69           HN       ASP  69 103.708   2.862  10.515
  556    HA   ASP  69           HA       ASP  69 102.393   5.480  10.302
  557    HB2  ASP  69           HB2      ASP  69 101.984   4.344  12.354
  558    HB3  ASP  69           HB1      ASP  69 103.696   4.048  12.610
  559    H    THR  70           HN       THR  70 105.557   4.087  10.320
  560    HA   THR  70           HA       THR  70 106.777   6.691  10.657
  561    HB   THR  70           HB       THR  70 108.014   3.936  10.479
  562    HG1  THR  70           HG1      THR  70 107.907   5.615  12.744
  563   HG21  THR  70          HG21      THR  70 109.562   5.723   9.746
  564   HG22  THR  70          HG22      THR  70 110.070   5.006  11.272
  565   HG23  THR  70          HG23      THR  70 109.278   6.582  11.262
  566    H    CYS  71           HN       CYS  71 107.654   7.798   9.131
  567    HA   CYS  71           HA       CYS  71 107.307   6.926   6.402
  568    HB2  CYS  71           HB2      CYS  71 106.583   9.191   7.249
  569    HB3  CYS  71           HB1      CYS  71 108.274   9.576   7.486
  570    HG   CYS  71           HG       CYS  71 106.515   9.403   4.628
  571    H    VAL  72           HN       VAL  72 108.931   5.372   6.370
  572    HA   VAL  72           HA       VAL  72 111.663   6.081   6.951
  573    HB   VAL  72           HB       VAL  72 110.751   3.804   7.338
  574   HG11  VAL  72          HG11      VAL  72 109.294   3.547   5.505
  575   HG12  VAL  72          HG12      VAL  72 110.488   2.248   5.452
  576   HG13  VAL  72          HG13      VAL  72 110.628   3.629   4.359
  577   HG21  VAL  72          HG21      VAL  72 113.068   3.875   5.417
  578   HG22  VAL  72          HG22      VAL  72 112.647   2.504   6.445
  579   HG23  VAL  72          HG23      VAL  72 113.152   4.031   7.172
  580    H    LEU  73           HN       LEU  73 109.684   6.870   4.580
  581    HA   LEU  73           HA       LEU  73 110.979   6.702   2.108
  582    HB2  LEU  73           HB2      LEU  73 108.644   7.422   2.773
  583    HB3  LEU  73           HB1      LEU  73 109.357   8.920   3.300
  584    HG   LEU  73           HG       LEU  73 109.961   9.478   1.026
  585   HD11  LEU  73          HD11      LEU  73 108.654   6.840   0.400
  586   HD12  LEU  73          HD12      LEU  73 110.368   7.213   0.184
  587   HD13  LEU  73          HD13      LEU  73 109.151   8.030  -0.802
  588   HD21  LEU  73          HD21      LEU  73 107.671   9.700   0.202
  589   HD22  LEU  73          HD22      LEU  73 107.809  10.102   1.914
  590   HD23  LEU  73          HD23      LEU  73 107.130   8.550   1.424
  591    H    GLY  74           HN       GLY  74 113.020   7.279   1.877
  592    HA2  GLY  74           HA2      GLY  74 114.944   8.535   1.831
  593    HA3  GLY  74           HA1      GLY  74 113.890   9.916   2.106
  594    H    HIS  75           HN       HIS  75 114.280   7.181   4.261
  595    HA   HIS  75           HA       HIS  75 114.833   8.951   6.454
  596    HB2  HIS  75           HB2      HIS  75 113.779   6.313   6.186
  597    HB3  HIS  75           HB1      HIS  75 115.348   6.205   6.959
  598    HD1  HIS  75           HD1      HIS  75 112.274   8.437   7.571
  599    HD2  HIS  75           HD2      HIS  75 115.190   6.216   9.482
  600    HE1  HIS  75           HE1      HIS  75 111.787   8.650  10.015
  601    H    THR  76           HN       THR  76 116.739   9.337   7.251
  602    HA   THR  76           HA       THR  76 119.168   8.892   5.890
  603    HB   THR  76           HB       THR  76 118.650   9.592   8.773
  604    HG1  THR  76           HG1      THR  76 118.415  11.017   6.408
  605   HG21  THR  76          HG21      THR  76 121.007   9.048   8.319
  606   HG22  THR  76          HG22      THR  76 120.772  10.728   8.759
  607   HG23  THR  76          HG23      THR  76 121.052  10.296   7.061
  608    H    HIS  77           HN       HIS  77 120.804   7.303   6.211
  609    HA   HIS  77           HA       HIS  77 120.415   4.798   6.999
  610    HB2  HIS  77           HB2      HIS  77 122.512   5.221   6.020
  611    HB3  HIS  77           HB1      HIS  77 122.864   6.496   7.156
  612    HD1  HIS  77           HD1      HIS  77 122.163   2.737   7.962
  613    HD2  HIS  77           HD2      HIS  77 125.093   5.678   8.417
  614    HE1  HIS  77           HE1      HIS  77 123.924   1.773   9.449
  615    H    ALA  78           HN       ALA  78 121.644   7.255   9.127
  616    HA   ALA  78           HA       ALA  78 121.998   5.605  11.381
  617    HB1  ALA  78           HB1      ALA  78 121.566   8.580  11.320
  618    HB2  ALA  78           HB2      ALA  78 123.111   7.761  11.093
  619    HB3  ALA  78           HB3      ALA  78 122.278   7.654  12.643
  620    H    GLN  79           HN       GLN  79 119.241   7.300  10.156
  621    HA   GLN  79           HA       GLN  79 117.808   7.156  12.604
  622    HB2  GLN  79           HB2      GLN  79 117.026   7.943   9.831
  623    HB3  GLN  79           HB1      GLN  79 115.951   8.093  11.207
  624    HG2  GLN  79           HG2      GLN  79 118.582   9.512  10.770
  625    HG3  GLN  79           HG1      GLN  79 116.974  10.245  10.733
  626   HE21  GLN  79          HE21      GLN  79 119.347  10.825  12.344
  627   HE22  GLN  79          HE22      GLN  79 118.847  10.691  13.976
  628    H    VAL  80           HN       VAL  80 117.669   5.701   9.414
  629    HA   VAL  80           HA       VAL  80 115.524   3.931   9.982
  630    HB   VAL  80           HB       VAL  80 116.066   4.568   7.658
  631   HG11  VAL  80          HG11      VAL  80 118.492   4.551   7.849
  632   HG12  VAL  80          HG12      VAL  80 117.917   3.630   6.472
  633   HG13  VAL  80          HG13      VAL  80 118.469   2.791   7.928
  634   HG21  VAL  80          HG21      VAL  80 115.662   2.394   6.693
  635   HG22  VAL  80          HG22      VAL  80 114.776   2.543   8.208
  636   HG23  VAL  80          HG23      VAL  80 116.266   1.609   8.150
  637    H    VAL  81           HN       VAL  81 118.993   3.445  10.199
  638    HA   VAL  81           HA       VAL  81 118.655   0.697  10.849
  639    HB   VAL  81           HB       VAL  81 120.843   1.538  10.056
  640   HG11  VAL  81          HG11      VAL  81 122.418   2.644  11.616
  641   HG12  VAL  81          HG12      VAL  81 121.114   2.781  12.800
  642   HG13  VAL  81          HG13      VAL  81 121.004   3.639  11.265
  643   HG21  VAL  81          HG21      VAL  81 120.992   0.191  12.743
  644   HG22  VAL  81          HG22      VAL  81 122.293   0.228  11.553
  645   HG23  VAL  81          HG23      VAL  81 120.779  -0.601  11.185
  646    H    LYS  82           HN       LYS  82 118.777   3.595  12.764
  647    HA   LYS  82           HA       LYS  82 118.796   2.429  15.261
  648    HB2  LYS  82           HB2      LYS  82 119.221   4.735  14.947
  649    HB3  LYS  82           HB1      LYS  82 117.655   4.975  14.208
  650    HG2  LYS  82           HG2      LYS  82 117.554   3.976  16.965
  651    HG3  LYS  82           HG1      LYS  82 118.281   5.575  16.799
  652    HD2  LYS  82           HD2      LYS  82 115.581   4.763  15.710
  653    HD3  LYS  82           HD1      LYS  82 115.827   5.640  17.219
  654    HE2  LYS  82           HE2      LYS  82 116.979   7.434  15.886
  655    HE3  LYS  82           HE1      LYS  82 116.515   6.581  14.423
  656    HZ1  LYS  82           HZ1      LYS  82 114.673   7.738  16.429
  657    HZ2  LYS  82           HZ2      LYS  82 114.176   6.845  15.114
  658    HZ3  LYS  82           HZ3      LYS  82 114.965   8.323  14.879
  659    H    ILE  83           HN       ILE  83 115.987   3.018  13.118
  660    HA   ILE  83           HA       ILE  83 114.119   2.363  15.209
  661    HB   ILE  83           HB       ILE  83 113.715   2.671  12.220
  662   HG12  ILE  83          HG12      ILE  83 113.118   4.537  14.511
  663   HG13  ILE  83          HG11      ILE  83 114.431   4.730  13.355
  664   HG21  ILE  83          HG21      ILE  83 111.308   2.814  12.741
  665   HG22  ILE  83          HG22      ILE  83 111.660   2.439  14.427
  666   HG23  ILE  83          HG23      ILE  83 111.980   1.241  13.174
  667   HD11  ILE  83          HD11      ILE  83 111.496   4.799  12.743
  668   HD12  ILE  83          HD12      ILE  83 112.797   5.022  11.568
  669   HD13  ILE  83          HD13      ILE  83 112.558   6.199  12.864
  670    H    PHE  84           HN       PHE  84 115.317   0.943  12.283
  671    HA   PHE  84           HA       PHE  84 113.767  -1.361  12.397
  672    HB2  PHE  84           HB2      PHE  84 116.067  -0.421  10.773
  673    HB3  PHE  84           HB1      PHE  84 115.543  -2.077  10.642
  674    HD1  PHE  84           HD2      PHE  84 113.988   1.335  10.729
  675    HD2  PHE  84           HD1      PHE  84 114.041  -2.502   8.912
  676    HE1  PHE  84           HE2      PHE  84 112.218   2.052   9.178
  677    HE2  PHE  84           HE1      PHE  84 112.274  -1.796   7.359
  678    HZ   PHE  84           HZ       PHE  84 111.358   0.483   7.489
  679    H    GLN  85           HN       GLN  85 116.928  -0.636  13.707
  680    HA   GLN  85           HA       GLN  85 117.293  -3.396  14.383
  681    HB2  GLN  85           HB2      GLN  85 118.973  -0.971  14.906
  682    HB3  GLN  85           HB1      GLN  85 119.394  -2.569  15.540
  683    HG2  GLN  85           HG2      GLN  85 119.086  -1.774  12.658
  684    HG3  GLN  85           HG1      GLN  85 120.603  -2.056  13.509
  685   HE21  GLN  85          HE21      GLN  85 117.805  -3.516  12.078
  686   HE22  GLN  85          HE22      GLN  85 118.425  -5.122  12.082
  687    H    SER  86           HN       SER  86 115.922  -0.611  15.963
  688    HA   SER  86           HA       SER  86 116.173  -1.782  18.582
  689    HB2  SER  86           HB2      SER  86 114.471   0.546  17.654
  690    HB3  SER  86           HB1      SER  86 114.756   0.094  19.335
  691    HG   SER  86           HG       SER  86 116.415   1.281  17.469
  692    H    ILE  87           HN       ILE  87 114.150  -2.214  15.947
  693    HA   ILE  87           HA       ILE  87 111.741  -2.852  16.755
  694    HB   ILE  87           HB       ILE  87 113.540  -4.116  14.755
  695   HG12  ILE  87          HG12      ILE  87 111.196  -2.269  14.670
  696   HG13  ILE  87          HG11      ILE  87 112.844  -1.997  14.117
  697   HG21  ILE  87          HG21      ILE  87 110.651  -4.926  15.071
  698   HG22  ILE  87          HG22      ILE  87 112.031  -5.967  15.392
  699   HG23  ILE  87          HG23      ILE  87 111.714  -5.341  13.768
  700   HD11  ILE  87          HD11      ILE  87 110.814  -3.832  12.939
  701   HD12  ILE  87          HD12      ILE  87 112.451  -3.708  12.328
  702   HD13  ILE  87          HD13      ILE  87 111.348  -2.318  12.232
  703    HA   PRO  88           HA       PRO  88 112.264  -6.709  19.209
  704    HB2  PRO  88           HB2      PRO  88 109.687  -6.807  19.986
  705    HB3  PRO  88           HB1      PRO  88 110.852  -5.677  20.682
  706    HG2  PRO  88           HG2      PRO  88 108.532  -5.113  19.006
  707    HG3  PRO  88           HG1      PRO  88 109.577  -3.959  19.856
  708    HD2  PRO  88           HD2      PRO  88 109.666  -4.870  17.040
  709    HD3  PRO  88           HD1      PRO  88 110.323  -3.405  17.697
  710    H    ILE  89           HN       ILE  89 111.914  -8.811  18.836
  711    HA   ILE  89           HA       ILE  89 110.834  -9.658  16.370
  712    HB   ILE  89           HB       ILE  89 111.341 -11.363  18.846
  713   HG12  ILE  89          HG12      ILE  89 113.273 -10.771  16.646
  714   HG13  ILE  89          HG11      ILE  89 113.290  -9.899  18.183
  715   HG21  ILE  89          HG21      ILE  89 111.396 -12.021  15.910
  716   HG22  ILE  89          HG22      ILE  89 110.139 -12.500  17.053
  717   HG23  ILE  89          HG23      ILE  89 111.782 -13.145  17.212
  718   HD11  ILE  89          HD11      ILE  89 113.769 -12.023  19.289
  719   HD12  ILE  89          HD12      ILE  89 114.978 -11.601  18.061
  720   HD13  ILE  89          HD13      ILE  89 113.765 -12.833  17.711
  721    H    GLY  90           HN       GLY  90 108.795 -10.639  15.982
  722    HA2  GLY  90           HA2      GLY  90 106.771 -11.682  16.601
  723    HA3  GLY  90           HA1      GLY  90 106.993 -11.087  18.244
  724    H    ALA  91           HN       ALA  91 107.678  -8.833  15.858
  725    HA   ALA  91           HA       ALA  91 105.155  -7.509  16.597
  726    HB1  ALA  91           HB1      ALA  91 107.831  -6.274  15.930
  727    HB2  ALA  91           HB2      ALA  91 107.032  -6.285  17.491
  728    HB3  ALA  91           HB3      ALA  91 106.366  -5.338  16.163
  729    H    SER  92           HN       SER  92 104.989  -5.503  14.728
  730    HA   SER  92           HA       SER  92 104.748  -6.836  12.123
  731    HB2  SER  92           HB2      SER  92 102.239  -6.464  12.193
  732    HB3  SER  92           HB1      SER  92 102.888  -7.784  13.185
  733    HG   SER  92           HG       SER  92 102.259  -5.173  14.115
  734    H    VAL  93           HN       VAL  93 104.482  -5.489  10.392
  735    HA   VAL  93           HA       VAL  93 103.529  -2.773  10.705
  736    HB   VAL  93           HB       VAL  93 105.445  -2.008   9.170
  737   HG11  VAL  93          HG11      VAL  93 105.193  -0.859  11.103
  738   HG12  VAL  93          HG12      VAL  93 106.874  -1.411  11.210
  739   HG13  VAL  93          HG13      VAL  93 105.589  -2.215  12.131
  740   HG21  VAL  93          HG21      VAL  93 106.826  -4.274  10.580
  741   HG22  VAL  93          HG22      VAL  93 107.625  -2.995   9.659
  742   HG23  VAL  93          HG23      VAL  93 106.532  -4.114   8.849
  743    H    ASP  94           HN       ASP  94 103.121  -1.730   8.746
  744    HA   ASP  94           HA       ASP  94 102.475  -3.559   6.588
  745    HB2  ASP  94           HB2      ASP  94 101.801  -0.655   7.102
  746    HB3  ASP  94           HB1      ASP  94 101.242  -1.585   5.742
  747    H    LEU  95           HN       LEU  95 104.225  -3.733   5.294
  748    HA   LEU  95           HA       LEU  95 105.999  -1.476   5.139
  749    HB2  LEU  95           HB2      LEU  95 106.588  -3.968   5.551
  750    HB3  LEU  95           HB1      LEU  95 106.369  -4.124   3.822
  751    HG   LEU  95           HG       LEU  95 108.133  -2.444   3.458
  752   HD11  LEU  95          HD11      LEU  95 107.894  -1.181   5.549
  753   HD12  LEU  95          HD12      LEU  95 109.535  -1.820   5.442
  754   HD13  LEU  95          HD13      LEU  95 108.327  -2.613   6.460
  755   HD21  LEU  95          HD21      LEU  95 108.618  -4.831   3.501
  756   HD22  LEU  95          HD22      LEU  95 108.862  -4.738   5.244
  757   HD23  LEU  95          HD23      LEU  95 109.974  -3.897   4.150
  758    H    GLU  96           HN       GLU  96 105.629  -0.093   3.618
  759    HA   GLU  96           HA       GLU  96 104.147  -0.875   1.233
  760    HB2  GLU  96           HB2      GLU  96 104.919   1.863   2.213
  761    HB3  GLU  96           HB1      GLU  96 103.758   1.504   0.939
  762    HG2  GLU  96           HG2      GLU  96 102.331   0.375   2.629
  763    HG3  GLU  96           HG1      GLU  96 103.454   0.894   3.878
  764    H    LEU  97           HN       LEU  97 105.381  -1.416  -0.412
  765    HA   LEU  97           HA       LEU  97 107.837   0.000  -0.820
  766    HB2  LEU  97           HB2      LEU  97 109.229  -1.954  -0.922
  767    HB3  LEU  97           HB1      LEU  97 108.480  -1.831   0.638
  768    HG   LEU  97           HG       LEU  97 108.094  -3.962  -1.488
  769   HD11  LEU  97          HD11      LEU  97 108.776  -3.942   1.406
  770   HD12  LEU  97          HD12      LEU  97 109.868  -4.218   0.055
  771   HD13  LEU  97          HD13      LEU  97 108.582  -5.380   0.415
  772   HD21  LEU  97          HD21      LEU  97 106.298  -4.941  -0.170
  773   HD22  LEU  97          HD22      LEU  97 105.797  -3.334  -0.704
  774   HD23  LEU  97          HD23      LEU  97 106.337  -3.584   0.955
  775    H    CYS  98           HN       CYS  98 108.792  -0.462  -2.869
  776    HA   CYS  98           HA       CYS  98 106.656  -1.015  -4.789
  777    HB2  CYS  98           HB2      CYS  98 107.673   1.371  -4.496
  778    HB3  CYS  98           HB1      CYS  98 109.064   0.700  -5.333
  779    HG   CYS  98           HG       CYS  98 108.004   0.576  -7.764
  780    H    ARG  99           HN       ARG  99 107.050  -2.547  -6.221
  781    HA   ARG  99           HA       ARG  99 109.617  -3.992  -6.101
  782    HB2  ARG  99           HB2      ARG  99 107.585  -5.241  -5.532
  783    HB3  ARG  99           HB1      ARG  99 106.858  -4.812  -7.063
  784    HG2  ARG  99           HG2      ARG  99 107.577  -7.008  -7.289
  785    HG3  ARG  99           HG1      ARG  99 108.810  -6.060  -8.129
  786    HD2  ARG  99           HD2      ARG  99 109.851  -7.764  -6.717
  787    HD3  ARG  99           HD1      ARG  99 110.174  -6.129  -6.088
  788    HE   ARG  99           HE       ARG  99 108.916  -6.482  -4.329
  789   HH11  ARG  99          HH11      ARG  99 108.461  -9.261  -6.472
  790   HH12  ARG  99          HH12      ARG  99 107.749 -10.239  -5.296
  791   HH21  ARG  99          HH21      ARG  99 108.038  -7.704  -2.803
  792   HH22  ARG  99          HH22      ARG  99 107.406  -9.295  -3.032
  793    H    GLY 100           HN       GLY 100 110.588  -4.564  -8.171
  794    HA2  GLY 100           HA2      GLY 100 110.392  -4.587 -10.574
  795    HA3  GLY 100           HA1      GLY 100 109.423  -3.124 -10.457
  796    H    TYR 101           HN       TYR 101 111.882  -3.045  -8.244
  797    HA   TYR 101           HA       TYR 101 113.404  -1.223  -9.891
  798    HB2  TYR 101           HB2      TYR 101 112.655  -1.038  -7.319
  799    HB3  TYR 101           HB1      TYR 101 114.133  -1.957  -7.079
  800    HD1  TYR 101           HD1      TYR 101 116.322  -0.943  -7.800
  801    HD2  TYR 101           HD2      TYR 101 112.694   1.265  -7.788
  802    HE1  TYR 101           HE1      TYR 101 117.600   1.156  -7.827
  803    HE2  TYR 101           HE2      TYR 101 113.959   3.372  -7.815
  804    HH   TYR 101           HH       TYR 101 116.075   4.230  -7.310
  805    HA   PRO 102           HA       PRO 102 115.678  -4.850 -10.983
  806    HB2  PRO 102           HB2      PRO 102 117.624  -3.683 -12.466
  807    HB3  PRO 102           HB1      PRO 102 115.970  -3.915 -13.036
  808    HG2  PRO 102           HG2      PRO 102 117.257  -1.463 -11.917
  809    HG3  PRO 102           HG1      PRO 102 116.138  -1.622 -13.282
  810    HD2  PRO 102           HD2      PRO 102 115.353  -0.793 -10.822
  811    HD3  PRO 102           HD1      PRO 102 114.289  -1.686 -11.928
  812    H    LEU 103           HN       LEU 103 117.483  -5.953 -10.584
  813    HA   LEU 103           HA       LEU 103 119.524  -4.823  -8.786
  814    HB2  LEU 103           HB2      LEU 103 117.924  -7.258  -8.710
  815    HB3  LEU 103           HB1      LEU 103 119.635  -7.640  -8.749
  816    HG   LEU 103           HG       LEU 103 118.623  -7.609  -6.478
  817   HD11  LEU 103          HD11      LEU 103 120.400  -6.269  -5.387
  818   HD12  LEU 103          HD12      LEU 103 120.797  -5.584  -6.956
  819   HD13  LEU 103          HD13      LEU 103 120.999  -7.309  -6.671
  820   HD21  LEU 103          HD21      LEU 103 118.071  -5.471  -5.433
  821   HD22  LEU 103          HD22      LEU 103 117.036  -5.802  -6.825
  822   HD23  LEU 103          HD23      LEU 103 118.355  -4.645  -6.966
  823    HA   PRO 104           HA       PRO 104 121.601  -6.168 -12.758
  824    HB2  PRO 104           HB2      PRO 104 122.578  -3.596 -13.361
  825    HB3  PRO 104           HB1      PRO 104 121.184  -4.374 -14.109
  826    HG2  PRO 104           HG2      PRO 104 121.141  -2.088 -12.461
  827    HG3  PRO 104           HG1      PRO 104 119.743  -3.038 -12.973
  828    HD2  PRO 104           HD2      PRO 104 121.230  -3.106 -10.386
  829    HD3  PRO 104           HD1      PRO 104 119.511  -3.402 -10.715
  830    H    PHE 105           HN       PHE 105 122.410  -4.855  -9.898
  831    HA   PHE 105           HA       PHE 105 125.263  -5.295 -10.264
  832    HB2  PHE 105           HB2      PHE 105 123.902  -3.053  -8.762
  833    HB3  PHE 105           HB1      PHE 105 125.571  -3.520  -8.437
  834    HD1  PHE 105           HD1      PHE 105 123.290  -2.279 -11.073
  835    HD2  PHE 105           HD2      PHE 105 127.315  -2.826  -9.821
  836    HE1  PHE 105           HE1      PHE 105 124.059  -0.942 -12.977
  837    HE2  PHE 105           HE2      PHE 105 128.088  -1.485 -11.726
  838    HZ   PHE 105           HZ       PHE 105 126.460  -0.551 -13.303
  839    H    ASP 106           HN       ASP 106 126.219  -6.372  -8.692
  840    HA   ASP 106           HA       ASP 106 124.495  -8.207  -7.313
  841    HB2  ASP 106           HB2      ASP 106 127.473  -8.017  -7.069
  842    HB3  ASP 106           HB1      ASP 106 126.463  -9.384  -6.710
  843    HA   PRO 107           HA       PRO 107 125.350  -6.348  -3.335
  844    HB2  PRO 107           HB2      PRO 107 123.871  -8.372  -2.030
  845    HB3  PRO 107           HB1      PRO 107 123.199  -6.893  -2.712
  846    HG2  PRO 107           HG2      PRO 107 122.641  -9.489  -3.658
  847    HG3  PRO 107           HG1      PRO 107 122.399  -7.970  -4.562
  848    HD2  PRO 107           HD2      PRO 107 124.731  -9.802  -4.571
  849    HD3  PRO 107           HD1      PRO 107 123.889  -9.195  -5.955
  850    H    ASP 108           HN       ASP 108 126.528  -8.961  -4.687
  851    HA   ASP 108           HA       ASP 108 127.500 -10.434  -2.503
  852    HB2  ASP 108           HB2      ASP 108 126.783 -11.744  -4.326
  853    HB3  ASP 108           HB1      ASP 108 127.713 -10.796  -5.478
  854    H    ASP 109           HN       ASP 109 128.725  -8.837  -5.358
  855    HA   ASP 109           HA       ASP 109 131.450  -8.969  -5.003
  856    HB2  ASP 109           HB2      ASP 109 130.208  -8.336  -7.092
  857    HB3  ASP 109           HB1      ASP 109 129.905  -6.759  -6.378
  858    HA   PRO 110           HA       PRO 110 132.384  -6.287  -1.521
  859    HB2  PRO 110           HB2      PRO 110 134.732  -5.691  -3.239
  860    HB3  PRO 110           HB1      PRO 110 134.690  -6.084  -1.525
  861    HG2  PRO 110           HG2      PRO 110 135.407  -7.949  -3.214
  862    HG3  PRO 110           HG1      PRO 110 134.192  -8.363  -1.985
  863    HD2  PRO 110           HD2      PRO 110 133.783  -7.687  -4.879
  864    HD3  PRO 110           HD1      PRO 110 133.056  -8.991  -3.905
  865    H    ASN 111           HN       ASN 111 134.070  -4.099  -1.652
  866    HA   ASN 111           HA       ASN 111 134.352  -2.080  -2.023
  867    HB2  ASN 111           HB2      ASN 111 132.294  -2.182  -4.217
  868    HB3  ASN 111           HB1      ASN 111 133.186  -0.749  -3.692
  869   HD21  ASN 111          HD21      ASN 111 135.680  -2.199  -3.248
  870   HD22  ASN 111          HD22      ASN 111 136.307  -2.552  -4.806
  871    H    THR 112           HN       THR 112 133.852  -0.773  -0.670
  872    HA   THR 112           HA       THR 112 131.514  -0.913   0.896
  873    HB   THR 112           HB       THR 112 133.572   1.282   0.746
  874    HG1  THR 112           HG1      THR 112 133.923  -1.201   1.329
  875   HG21  THR 112          HG21      THR 112 131.695   0.488   2.983
  876   HG22  THR 112          HG22      THR 112 131.574   1.919   1.959
  877   HG23  THR 112          HG23      THR 112 132.933   1.754   3.074
  878    H    SER 113           HN       SER 113 132.490   0.921  -1.600
  879    HA   SER 113           HA       SER 113 130.201   2.702  -1.678
  880    HB2  SER 113           HB2      SER 113 131.570   2.925  -4.082
  881    HB3  SER 113           HB1      SER 113 131.730   3.976  -2.671
  882    HG   SER 113           HG       SER 113 133.553   3.079  -2.188
  883    H    LEU 114           HN       LEU 114 128.375   2.036  -2.453
  884    HA   LEU 114           HA       LEU 114 128.329  -0.197  -4.363
  885    HB2  LEU 114           HB2      LEU 114 125.961   1.054  -3.004
  886    HB3  LEU 114           HB1      LEU 114 126.065  -0.531  -3.739
  887    HG   LEU 114           HG       LEU 114 127.148   0.385  -1.106
  888   HD11  LEU 114          HD11      LEU 114 124.905  -0.319  -1.081
  889   HD12  LEU 114          HD12      LEU 114 125.903  -1.523  -0.255
  890   HD13  LEU 114          HD13      LEU 114 125.305  -1.831  -1.894
  891   HD21  LEU 114          HD21      LEU 114 127.820  -2.145  -2.552
  892   HD22  LEU 114          HD22      LEU 114 128.279  -1.719  -0.862
  893   HD23  LEU 114          HD23      LEU 114 128.843  -0.739  -2.234
  894    H    VAL 115           HN       VAL 115 128.530   0.627  -6.301
  895    HA   VAL 115           HA       VAL 115 126.964   3.015  -6.871
  896    HB   VAL 115           HB       VAL 115 128.451   3.706  -8.560
  897   HG11  VAL 115          HG11      VAL 115 130.590   4.036  -7.430
  898   HG12  VAL 115          HG12      VAL 115 130.096   2.858  -6.212
  899   HG13  VAL 115          HG13      VAL 115 129.189   4.357  -6.407
  900   HG21  VAL 115          HG21      VAL 115 129.909   1.069  -8.293
  901   HG22  VAL 115          HG22      VAL 115 130.520   2.457  -9.197
  902   HG23  VAL 115          HG23      VAL 115 129.014   1.690  -9.693
  903    H    THR 116           HN       THR 116 125.484   2.944  -8.297
  904    HA   THR 116           HA       THR 116 125.395   0.602 -10.008
  905    HB   THR 116           HB       THR 116 123.289   1.171  -8.635
  906    HG1  THR 116           HG1      THR 116 122.199   1.467 -11.055
  907   HG21  THR 116          HG21      THR 116 123.211   3.489 -10.540
  908   HG22  THR 116          HG22      THR 116 123.436   3.623  -8.792
  909   HG23  THR 116          HG23      THR 116 121.890   3.050  -9.449
  910    H    SER 117           HN       SER 117 125.447   1.010 -12.214
  911    HA   SER 117           HA       SER 117 126.778   3.423 -12.866
  912    HB2  SER 117           HB2      SER 117 125.877   1.141 -14.648
  913    HB3  SER 117           HB1      SER 117 126.920   2.469 -15.160
  914    HG   SER 117           HG       SER 117 128.449   1.805 -13.674
  915    H    VAL 118           HN       VAL 118 125.752   5.185 -13.472
  916    HA   VAL 118           HA       VAL 118 122.912   4.946 -13.899
  917    HB   VAL 118           HB       VAL 118 123.482   6.456 -12.134
  918   HG11  VAL 118          HG11      VAL 118 125.257   7.943 -14.055
  919   HG12  VAL 118          HG12      VAL 118 125.769   6.920 -12.715
  920   HG13  VAL 118          HG13      VAL 118 124.901   8.427 -12.389
  921   HG21  VAL 118          HG21      VAL 118 122.491   8.587 -12.894
  922   HG22  VAL 118          HG22      VAL 118 121.599   7.187 -13.490
  923   HG23  VAL 118          HG23      VAL 118 122.689   8.061 -14.566
  924    H    ALA 119           HN       ALA 119 122.549   4.450 -15.909
  925    HA   ALA 119           HA       ALA 119 123.704   6.165 -17.979
  926    HB1  ALA 119           HB1      ALA 119 124.084   3.749 -18.337
  927    HB2  ALA 119           HB2      ALA 119 123.007   4.406 -19.570
  928    HB3  ALA 119           HB3      ALA 119 122.347   3.465 -18.234
  929    H    ILE 120           HN       ILE 120 122.388   7.689 -17.153
  930    HA   ILE 120           HA       ILE 120 119.659   7.686 -18.208
  931    HB   ILE 120           HB       ILE 120 120.459   8.723 -15.459
  932   HG12  ILE 120          HG12      ILE 120 120.298   6.258 -15.424
  933   HG13  ILE 120          HG11      ILE 120 119.029   6.994 -14.458
  934   HG21  ILE 120          HG21      ILE 120 117.719   8.577 -16.712
  935   HG22  ILE 120          HG22      ILE 120 118.723  10.009 -16.617
  936   HG23  ILE 120          HG23      ILE 120 118.108   9.269 -15.127
  937   HD11  ILE 120          HD11      ILE 120 118.730   5.836 -17.223
  938   HD12  ILE 120          HD12      ILE 120 117.435   6.590 -16.291
  939   HD13  ILE 120          HD13      ILE 120 118.184   5.097 -15.717
  940    H    LEU 121           HN       LEU 121 122.318   9.483 -16.622
  941    HA   LEU 121           HA       LEU 121 122.006  11.933 -17.895
  942    HB2  LEU 121           HB2      LEU 121 123.475  11.086 -15.893
  943    HB3  LEU 121           HB1      LEU 121 124.583  10.590 -17.152
  944    HG   LEU 121           HG       LEU 121 123.671  13.391 -16.710
  945   HD11  LEU 121          HD11      LEU 121 126.227  12.038 -15.812
  946   HD12  LEU 121          HD12      LEU 121 124.912  12.580 -14.771
  947   HD13  LEU 121          HD13      LEU 121 125.882  13.761 -15.649
  948   HD21  LEU 121          HD21      LEU 121 124.518  13.012 -18.973
  949   HD22  LEU 121          HD22      LEU 121 126.001  12.319 -18.316
  950   HD23  LEU 121          HD23      LEU 121 125.639  14.027 -18.066
  951    H    ASP 122           HN       ASP 122 122.690  12.487 -19.984
  952    HA   ASP 122           HA       ASP 122 123.285  10.272 -21.669
  953    HB2  ASP 122           HB2      ASP 122 122.962  11.809 -23.545
  954    HB3  ASP 122           HB1      ASP 122 121.606  11.857 -22.439
  955    H    LYS 123           HN       LYS 123 125.333   9.709 -20.977
  956    HA   LYS 123           HA       LYS 123 127.317  11.487 -22.074
  957    HB2  LYS 123           HB2      LYS 123 129.051  10.231 -20.881
  958    HB3  LYS 123           HB1      LYS 123 127.917  10.959 -19.764
  959    HG2  LYS 123           HG2      LYS 123 127.800   8.061 -20.575
  960    HG3  LYS 123           HG1      LYS 123 128.809   8.624 -19.251
  961    HD2  LYS 123           HD2      LYS 123 126.800   9.506 -18.130
  962    HD3  LYS 123           HD1      LYS 123 125.803   8.892 -19.446
  963    HE2  LYS 123           HE2      LYS 123 125.806   7.383 -17.514
  964    HE3  LYS 123           HE1      LYS 123 126.490   6.616 -18.943
  965    HZ1  LYS 123           HZ1      LYS 123 128.685   7.002 -18.081
  966    HZ2  LYS 123           HZ2      LYS 123 127.791   6.181 -16.926
  967    HZ3  LYS 123           HZ3      LYS 123 128.079   7.821 -16.744
  968    H    GLU 124           HN       GLU 124 127.787  11.124 -23.962
  969    HA   GLU 124           HA       GLU 124 127.323   8.545 -25.234
  970    HB2  GLU 124           HB2      GLU 124 126.250  10.548 -26.114
  971    HB3  GLU 124           HB1      GLU 124 127.805  11.326 -26.288
  972    HG2  GLU 124           HG2      GLU 124 128.412   9.640 -27.976
  973    HG3  GLU 124           HG1      GLU 124 126.790   8.957 -27.824
  974    HA   PRO 125           HA       PRO 125 131.892   8.490 -25.270
  975    HB2  PRO 125           HB2      PRO 125 131.894   5.675 -24.916
  976    HB3  PRO 125           HB1      PRO 125 132.227   6.894 -23.686
  977    HG2  PRO 125           HG2      PRO 125 130.023   5.181 -23.721
  978    HG3  PRO 125           HG1      PRO 125 130.167   6.659 -22.758
  979    HD2  PRO 125           HD2      PRO 125 128.760   6.223 -25.361
  980    HD3  PRO 125           HD1      PRO 125 128.320   7.256 -23.982
  981    H1   ARG 151           HT1      ARG 151 121.433  16.351  -5.023
  982    H2   ARG 151           HT2      ARG 151 122.787  16.426  -6.050
  983    H3   ARG 151           HT3      ARG 151 122.939  16.800  -4.425
  984    HA   ARG 151           HA       ARG 151 121.914  14.366  -4.279
  985    HB2  ARG 151           HB2      ARG 151 122.265  14.092  -6.733
  986    HB3  ARG 151           HB1      ARG 151 123.981  14.386  -6.487
  987    HG2  ARG 151           HG2      ARG 151 123.551  12.023  -6.707
  988    HG3  ARG 151           HG1      ARG 151 124.112  12.395  -5.074
  989    HD2  ARG 151           HD2      ARG 151 121.698  12.442  -4.358
  990    HD3  ARG 151           HD1      ARG 151 121.284  11.844  -5.966
  991    HE   ARG 151           HE       ARG 151 123.262  10.288  -4.709
  992   HH11  ARG 151          HH11      ARG 151 119.782  10.927  -4.518
  993   HH12  ARG 151          HH12      ARG 151 119.370   9.338  -4.101
  994   HH21  ARG 151          HH21      ARG 151 122.772   8.182  -4.037
  995   HH22  ARG 151          HH22      ARG 151 121.208   7.650  -3.806
  996    H    SER 152           HN       SER 152 123.074  13.490  -2.545
  997    HA   SER 152           HA       SER 152 125.573  14.846  -1.998
  998    HB2  SER 152           HB2      SER 152 123.760  15.002  -0.304
  999    HB3  SER 152           HB1      SER 152 123.806  13.252  -0.128
 1000    HG   SER 152           HG       SER 152 125.805  15.143   0.523
 1001    H    SER 153           HN       SER 153 124.224  11.499  -1.740
 1002    HA   SER 153           HA       SER 153 127.003  10.597  -1.887
 1003    HB2  SER 153           HB2      SER 153 124.562   9.036  -1.059
 1004    HB3  SER 153           HB1      SER 153 126.255   8.577  -0.822
 1005    HG   SER 153           HG       SER 153 124.663  10.456   0.407
 1006    H    ARG 154           HN       ARG 154 127.551   8.760  -3.218
 1007    HA   ARG 154           HA       ARG 154 125.627   8.100  -5.340
 1008    HB2  ARG 154           HB2      ARG 154 128.594   8.605  -5.646
 1009    HB3  ARG 154           HB1      ARG 154 127.646   7.761  -6.859
 1010    HG2  ARG 154           HG2      ARG 154 126.256   9.752  -7.152
 1011    HG3  ARG 154           HG1      ARG 154 127.209  10.589  -5.927
 1012    HD2  ARG 154           HD2      ARG 154 128.285   9.470  -8.513
 1013    HD3  ARG 154           HD1      ARG 154 127.901  11.166  -8.233
 1014    HE   ARG 154           HE       ARG 154 129.573  10.760  -6.271
 1015   HH11  ARG 154          HH11      ARG 154 129.878   9.650  -9.618
 1016   HH12  ARG 154          HH12      ARG 154 131.566   9.723  -9.661
 1017   HH21  ARG 154          HH21      ARG 154 131.930  10.840  -6.307
 1018   HH22  ARG 154          HH22      ARG 154 132.781  10.351  -7.697
 1019    H    THR 155           HN       THR 155 126.368   6.905  -2.794
 1020    HA   THR 155           HA       THR 155 126.812   4.175  -3.724
 1021    HB   THR 155           HB       THR 155 129.007   4.658  -2.952
 1022    HG1  THR 155           HG1      THR 155 128.029   3.628  -0.570
 1023   HG21  THR 155          HG21      THR 155 127.753   5.898  -0.518
 1024   HG22  THR 155          HG22      THR 155 128.726   6.732  -1.753
 1025   HG23  THR 155          HG23      THR 155 129.457   5.500  -0.697
 1026    H    ARG 156           HN       ARG 156 125.265   3.064  -3.180
 1027    HA   ARG 156           HA       ARG 156 123.195   3.828  -1.396
 1028    HB2  ARG 156           HB2      ARG 156 124.007   1.048  -2.282
 1029    HB3  ARG 156           HB1      ARG 156 122.515   1.507  -1.485
 1030    HG2  ARG 156           HG2      ARG 156 123.327   2.466  -4.201
 1031    HG3  ARG 156           HG1      ARG 156 122.351   1.032  -3.910
 1032    HD2  ARG 156           HD2      ARG 156 120.933   2.787  -2.465
 1033    HD3  ARG 156           HD1      ARG 156 121.624   3.904  -3.647
 1034    HE   ARG 156           HE       ARG 156 120.254   1.472  -4.533
 1035   HH11  ARG 156          HH11      ARG 156 120.263   5.025  -4.430
 1036   HH12  ARG 156          HH12      ARG 156 119.038   5.188  -5.589
 1037   HH21  ARG 156          HH21      ARG 156 118.590   1.680  -6.031
 1038   HH22  ARG 156          HH22      ARG 156 118.042   3.194  -6.593
 1039    H    ARG 157           HN       ARG 157 123.072   3.483   0.870
 1040    HA   ARG 157           HA       ARG 157 125.444   2.331   2.057
 1041    HB2  ARG 157           HB2      ARG 157 124.756   4.445   2.945
 1042    HB3  ARG 157           HB1      ARG 157 123.091   3.934   3.056
 1043    HG2  ARG 157           HG2      ARG 157 125.241   2.719   4.758
 1044    HG3  ARG 157           HG1      ARG 157 124.390   4.198   5.216
 1045    HD2  ARG 157           HD2      ARG 157 123.183   1.490   4.687
 1046    HD3  ARG 157           HD1      ARG 157 123.294   2.320   6.239
 1047    HE   ARG 157           HE       ARG 157 121.901   4.090   4.979
 1048   HH11  ARG 157          HH11      ARG 157 121.561   0.730   4.192
 1049   HH12  ARG 157          HH12      ARG 157 119.862   0.689   4.162
 1050   HH21  ARG 157          HH21      ARG 157 119.604   4.161   4.917
 1051   HH22  ARG 157          HH22      ARG 157 118.694   2.755   4.606
 1052    H    GLU 158           HN       GLU 158 125.367   0.454   3.440
 1053    HA   GLU 158           HA       GLU 158 123.043  -1.211   2.845
 1054    HB2  GLU 158           HB2      GLU 158 125.288  -1.938   2.046
 1055    HB3  GLU 158           HB1      GLU 158 125.845  -1.972   3.701
 1056    HG2  GLU 158           HG2      GLU 158 123.586  -3.711   2.763
 1057    HG3  GLU 158           HG1      GLU 158 125.268  -4.176   2.551
 1058    H    THR 159           HN       THR 159 121.680  -1.732   4.399
 1059    HA   THR 159           HA       THR 159 122.531  -1.763   7.186
 1060    HB   THR 159           HB       THR 159 120.093  -0.282   6.122
 1061    HG1  THR 159           HG1      THR 159 122.396   0.344   7.525
 1062   HG21  THR 159          HG21      THR 159 120.589  -0.923   9.081
 1063   HG22  THR 159          HG22      THR 159 119.288  -1.596   8.110
 1064   HG23  THR 159          HG23      THR 159 119.313   0.118   8.465
 1065    H    GLN 160           HN       GLN 160 122.263  -3.629   7.916
 1066    HA   GLN 160           HA       GLN 160 120.516  -5.513   6.683
 1067    HB2  GLN 160           HB2      GLN 160 122.626  -6.329   7.479
 1068    HB3  GLN 160           HB1      GLN 160 122.351  -5.654   9.076
 1069    HG2  GLN 160           HG2      GLN 160 120.533  -7.277   9.426
 1070    HG3  GLN 160           HG1      GLN 160 120.858  -7.962   7.835
 1071   HE21  GLN 160          HE21      GLN 160 121.298  -9.993   8.834
 1072   HE22  GLN 160          HE22      GLN 160 122.797 -10.253   9.634
 1073    H    VAL 161           HN       VAL 161 118.444  -5.796   7.175
 1074    HA   VAL 161           HA       VAL 161 117.728  -5.062   9.827
 1075    HB   VAL 161           HB       VAL 161 115.476  -4.380   9.094
 1076   HG11  VAL 161          HG11      VAL 161 115.906  -2.429   7.868
 1077   HG12  VAL 161          HG12      VAL 161 117.507  -2.995   7.410
 1078   HG13  VAL 161          HG13      VAL 161 117.151  -2.617   9.122
 1079   HG21  VAL 161          HG21      VAL 161 116.401  -4.813   6.271
 1080   HG22  VAL 161          HG22      VAL 161 114.864  -4.123   6.772
 1081   HG23  VAL 161          HG23      VAL 161 115.230  -5.817   7.128
  Start of MODEL    9
    1    H1   GLY  -3           HT1      GLY  -3 117.620   8.922 -22.422
    2    H2   GLY  -3           HT2      GLY  -3 116.132   8.376 -23.004
    3    H3   GLY  -3           HT3      GLY  -3 116.367   8.620 -21.342
    4    HA2  GLY  -3           HA1      GLY  -3 116.462  10.733 -23.407
    5    HA3  GLY  -3           HA2      GLY  -3 115.120  10.473 -22.307
    6    H    ALA  -2           HN       ALA  -2 115.402  12.592 -21.422
    7    HA   ALA  -2           HA       ALA  -2 117.975  13.267 -20.247
    8    HB1  ALA  -2           HB1      ALA  -2 116.838  14.948 -21.613
    9    HB2  ALA  -2           HB2      ALA  -2 117.041  15.488 -19.949
   10    HB3  ALA  -2           HB3      ALA  -2 115.468  14.917 -20.504
   11    H    MET  -1           HN       MET  -1 115.396  11.587 -19.240
   12    HA   MET  -1           HA       MET  -1 115.753  12.433 -16.469
   13    HB2  MET  -1           HB2      MET  -1 113.496  13.064 -17.435
   14    HB3  MET  -1           HB1      MET  -1 113.197  11.361 -17.719
   15    HG2  MET  -1           HG2      MET  -1 113.315  10.941 -15.305
   16    HG3  MET  -1           HG1      MET  -1 113.595  12.659 -15.030
   17    HE1  MET  -1           HE1      MET  -1 109.927  12.130 -13.724
   18    HE2  MET  -1           HE2      MET  -1 111.542  12.711 -13.317
   19    HE3  MET  -1           HE3      MET  -1 111.270  10.993 -13.603
   20    H    GLY   0           HN       GLY   0 117.385  10.658 -17.703
   21    HA2  GLY   0           HA2      GLY   0 116.430   7.949 -17.261
   22    HA3  GLY   0           HA1      GLY   0 118.009   8.404 -17.883
   23    H    LYS   1           HN       LYS   1 117.369  10.212 -15.221
   24    HA   LYS   1           HA       LYS   1 119.081   8.552 -13.543
   25    HB2  LYS   1           HB2      LYS   1 118.119  11.409 -13.234
   26    HB3  LYS   1           HB1      LYS   1 119.053  10.564 -12.020
   27    HG2  LYS   1           HG2      LYS   1 120.627  11.868 -13.115
   28    HG3  LYS   1           HG1      LYS   1 120.803  10.267 -13.823
   29    HD2  LYS   1           HD2      LYS   1 120.916  12.091 -15.517
   30    HD3  LYS   1           HD1      LYS   1 119.590  10.965 -15.810
   31    HE2  LYS   1           HE2      LYS   1 117.985  12.489 -15.304
   32    HE3  LYS   1           HE1      LYS   1 119.016  13.432 -14.197
   33    HZ1  LYS   1           HZ1      LYS   1 120.144  14.233 -16.246
   34    HZ2  LYS   1           HZ2      LYS   1 118.526  14.656 -16.183
   35    HZ3  LYS   1           HZ3      LYS   1 119.013  13.401 -17.176
   36    HA   PRO   2           HA       PRO   2 115.627   7.250 -11.139
   37    HB2  PRO   2           HB2      PRO   2 116.872   6.970  -8.691
   38    HB3  PRO   2           HB1      PRO   2 116.865   5.750  -9.967
   39    HG2  PRO   2           HG2      PRO   2 118.933   7.697  -9.189
   40    HG3  PRO   2           HG1      PRO   2 119.161   6.050  -9.818
   41    HD2  PRO   2           HD2      PRO   2 119.515   8.349 -11.271
   42    HD3  PRO   2           HD1      PRO   2 119.077   6.817 -12.029
   43    H    PHE   3           HN       PHE   3 114.195   8.323 -10.368
   44    HA   PHE   3           HA       PHE   3 114.499  11.098  -9.811
   45    HB2  PHE   3           HB2      PHE   3 111.861  10.815  -9.834
   46    HB3  PHE   3           HB1      PHE   3 112.808  10.781 -11.342
   47    HD1  PHE   3           HD1      PHE   3 111.532   8.603  -8.668
   48    HD2  PHE   3           HD2      PHE   3 112.429   9.022 -12.776
   49    HE1  PHE   3           HE1      PHE   3 110.619   6.422  -9.050
   50    HE2  PHE   3           HE2      PHE   3 111.497   6.780 -13.216
   51    HZ   PHE   3           HZ       PHE   3 110.587   5.457 -11.350
   52    H    PHE   4           HN       PHE   4 113.497  12.133  -8.215
   53    HA   PHE   4           HA       PHE   4 112.519  10.708  -5.922
   54    HB2  PHE   4           HB2      PHE   4 114.787  10.977  -5.128
   55    HB3  PHE   4           HB1      PHE   4 114.825  12.623  -5.782
   56    HD1  PHE   4           HD1      PHE   4 113.879  14.481  -4.619
   57    HD2  PHE   4           HD2      PHE   4 113.532  10.568  -3.012
   58    HE1  PHE   4           HE1      PHE   4 112.997  15.434  -2.611
   59    HE2  PHE   4           HE2      PHE   4 112.665  11.519  -0.920
   60    HZ   PHE   4           HZ       PHE   4 112.390  13.958  -0.692
   61    H    THR   5           HN       THR   5 110.779  11.638  -5.324
   62    HA   THR   5           HA       THR   5 110.792  14.353  -4.595
   63    HB   THR   5           HB       THR   5 110.185  14.590  -6.889
   64    HG1  THR   5           HG1      THR   5 108.422  15.270  -4.868
   65   HG21  THR   5          HG21      THR   5 107.727  12.943  -6.261
   66   HG22  THR   5          HG22      THR   5 109.071  12.446  -7.266
   67   HG23  THR   5          HG23      THR   5 108.012  13.764  -7.802
   68    H    ARG   6           HN       ARG   6 110.723  11.883  -3.430
   69    HA   ARG   6           HA       ARG   6 109.903  10.942  -1.496
   70    HB2  ARG   6           HB2      ARG   6 109.912  13.417  -0.842
   71    HB3  ARG   6           HB1      ARG   6 108.197  13.433  -1.245
   72    HG2  ARG   6           HG2      ARG   6 108.009  12.942   0.976
   73    HG3  ARG   6           HG1      ARG   6 108.234  11.358   0.152
   74    HD2  ARG   6           HD2      ARG   6 109.679  11.485   2.169
   75    HD3  ARG   6           HD1      ARG   6 110.590  11.370   0.657
   76    HE   ARG   6           HE       ARG   6 110.506  13.994   0.975
   77   HH11  ARG   6          HH11      ARG   6 111.437  11.488   3.332
   78   HH12  ARG   6          HH12      ARG   6 112.358  12.558   4.272
   79   HH21  ARG   6          HH21      ARG   6 111.784  15.414   2.262
   80   HH22  ARG   6          HH22      ARG   6 112.585  14.849   3.652
   81    H    ASN   7           HN       ASN   7 108.710  10.464  -3.924
   82    HA   ASN   7           HA       ASN   7 105.937   9.834  -3.085
   83    HB2  ASN   7           HB2      ASN   7 106.962  10.796  -5.675
   84    HB3  ASN   7           HB1      ASN   7 105.626   9.667  -5.711
   85   HD21  ASN   7          HD21      ASN   7 106.055  11.983  -3.136
   86   HD22  ASN   7          HD22      ASN   7 104.764  13.028  -3.545
   87    HA   PRO   8           HA       PRO   8 106.928   5.389  -3.574
   88    HB2  PRO   8           HB2      PRO   8 104.076   5.264  -3.563
   89    HB3  PRO   8           HB1      PRO   8 105.134   4.431  -2.492
   90    HG2  PRO   8           HG2      PRO   8 103.490   6.506  -1.981
   91    HG3  PRO   8           HG1      PRO   8 104.857   6.122  -0.894
   92    HD2  PRO   8           HD2      PRO   8 104.335   8.315  -2.629
   93    HD3  PRO   8           HD1      PRO   8 105.700   8.184  -1.489
   94    H    SER   9           HN       SER   9 104.444   7.365  -4.724
   95    HA   SER   9           HA       SER   9 103.500   5.711  -6.525
   96    HB2  SER   9           HB2      SER   9 102.191   7.347  -5.543
   97    HB3  SER   9           HB1      SER   9 103.148   8.672  -6.209
   98    HG   SER   9           HG       SER   9 101.666   6.796  -7.739
   99    H    GLU  10           HN       GLU  10 106.229   7.963  -6.576
  100    HA   GLU  10           HA       GLU  10 106.266   8.404  -9.415
  101    HB2  GLU  10           HB2      GLU  10 108.380   9.568  -9.101
  102    HB3  GLU  10           HB1      GLU  10 107.325  10.059  -7.774
  103    HG2  GLU  10           HG2      GLU  10 108.547   8.336  -6.399
  104    HG3  GLU  10           HG1      GLU  10 109.651   8.165  -7.759
  105    H    LEU  11           HN       LEU  11 107.731   6.338  -7.018
  106    HA   LEU  11           HA       LEU  11 109.555   4.961  -8.576
  107    HB2  LEU  11           HB2      LEU  11 107.842   3.965  -6.324
  108    HB3  LEU  11           HB1      LEU  11 109.201   3.088  -7.000
  109    HG   LEU  11           HG       LEU  11 109.384   5.773  -5.625
  110   HD11  LEU  11          HD11      LEU  11 110.175   3.028  -4.722
  111   HD12  LEU  11          HD12      LEU  11 108.810   3.971  -4.121
  112   HD13  LEU  11          HD13      LEU  11 110.464   4.533  -3.841
  113   HD21  LEU  11          HD21      LEU  11 111.815   5.346  -5.700
  114   HD22  LEU  11          HD22      LEU  11 111.112   5.501  -7.308
  115   HD23  LEU  11          HD23      LEU  11 111.506   3.909  -6.680
  116    H    LYS  12           HN       LYS  12 109.531   3.529  -9.955
  117    HA   LYS  12           HA       LYS  12 107.056   3.027 -11.398
  118    HB2  LYS  12           HB2      LYS  12 108.494   2.094 -13.153
  119    HB3  LYS  12           HB1      LYS  12 108.934   3.740 -12.704
  120    HG2  LYS  12           HG2      LYS  12 110.778   3.071 -11.554
  121    HG3  LYS  12           HG1      LYS  12 110.201   1.416 -11.423
  122    HD2  LYS  12           HD2      LYS  12 110.583   1.055 -13.743
  123    HD3  LYS  12           HD1      LYS  12 111.021   2.756 -14.025
  124    HE2  LYS  12           HE2      LYS  12 112.933   2.369 -12.432
  125    HE3  LYS  12           HE1      LYS  12 112.505   0.662 -12.429
  126    HZ1  LYS  12           HZ1      LYS  12 113.399   2.268 -14.748
  127    HZ2  LYS  12           HZ2      LYS  12 112.897   0.655 -14.863
  128    HZ3  LYS  12           HZ3      LYS  12 114.270   1.067 -13.970
  129    H    GLY  13           HN       GLY  13 106.807   0.956 -12.472
  130    HA2  GLY  13           HA2      GLY  13 106.865  -1.405 -12.477
  131    HA3  GLY  13           HA1      GLY  13 107.590  -1.370 -10.874
  132    H    LYS  14           HN       LYS  14 106.356  -1.677  -9.199
  133    HA   LYS  14           HA       LYS  14 103.556  -1.082  -9.305
  134    HB2  LYS  14           HB2      LYS  14 103.040  -3.361  -8.287
  135    HB3  LYS  14           HB1      LYS  14 103.228  -3.255 -10.041
  136    HG2  LYS  14           HG2      LYS  14 105.565  -3.959  -8.405
  137    HG3  LYS  14           HG1      LYS  14 104.296  -5.183  -8.547
  138    HD2  LYS  14           HD2      LYS  14 104.503  -4.927 -11.058
  139    HD3  LYS  14           HD1      LYS  14 105.873  -3.855 -10.775
  140    HE2  LYS  14           HE2      LYS  14 107.104  -5.615  -9.722
  141    HE3  LYS  14           HE1      LYS  14 105.713  -6.695  -9.791
  142    HZ1  LYS  14           HZ1      LYS  14 105.878  -6.656 -12.206
  143    HZ2  LYS  14           HZ2      LYS  14 107.287  -7.215 -11.512
  144    HZ3  LYS  14           HZ3      LYS  14 107.237  -5.656 -12.138
  145    H    PHE  15           HN       PHE  15 102.598  -0.905  -7.336
  146    HA   PHE  15           HA       PHE  15 104.465  -0.413  -5.157
  147    HB2  PHE  15           HB2      PHE  15 103.438   1.547  -6.263
  148    HB3  PHE  15           HB1      PHE  15 101.854   0.867  -5.960
  149    HD1  PHE  15           HD1      PHE  15 104.179   0.507  -3.240
  150    HD2  PHE  15           HD2      PHE  15 101.413   3.099  -5.098
  151    HE1  PHE  15           HE1      PHE  15 104.084   1.871  -1.173
  152    HE2  PHE  15           HE2      PHE  15 101.289   4.476  -3.065
  153    HZ   PHE  15           HZ       PHE  15 102.626   3.896  -1.113
  154    H    ILE  16           HN       ILE  16 104.119  -1.732  -3.449
  155    HA   ILE  16           HA       ILE  16 101.473  -2.778  -3.003
  156    HB   ILE  16           HB       ILE  16 102.462  -4.975  -2.360
  157   HG12  ILE  16          HG12      ILE  16 104.855  -4.232  -2.379
  158   HG13  ILE  16          HG11      ILE  16 104.563  -5.752  -3.194
  159   HG21  ILE  16          HG21      ILE  16 102.448  -4.247  -5.276
  160   HG22  ILE  16          HG22      ILE  16 101.096  -4.840  -4.308
  161   HG23  ILE  16          HG23      ILE  16 102.457  -5.901  -4.668
  162   HD11  ILE  16          HD11      ILE  16 106.173  -4.280  -4.411
  163   HD12  ILE  16          HD12      ILE  16 104.855  -3.109  -4.657
  164   HD13  ILE  16          HD13      ILE  16 104.754  -4.699  -5.363
  165    H    HIS  17           HN       HIS  17 101.096  -3.521  -0.915
  166    HA   HIS  17           HA       HIS  17 102.882  -2.412   1.129
  167    HB2  HIS  17           HB2      HIS  17 101.056  -0.900   0.569
  168    HB3  HIS  17           HB1      HIS  17  99.887  -2.194   0.829
  169    HD1  HIS  17           HD1      HIS  17 101.398   0.734   2.485
  170    HD2  HIS  17           HD2      HIS  17  99.691  -2.875   3.689
  171    HE1  HIS  17           HE1      HIS  17 100.671   1.067   4.822
  172    H    THR  18           HN       THR  18 103.595  -4.218   1.927
  173    HA   THR  18           HA       THR  18 101.723  -6.393   2.660
  174    HB   THR  18           HB       THR  18 103.204  -7.196   0.894
  175    HG1  THR  18           HG1      THR  18 104.283  -8.320   3.245
  176   HG21  THR  18          HG21      THR  18 105.660  -7.330   1.202
  177   HG22  THR  18          HG22      THR  18 105.498  -6.439   2.714
  178   HG23  THR  18          HG23      THR  18 105.088  -5.657   1.186
  179    H    LYS  19           HN       LYS  19 101.764  -7.152   4.707
  180    HA   LYS  19           HA       LYS  19 103.184  -5.633   6.698
  181    HB2  LYS  19           HB2      LYS  19 100.878  -6.249   7.089
  182    HB3  LYS  19           HB1      LYS  19 101.236  -7.943   6.859
  183    HG2  LYS  19           HG2      LYS  19 102.364  -6.367   9.175
  184    HG3  LYS  19           HG1      LYS  19 100.765  -7.085   9.232
  185    HD2  LYS  19           HD2      LYS  19 102.050  -9.315   8.587
  186    HD3  LYS  19           HD1      LYS  19 103.453  -8.413   9.181
  187    HE2  LYS  19           HE2      LYS  19 102.475  -9.804  10.923
  188    HE3  LYS  19           HE1      LYS  19 102.420  -8.091  11.314
  189    HZ1  LYS  19           HZ1      LYS  19 100.093  -8.055  10.619
  190    HZ2  LYS  19           HZ2      LYS  19 100.345  -9.167  11.850
  191    HZ3  LYS  19           HZ3      LYS  19 100.143  -9.707  10.279
  192    H    LEU  20           HN       LEU  20 104.968  -6.184   7.785
  193    HA   LEU  20           HA       LEU  20 105.944  -8.899   7.438
  194    HB2  LEU  20           HB2      LEU  20 107.321  -6.394   6.907
  195    HB3  LEU  20           HB1      LEU  20 108.135  -7.303   8.176
  196    HG   LEU  20           HG       LEU  20 108.438  -9.193   6.758
  197   HD11  LEU  20          HD11      LEU  20 106.976  -7.682   4.608
  198   HD12  LEU  20          HD12      LEU  20 106.420  -9.144   5.445
  199   HD13  LEU  20          HD13      LEU  20 107.849  -9.207   4.431
  200   HD21  LEU  20          HD21      LEU  20 109.183  -6.693   5.315
  201   HD22  LEU  20          HD22      LEU  20 109.972  -8.272   5.214
  202   HD23  LEU  20          HD23      LEU  20 110.005  -7.353   6.724
  203    H    ARG  21           HN       ARG  21 105.905  -9.934   9.122
  204    HA   ARG  21           HA       ARG  21 105.336  -8.710  11.610
  205    HB2  ARG  21           HB2      ARG  21 104.289 -10.816  10.930
  206    HB3  ARG  21           HB1      ARG  21 105.870 -11.572  10.857
  207    HG2  ARG  21           HG2      ARG  21 106.132 -11.123  13.278
  208    HG3  ARG  21           HG1      ARG  21 104.462 -10.559  13.305
  209    HD2  ARG  21           HD2      ARG  21 103.671 -12.695  12.487
  210    HD3  ARG  21           HD1      ARG  21 105.331 -13.278  12.365
  211    HE   ARG  21           HE       ARG  21 104.194 -12.476  14.934
  212   HH11  ARG  21          HH11      ARG  21 105.621 -14.954  12.849
  213   HH12  ARG  21          HH12      ARG  21 105.810 -16.114  14.064
  214   HH21  ARG  21          HH21      ARG  21 104.467 -14.088  16.666
  215   HH22  ARG  21          HH22      ARG  21 105.136 -15.599  16.278
  216    H    LYS  22           HN       LYS  22 107.114  -7.661  12.439
  217    HA   LYS  22           HA       LYS  22 109.699  -7.822  12.433
  218    HB2  LYS  22           HB2      LYS  22 107.821  -7.637  14.693
  219    HB3  LYS  22           HB1      LYS  22 109.541  -7.662  14.995
  220    HG2  LYS  22           HG2      LYS  22 108.760  -5.416  15.008
  221    HG3  LYS  22           HG1      LYS  22 109.799  -5.816  13.639
  222    HD2  LYS  22           HD2      LYS  22 108.155  -5.351  12.166
  223    HD3  LYS  22           HD1      LYS  22 106.964  -6.039  13.295
  224    HE2  LYS  22           HE2      LYS  22 106.590  -3.641  13.002
  225    HE3  LYS  22           HE1      LYS  22 106.979  -4.058  14.654
  226    HZ1  LYS  22           HZ1      LYS  22 108.929  -2.860  12.726
  227    HZ2  LYS  22           HZ2      LYS  22 109.158  -3.104  14.400
  228    HZ3  LYS  22           HZ3      LYS  22 108.041  -2.034  13.861
  229    H    SER  23           HN       SER  23 110.805  -9.565  12.184
  230    HA   SER  23           HA       SER  23 110.408 -11.996  13.633
  231    HB2  SER  23           HB2      SER  23 111.078 -11.912  11.218
  232    HB3  SER  23           HB1      SER  23 112.565 -11.102  11.669
  233    HG   SER  23           HG       SER  23 112.863 -13.347  11.335
  234    H    SER  24           HN       SER  24 113.347 -12.429  13.839
  235    HA   SER  24           HA       SER  24 113.738 -11.727  16.507
  236    HB2  SER  24           HB2      SER  24 115.812 -12.502  14.478
  237    HB3  SER  24           HB1      SER  24 115.925 -12.685  16.232
  238    HG   SER  24           HG       SER  24 114.826 -14.319  14.436
  239    H    ARG  25           HN       ARG  25 113.347  -9.412  16.506
  240    HA   ARG  25           HA       ARG  25 113.893  -7.381  16.860
  241    HB2  ARG  25           HB2      ARG  25 116.495  -8.654  17.251
  242    HB3  ARG  25           HB1      ARG  25 116.404  -6.883  17.249
  243    HG2  ARG  25           HG2      ARG  25 114.730  -6.870  18.899
  244    HG3  ARG  25           HG1      ARG  25 114.552  -8.618  18.803
  245    HD2  ARG  25           HD2      ARG  25 115.700  -7.921  20.709
  246    HD3  ARG  25           HD1      ARG  25 116.663  -8.924  19.587
  247    HE   ARG  25           HE       ARG  25 117.862  -6.945  18.937
  248   HH11  ARG  25          HH11      ARG  25 115.979  -6.550  21.911
  249   HH12  ARG  25          HH12      ARG  25 116.931  -5.278  22.513
  250   HH21  ARG  25          HH21      ARG  25 119.170  -5.220  19.761
  251   HH22  ARG  25          HH22      ARG  25 118.818  -4.487  21.251
  252    H    GLY  26           HN       GLY  26 113.349  -7.859  14.363
  253    HA2  GLY  26           HA2      GLY  26 113.903  -5.676  12.931
  254    HA3  GLY  26           HA1      GLY  26 115.293  -6.722  12.600
  255    H    PHE  27           HN       PHE  27 115.001  -7.469  10.685
  256    HA   PHE  27           HA       PHE  27 112.398  -8.635  10.059
  257    HB2  PHE  27           HB2      PHE  27 114.023  -6.637   8.684
  258    HB3  PHE  27           HB1      PHE  27 112.921  -7.628   7.680
  259    HD1  PHE  27           HD2      PHE  27 110.444  -7.593   8.928
  260    HD2  PHE  27           HD1      PHE  27 113.531  -4.715   9.334
  261    HE1  PHE  27           HE2      PHE  27 108.798  -5.903   9.776
  262    HE2  PHE  27           HE1      PHE  27 111.944  -3.118  10.174
  263    HZ   PHE  27           HZ       PHE  27 109.603  -3.705  10.429
  264    H    GLY  28           HN       GLY  28 115.586  -8.363   8.359
  265    HA2  GLY  28           HA2      GLY  28 116.832 -10.464   8.071
  266    HA3  GLY  28           HA1      GLY  28 115.293 -11.280   7.870
  267    H    PHE  29           HN       PHE  29 116.684  -8.330   6.584
  268    HA   PHE  29           HA       PHE  29 117.373  -9.484   4.158
  269    HB2  PHE  29           HB2      PHE  29 115.971  -8.004   2.664
  270    HB3  PHE  29           HB1      PHE  29 115.098  -9.300   3.439
  271    HD1  PHE  29           HD2      PHE  29 113.489  -8.820   5.163
  272    HD2  PHE  29           HD1      PHE  29 115.532  -5.746   3.146
  273    HE1  PHE  29           HE2      PHE  29 111.805  -7.210   5.941
  274    HE2  PHE  29           HE1      PHE  29 113.848  -4.098   3.904
  275    HZ   PHE  29           HZ       PHE  29 111.975  -4.843   5.310
  276    H    THR  30           HN       THR  30 118.804  -8.141   3.048
  277    HA   THR  30           HA       THR  30 119.482  -5.905   4.754
  278    HB   THR  30           HB       THR  30 121.837  -6.187   3.934
  279    HG1  THR  30           HG1      THR  30 122.129  -8.395   2.950
  280   HG21  THR  30          HG21      THR  30 121.011  -7.268   6.014
  281   HG22  THR  30          HG22      THR  30 122.295  -8.201   5.234
  282   HG23  THR  30          HG23      THR  30 120.612  -8.697   5.074
  283    H    VAL  31           HN       VAL  31 119.785  -3.926   3.859
  284    HA   VAL  31           HA       VAL  31 118.810  -3.774   1.099
  285    HB   VAL  31           HB       VAL  31 117.397  -1.875   1.738
  286   HG11  VAL  31          HG11      VAL  31 115.798  -2.937   3.144
  287   HG12  VAL  31          HG12      VAL  31 117.003  -4.111   3.656
  288   HG13  VAL  31          HG13      VAL  31 116.452  -4.095   1.983
  289   HG21  VAL  31          HG21      VAL  31 118.766  -0.913   3.440
  290   HG22  VAL  31          HG22      VAL  31 118.464  -2.340   4.457
  291   HG23  VAL  31          HG23      VAL  31 117.127  -1.255   4.039
  292    H    VAL  32           HN       VAL  32 119.328  -1.814  -0.026
  293    HA   VAL  32           HA       VAL  32 121.651  -0.367   0.953
  294    HB   VAL  32           HB       VAL  32 122.324  -0.034  -1.457
  295   HG11  VAL  32          HG11      VAL  32 122.386  -2.794  -0.355
  296   HG12  VAL  32          HG12      VAL  32 123.549  -1.507  -0.010
  297   HG13  VAL  32          HG13      VAL  32 123.452  -2.208  -1.631
  298   HG21  VAL  32          HG21      VAL  32 120.256  -0.712  -2.588
  299   HG22  VAL  32          HG22      VAL  32 120.391  -2.330  -1.927
  300   HG23  VAL  32          HG23      VAL  32 121.569  -1.765  -3.107
  301    H    GLY  33           HN       GLY  33 121.470   1.695   0.983
  302    HA2  GLY  33           HA2      GLY  33 120.657   3.549  -0.540
  303    HA3  GLY  33           HA1      GLY  33 119.096   2.768  -0.328
  304    H    GLY  34           HN       GLY  34 118.096   4.246   0.687
  305    HA2  GLY  34           HA2      GLY  34 117.568   5.868   2.181
  306    HA3  GLY  34           HA1      GLY  34 117.695   4.582   3.333
  307    H    ASP  35           HN       ASP  35 119.568   6.715   1.492
  308    HA   ASP  35           HA       ASP  35 121.619   6.994   3.650
  309    HB2  ASP  35           HB2      ASP  35 122.069   6.085   1.247
  310    HB3  ASP  35           HB1      ASP  35 121.738   7.709   0.716
  311    H    GLU  36           HN       GLU  36 119.196   8.629   1.679
  312    HA   GLU  36           HA       GLU  36 119.942  11.075   3.084
  313    HB2  GLU  36           HB2      GLU  36 119.408  11.050   0.145
  314    HB3  GLU  36           HB1      GLU  36 120.100  12.308   1.140
  315    HG2  GLU  36           HG2      GLU  36 122.005  10.444   1.439
  316    HG3  GLU  36           HG1      GLU  36 121.133   9.946   0.021
  317    HA   PRO  37           HA       PRO  37 115.614  11.779   3.072
  318    HB2  PRO  37           HB2      PRO  37 116.424  14.433   2.095
  319    HB3  PRO  37           HB1      PRO  37 115.456  14.085   3.573
  320    HG2  PRO  37           HG2      PRO  37 117.916  14.927   3.834
  321    HG3  PRO  37           HG1      PRO  37 117.522  13.400   4.670
  322    HD2  PRO  37           HD2      PRO  37 118.647  13.718   1.910
  323    HD3  PRO  37           HD1      PRO  37 119.461  12.836   3.182
  324    H    ASP  38           HN       ASP  38 117.647  12.083   0.538
  325    HA   ASP  38           HA       ASP  38 115.611  12.510  -1.520
  326    HB2  ASP  38           HB2      ASP  38 117.330  14.181  -1.482
  327    HB3  ASP  38           HB1      ASP  38 118.590  12.967  -1.457
  328    H    GLU  39           HN       GLU  39 117.532  10.067  -0.057
  329    HA   GLU  39           HA       GLU  39 117.444   8.398  -2.455
  330    HB2  GLU  39           HB2      GLU  39 119.730   9.116  -1.956
  331    HB3  GLU  39           HB1      GLU  39 119.555   8.532  -0.308
  332    HG2  GLU  39           HG2      GLU  39 120.833   7.032  -1.569
  333    HG3  GLU  39           HG1      GLU  39 119.305   6.258  -1.153
  334    H    PHE  40           HN       PHE  40 116.279   6.690  -2.179
  335    HA   PHE  40           HA       PHE  40 114.923   5.971   0.353
  336    HB2  PHE  40           HB2      PHE  40 114.469   4.747  -2.372
  337    HB3  PHE  40           HB1      PHE  40 113.372   4.772  -1.012
  338    HD1  PHE  40           HD1      PHE  40 112.812   7.403  -0.311
  339    HD2  PHE  40           HD2      PHE  40 113.833   5.937  -4.170
  340    HE1  PHE  40           HE1      PHE  40 111.606   9.286  -1.354
  341    HE2  PHE  40           HE2      PHE  40 112.641   7.813  -5.216
  342    HZ   PHE  40           HZ       PHE  40 111.519   9.491  -3.818
  343    H    LEU  41           HN       LEU  41 114.476   3.495   0.720
  344    HA   LEU  41           HA       LEU  41 117.146   2.274   0.536
  345    HB2  LEU  41           HB2      LEU  41 114.799   1.422   2.249
  346    HB3  LEU  41           HB1      LEU  41 116.358   0.621   2.118
  347    HG   LEU  41           HG       LEU  41 117.331   2.751   3.027
  348   HD11  LEU  41          HD11      LEU  41 115.407   4.229   2.772
  349   HD12  LEU  41          HD12      LEU  41 115.800   4.072   4.489
  350   HD13  LEU  41          HD13      LEU  41 114.447   3.180   3.810
  351   HD21  LEU  41          HD21      LEU  41 115.584   0.983   4.710
  352   HD22  LEU  41          HD22      LEU  41 116.857   2.038   5.327
  353   HD23  LEU  41          HD23      LEU  41 117.266   0.717   4.249
  354    H    GLN  42           HN       GLN  42 117.422   0.244  -0.377
  355    HA   GLN  42           HA       GLN  42 115.101  -0.832  -1.782
  356    HB2  GLN  42           HB2      GLN  42 116.593   0.539  -3.145
  357    HB3  GLN  42           HB1      GLN  42 117.945  -0.531  -2.695
  358    HG2  GLN  42           HG2      GLN  42 116.371  -2.352  -3.811
  359    HG3  GLN  42           HG1      GLN  42 115.559  -0.972  -4.452
  360   HE21  GLN  42          HE21      GLN  42 117.297  -3.064  -5.740
  361   HE22  GLN  42          HE22      GLN  42 118.388  -2.129  -6.687
  362    H    ILE  43           HN       ILE  43 115.475  -3.132  -2.123
  363    HA   ILE  43           HA       ILE  43 116.960  -4.342   0.116
  364    HB   ILE  43           HB       ILE  43 115.543  -5.955  -2.011
  365   HG12  ILE  43          HG12      ILE  43 113.873  -4.347  -1.293
  366   HG13  ILE  43          HG11      ILE  43 113.484  -5.941  -0.660
  367   HG21  ILE  43          HG21      ILE  43 115.184  -7.577  -0.199
  368   HG22  ILE  43          HG22      ILE  43 116.080  -6.531   0.898
  369   HG23  ILE  43          HG23      ILE  43 116.886  -7.238  -0.496
  370   HD11  ILE  43          HD11      ILE  43 114.724  -3.672   0.843
  371   HD12  ILE  43          HD12      ILE  43 114.345  -5.267   1.499
  372   HD13  ILE  43          HD13      ILE  43 113.046  -4.209   0.940
  373    H    LYS  44           HN       LYS  44 118.990  -5.235  -0.127
  374    HA   LYS  44           HA       LYS  44 119.979  -5.692  -2.874
  375    HB2  LYS  44           HB2      LYS  44 122.245  -5.583  -2.067
  376    HB3  LYS  44           HB1      LYS  44 121.367  -4.163  -1.528
  377    HG2  LYS  44           HG2      LYS  44 121.234  -4.942   0.715
  378    HG3  LYS  44           HG1      LYS  44 121.692  -6.571   0.257
  379    HD2  LYS  44           HD2      LYS  44 123.550  -4.159   0.212
  380    HD3  LYS  44           HD1      LYS  44 123.485  -5.387   1.463
  381    HE2  LYS  44           HE2      LYS  44 124.067  -7.085  -0.251
  382    HE3  LYS  44           HE1      LYS  44 124.244  -5.776  -1.421
  383    HZ1  LYS  44           HZ1      LYS  44 125.767  -6.041   1.090
  384    HZ2  LYS  44           HZ2      LYS  44 126.055  -4.854  -0.068
  385    HZ3  LYS  44           HZ3      LYS  44 126.366  -6.491  -0.389
  386    H    SER  45           HN       SER  45 119.256  -7.258   0.114
  387    HA   SER  45           HA       SER  45 119.527  -9.741  -1.319
  388    HB2  SER  45           HB2      SER  45 120.885  -9.307   1.357
  389    HB3  SER  45           HB1      SER  45 120.790 -10.833   0.477
  390    HG   SER  45           HG       SER  45 121.734  -8.950  -1.129
  391    H    LEU  46           HN       LEU  46 117.723 -10.813  -0.977
  392    HA   LEU  46           HA       LEU  46 115.984 -10.195   1.148
  393    HB2  LEU  46           HB2      LEU  46 115.448 -10.564  -1.271
  394    HB3  LEU  46           HB1      LEU  46 116.006 -12.202  -1.105
  395    HG   LEU  46           HG       LEU  46 113.587 -11.850  -1.271
  396   HD11  LEU  46          HD11      LEU  46 114.572 -13.230   1.205
  397   HD12  LEU  46          HD12      LEU  46 114.438 -13.906  -0.426
  398   HD13  LEU  46          HD13      LEU  46 112.982 -13.459   0.463
  399   HD21  LEU  46          HD21      LEU  46 113.867 -10.726   1.504
  400   HD22  LEU  46          HD22      LEU  46 112.342 -11.152   0.721
  401   HD23  LEU  46          HD23      LEU  46 113.342  -9.861   0.059
  402    H    VAL  47           HN       VAL  47 116.519 -11.201   3.178
  403    HA   VAL  47           HA       VAL  47 118.332 -13.399   3.090
  404    HB   VAL  47           HB       VAL  47 117.302 -11.675   5.350
  405   HG11  VAL  47          HG11      VAL  47 118.917 -12.759   6.784
  406   HG12  VAL  47          HG12      VAL  47 119.387 -13.824   5.450
  407   HG13  VAL  47          HG13      VAL  47 117.757 -13.924   6.127
  408   HG21  VAL  47          HG21      VAL  47 118.862 -10.598   3.771
  409   HG22  VAL  47          HG22      VAL  47 120.051 -11.850   4.116
  410   HG23  VAL  47          HG23      VAL  47 119.522 -10.752   5.394
  411    H    LEU  48           HN       LEU  48 117.863 -15.390   3.442
  412    HA   LEU  48           HA       LEU  48 115.146 -16.283   3.750
  413    HB2  LEU  48           HB2      LEU  48 117.757 -17.643   3.632
  414    HB3  LEU  48           HB1      LEU  48 116.201 -18.453   3.688
  415    HG   LEU  48           HG       LEU  48 117.210 -16.622   1.474
  416   HD11  LEU  48          HD11      LEU  48 118.264 -18.805   1.435
  417   HD12  LEU  48          HD12      LEU  48 117.197 -18.568   0.049
  418   HD13  LEU  48          HD13      LEU  48 116.676 -19.577   1.401
  419   HD21  LEU  48          HD21      LEU  48 114.608 -18.111   1.697
  420   HD22  LEU  48          HD22      LEU  48 115.136 -17.161   0.295
  421   HD23  LEU  48          HD23      LEU  48 114.843 -16.377   1.858
  422    H    ASP  49           HN       ASP  49 114.565 -15.644   5.625
  423    HA   ASP  49           HA       ASP  49 114.807 -17.017   7.981
  424    HB2  ASP  49           HB2      ASP  49 117.092 -16.781   8.019
  425    HB3  ASP  49           HB1      ASP  49 117.081 -15.115   7.564
  426    H    GLY  50           HN       GLY  50 114.509 -14.006   6.360
  427    HA2  GLY  50           HA2      GLY  50 113.226 -12.643   8.628
  428    HA3  GLY  50           HA1      GLY  50 113.727 -12.025   7.060
  429    HA   PRO  51           HA       PRO  51 109.291 -13.228   7.445
  430    HB2  PRO  51           HB2      PRO  51 108.104 -10.641   7.792
  431    HB3  PRO  51           HB1      PRO  51 108.402 -11.860   8.983
  432    HG2  PRO  51           HG2      PRO  51 109.696  -9.396   8.766
  433    HG3  PRO  51           HG1      PRO  51 110.063 -10.695   9.898
  434    HD2  PRO  51           HD2      PRO  51 111.294  -9.981   7.318
  435    HD3  PRO  51           HD1      PRO  51 112.106 -10.675   8.699
  436    H    ALA  52           HN       ALA  52 110.851 -10.853   5.621
  437    HA   ALA  52           HA       ALA  52 109.149 -10.475   3.436
  438    HB1  ALA  52           HB1      ALA  52 111.173  -9.167   3.809
  439    HB2  ALA  52           HB2      ALA  52 111.265  -9.942   2.224
  440    HB3  ALA  52           HB3      ALA  52 112.158 -10.600   3.581
  441    H    ALA  53           HN       ALA  53 111.771 -12.911   3.843
  442    HA   ALA  53           HA       ALA  53 111.267 -14.347   1.376
  443    HB1  ALA  53           HB1      ALA  53 112.578 -15.506   3.785
  444    HB2  ALA  53           HB2      ALA  53 113.438 -14.310   2.811
  445    HB3  ALA  53           HB3      ALA  53 112.900 -15.846   2.094
  446    H    LEU  54           HN       LEU  54 110.482 -14.532   4.610
  447    HA   LEU  54           HA       LEU  54 109.709 -17.170   4.727
  448    HB2  LEU  54           HB2      LEU  54 109.604 -14.777   6.435
  449    HB3  LEU  54           HB1      LEU  54 108.874 -16.268   7.006
  450    HG   LEU  54           HG       LEU  54 111.390 -15.576   7.683
  451   HD11  LEU  54          HD11      LEU  54 110.791 -18.050   6.318
  452   HD12  LEU  54          HD12      LEU  54 110.113 -17.814   7.977
  453   HD13  LEU  54          HD13      LEU  54 111.912 -17.999   7.676
  454   HD21  LEU  54          HD21      LEU  54 111.801 -16.947   5.037
  455   HD22  LEU  54          HD22      LEU  54 113.004 -16.822   6.322
  456   HD23  LEU  54          HD23      LEU  54 112.357 -15.352   5.599
  457    H    ASP  55           HN       ASP  55 107.989 -14.131   4.534
  458    HA   ASP  55           HA       ASP  55 105.372 -15.368   4.314
  459    HB2  ASP  55           HB2      ASP  55 105.845 -12.915   5.097
  460    HB3  ASP  55           HB1      ASP  55 106.114 -12.594   3.409
  461    H    GLY  56           HN       GLY  56 107.961 -14.473   2.374
  462    HA2  GLY  56           HA2      GLY  56 108.544 -14.863   0.227
  463    HA3  GLY  56           HA1      GLY  56 107.144 -15.951   0.134
  464    H    LYS  57           HN       LYS  57 107.252 -12.539   0.761
  465    HA   LYS  57           HA       LYS  57 105.653 -12.211  -1.674
  466    HB2  LYS  57           HB2      LYS  57 104.313 -12.204   0.340
  467    HB3  LYS  57           HB1      LYS  57 105.320 -10.952   1.020
  468    HG2  LYS  57           HG2      LYS  57 103.152 -10.061   0.237
  469    HG3  LYS  57           HG1      LYS  57 104.478  -9.379  -0.701
  470    HD2  LYS  57           HD2      LYS  57 102.687  -9.974  -2.213
  471    HD3  LYS  57           HD1      LYS  57 104.031 -11.076  -2.468
  472    HE2  LYS  57           HE2      LYS  57 102.867 -12.755  -1.094
  473    HE3  LYS  57           HE1      LYS  57 101.521 -11.631  -0.898
  474    HZ1  LYS  57           HZ1      LYS  57 101.278 -11.648  -3.344
  475    HZ2  LYS  57           HZ2      LYS  57 101.042 -13.166  -2.652
  476    HZ3  LYS  57           HZ3      LYS  57 102.481 -12.826  -3.435
  477    H    MET  58           HN       MET  58 108.586 -11.479  -0.433
  478    HA   MET  58           HA       MET  58 108.745  -8.909  -1.863
  479    HB2  MET  58           HB2      MET  58 110.034  -9.604   0.782
  480    HB3  MET  58           HB1      MET  58 110.493  -8.229  -0.209
  481    HG2  MET  58           HG2      MET  58 108.313  -7.263   0.123
  482    HG3  MET  58           HG1      MET  58 107.783  -8.718   0.942
  483    HE1  MET  58           HE1      MET  58 110.592  -5.924   1.135
  484    HE2  MET  58           HE2      MET  58 111.434  -7.432   1.510
  485    HE3  MET  58           HE3      MET  58 111.207  -6.213   2.762
  486    H    GLU  59           HN       GLU  59 110.940  -8.444  -2.654
  487    HA   GLU  59           HA       GLU  59 112.609 -10.835  -3.063
  488    HB2  GLU  59           HB2      GLU  59 111.504  -8.989  -5.171
  489    HB3  GLU  59           HB1      GLU  59 112.883 -10.026  -5.446
  490    HG2  GLU  59           HG2      GLU  59 111.437 -11.982  -5.014
  491    HG3  GLU  59           HG1      GLU  59 110.062 -10.882  -4.850
  492    H    THR  60           HN       THR  60 114.784 -10.251  -3.872
  493    HA   THR  60           HA       THR  60 115.912  -7.886  -2.841
  494    HB   THR  60           HB       THR  60 116.944  -9.755  -4.966
  495    HG1  THR  60           HG1      THR  60 116.709 -11.152  -3.394
  496   HG21  THR  60          HG21      THR  60 119.094  -9.101  -4.127
  497   HG22  THR  60          HG22      THR  60 118.280  -8.085  -2.928
  498   HG23  THR  60          HG23      THR  60 118.143  -7.699  -4.655
  499    H    GLY  61           HN       GLY  61 115.670  -5.964  -3.800
  500    HA2  GLY  61           HA2      GLY  61 116.069  -4.796  -5.964
  501    HA3  GLY  61           HA1      GLY  61 114.863  -5.898  -6.627
  502    H    ASP  62           HN       ASP  62 113.348  -5.747  -4.002
  503    HA   ASP  62           HA       ASP  62 111.486  -3.745  -4.614
  504    HB2  ASP  62           HB2      ASP  62 112.098  -5.206  -2.072
  505    HB3  ASP  62           HB1      ASP  62 110.995  -3.841  -2.069
  506    H    VAL  63           HN       VAL  63 111.298  -1.678  -4.034
  507    HA   VAL  63           HA       VAL  63 113.387  -0.762  -2.301
  508    HB   VAL  63           HB       VAL  63 113.987   0.500  -4.116
  509   HG11  VAL  63          HG11      VAL  63 111.104   0.705  -4.868
  510   HG12  VAL  63          HG12      VAL  63 112.389  -0.324  -5.550
  511   HG13  VAL  63          HG13      VAL  63 112.465   1.428  -5.754
  512   HG21  VAL  63          HG21      VAL  63 113.514   2.139  -2.367
  513   HG22  VAL  63          HG22      VAL  63 111.853   2.287  -2.938
  514   HG23  VAL  63          HG23      VAL  63 113.188   2.819  -3.961
  515    H    ILE  64           HN       ILE  64 113.094  -0.184  -0.514
  516    HA   ILE  64           HA       ILE  64 110.561  -0.232   0.635
  517    HB   ILE  64           HB       ILE  64 113.229   0.510   1.819
  518   HG12  ILE  64          HG12      ILE  64 113.104  -1.819   1.118
  519   HG13  ILE  64          HG11      ILE  64 113.160  -1.710   2.871
  520   HG21  ILE  64          HG21      ILE  64 112.208   0.239   4.049
  521   HG22  ILE  64          HG22      ILE  64 110.634   0.018   3.287
  522   HG23  ILE  64          HG23      ILE  64 111.470   1.563   3.144
  523   HD11  ILE  64          HD11      ILE  64 110.708  -2.047   2.920
  524   HD12  ILE  64          HD12      ILE  64 111.591  -3.402   2.231
  525   HD13  ILE  64          HD13      ILE  64 110.736  -2.285   1.170
  526    H    VAL  65           HN       VAL  65 109.233   1.297   0.627
  527    HA   VAL  65           HA       VAL  65 109.918   4.065   0.089
  528    HB   VAL  65           HB       VAL  65 107.259   2.627   0.206
  529   HG11  VAL  65          HG11      VAL  65 107.888   5.323  -0.949
  530   HG12  VAL  65          HG12      VAL  65 107.159   5.053   0.630
  531   HG13  VAL  65          HG13      VAL  65 106.308   4.551  -0.831
  532   HG21  VAL  65          HG21      VAL  65 107.293   2.743  -2.245
  533   HG22  VAL  65          HG22      VAL  65 108.623   1.771  -1.607
  534   HG23  VAL  65          HG23      VAL  65 108.922   3.412  -2.164
  535    H    SER  66           HN       SER  66 107.761   2.206   2.276
  536    HA   SER  66           HA       SER  66 108.394   3.948   4.469
  537    HB2  SER  66           HB2      SER  66 105.615   4.078   3.250
  538    HB3  SER  66           HB1      SER  66 106.077   4.780   4.797
  539    HG   SER  66           HG       SER  66 107.737   5.508   2.784
  540    H    VAL  67           HN       VAL  67 106.816   3.398   6.371
  541    HA   VAL  67           HA       VAL  67 105.831   0.682   6.250
  542    HB   VAL  67           HB       VAL  67 108.285   0.633   6.918
  543   HG11  VAL  67          HG11      VAL  67 108.399   2.709   8.128
  544   HG12  VAL  67          HG12      VAL  67 108.912   1.358   9.143
  545   HG13  VAL  67          HG13      VAL  67 107.312   2.072   9.360
  546   HG21  VAL  67          HG21      VAL  67 106.306  -0.220   8.982
  547   HG22  VAL  67          HG22      VAL  67 107.955  -0.836   8.830
  548   HG23  VAL  67          HG23      VAL  67 106.767  -1.142   7.554
  549    H    ASN  68           HN       ASN  68 104.319   0.342   7.787
  550    HA   ASN  68           HA       ASN  68 102.478   1.913   8.771
  551    HB2  ASN  68           HB2      ASN  68 102.375  -0.321   9.336
  552    HB3  ASN  68           HB1      ASN  68 103.929  -0.306  10.139
  553   HD21  ASN  68          HD21      ASN  68 103.319  -1.116  11.932
  554   HD22  ASN  68          HD22      ASN  68 102.240  -0.480  13.079
  555    H    ASP  69           HN       ASP  69 102.569   3.814   9.575
  556    HA   ASP  69           HA       ASP  69 102.789   5.599  10.916
  557    HB2  ASP  69           HB2      ASP  69 102.635   4.251  12.879
  558    HB3  ASP  69           HB1      ASP  69 104.330   3.786  12.764
  559    H    THR  70           HN       THR  70 105.816   4.033  10.139
  560    HA   THR  70           HA       THR  70 107.154   6.607  10.591
  561    HB   THR  70           HB       THR  70 108.432   3.925  10.117
  562    HG1  THR  70           HG1      THR  70 107.201   4.994  12.340
  563   HG21  THR  70          HG21      THR  70 109.864   5.877   9.699
  564   HG22  THR  70          HG22      THR  70 110.407   4.987  11.119
  565   HG23  THR  70          HG23      THR  70 109.504   6.492  11.314
  566    H    CYS  71           HN       CYS  71 107.661   7.825   8.994
  567    HA   CYS  71           HA       CYS  71 107.258   6.907   6.296
  568    HB2  CYS  71           HB2      CYS  71 106.493   9.129   7.231
  569    HB3  CYS  71           HB1      CYS  71 108.178   9.611   7.238
  570    HG   CYS  71           HG       CYS  71 106.087  10.003   4.873
  571    H    VAL  72           HN       VAL  72 108.915   5.441   6.239
  572    HA   VAL  72           HA       VAL  72 111.664   6.094   6.610
  573    HB   VAL  72           HB       VAL  72 110.346   3.710   5.230
  574   HG11  VAL  72          HG11      VAL  72 113.184   3.974   6.213
  575   HG12  VAL  72          HG12      VAL  72 112.678   3.941   4.525
  576   HG13  VAL  72          HG13      VAL  72 112.443   2.516   5.544
  577   HG21  VAL  72          HG21      VAL  72 110.716   2.555   7.311
  578   HG22  VAL  72          HG22      VAL  72 109.776   4.034   7.583
  579   HG23  VAL  72          HG23      VAL  72 111.486   3.987   7.987
  580    H    LEU  73           HN       LEU  73 109.562   7.025   4.325
  581    HA   LEU  73           HA       LEU  73 110.952   6.884   1.873
  582    HB2  LEU  73           HB2      LEU  73 108.508   7.329   2.441
  583    HB3  LEU  73           HB1      LEU  73 109.008   8.935   2.897
  584    HG   LEU  73           HG       LEU  73 109.582   9.456   0.607
  585   HD11  LEU  73          HD11      LEU  73 110.474   7.322  -0.095
  586   HD12  LEU  73          HD12      LEU  73 109.114   7.734  -1.153
  587   HD13  LEU  73          HD13      LEU  73 108.913   6.566   0.167
  588   HD21  LEU  73          HD21      LEU  73 107.377   9.232  -0.379
  589   HD22  LEU  73          HD22      LEU  73 107.260   9.678   1.322
  590   HD23  LEU  73          HD23      LEU  73 106.946   8.014   0.820
  591    H    GLY  74           HN       GLY  74 112.918   7.659   1.733
  592    HA2  GLY  74           HA2      GLY  74 114.636   9.202   1.675
  593    HA3  GLY  74           HA1      GLY  74 113.463  10.391   2.229
  594    H    HIS  75           HN       HIS  75 113.960   7.465   4.108
  595    HA   HIS  75           HA       HIS  75 114.675   9.055   6.343
  596    HB2  HIS  75           HB2      HIS  75 113.753   6.352   5.913
  597    HB3  HIS  75           HB1      HIS  75 115.259   6.360   6.811
  598    HD1  HIS  75           HD1      HIS  75 112.407   8.866   7.188
  599    HD2  HIS  75           HD2      HIS  75 114.459   5.928   9.250
  600    HE1  HIS  75           HE1      HIS  75 111.593   9.020   9.549
  601    H    THR  76           HN       THR  76 116.585   9.229   7.293
  602    HA   THR  76           HA       THR  76 118.940   8.942   5.717
  603    HB   THR  76           HB       THR  76 118.478   9.587   8.620
  604    HG1  THR  76           HG1      THR  76 117.937  10.936   6.327
  605   HG21  THR  76          HG21      THR  76 120.827   9.130   8.139
  606   HG22  THR  76          HG22      THR  76 120.581  10.828   8.506
  607   HG23  THR  76          HG23      THR  76 120.816  10.313   6.823
  608    H    HIS  77           HN       HIS  77 120.567   7.248   6.015
  609    HA   HIS  77           HA       HIS  77 119.867   4.789   6.704
  610    HB2  HIS  77           HB2      HIS  77 121.942   5.061   5.559
  611    HB3  HIS  77           HB1      HIS  77 122.609   6.022   6.875
  612    HD1  HIS  77           HD1      HIS  77 121.394   2.344   6.487
  613    HD2  HIS  77           HD2      HIS  77 124.279   4.641   8.436
  614    HE1  HIS  77           HE1      HIS  77 122.798   0.749   7.785
  615    H    ALA  78           HN       ALA  78 121.403   7.004   8.748
  616    HA   ALA  78           HA       ALA  78 121.780   5.400  11.033
  617    HB1  ALA  78           HB1      ALA  78 122.872   7.561  10.760
  618    HB2  ALA  78           HB2      ALA  78 122.027   7.472  12.310
  619    HB3  ALA  78           HB3      ALA  78 121.327   8.381  10.967
  620    H    GLN  79           HN       GLN  79 119.027   7.262   9.985
  621    HA   GLN  79           HA       GLN  79 117.689   6.971  12.435
  622    HB2  GLN  79           HB2      GLN  79 116.659   7.849   9.755
  623    HB3  GLN  79           HB1      GLN  79 115.690   7.910  11.214
  624    HG2  GLN  79           HG2      GLN  79 118.211   9.433  10.605
  625    HG3  GLN  79           HG1      GLN  79 116.582  10.089  10.795
  626   HE21  GLN  79          HE21      GLN  79 119.040  10.740  12.134
  627   HE22  GLN  79          HE22      GLN  79 118.819  10.478  13.805
  628    H    VAL  80           HN       VAL  80 117.263   5.648   9.196
  629    HA   VAL  80           HA       VAL  80 115.117   3.979   9.843
  630    HB   VAL  80           HB       VAL  80 115.510   4.594   7.489
  631   HG11  VAL  80          HG11      VAL  80 117.318   3.745   6.179
  632   HG12  VAL  80          HG12      VAL  80 117.947   2.853   7.564
  633   HG13  VAL  80          HG13      VAL  80 117.961   4.613   7.576
  634   HG21  VAL  80          HG21      VAL  80 115.772   1.618   7.930
  635   HG22  VAL  80          HG22      VAL  80 115.146   2.410   6.476
  636   HG23  VAL  80          HG23      VAL  80 114.275   2.537   7.999
  637    H    VAL  81           HN       VAL  81 118.589   3.341   9.798
  638    HA   VAL  81           HA       VAL  81 118.328   0.587  10.308
  639    HB   VAL  81           HB       VAL  81 120.506   1.612   9.514
  640   HG11  VAL  81          HG11      VAL  81 120.887   2.437  12.375
  641   HG12  VAL  81          HG12      VAL  81 120.693   3.505  10.987
  642   HG13  VAL  81          HG13      VAL  81 122.121   2.477  11.113
  643   HG21  VAL  81          HG21      VAL  81 120.706  -0.134  11.956
  644   HG22  VAL  81          HG22      VAL  81 121.973   0.090  10.752
  645   HG23  VAL  81          HG23      VAL  81 120.453  -0.686  10.301
  646    H    LYS  82           HN       LYS  82 118.651   3.300  12.469
  647    HA   LYS  82           HA       LYS  82 118.914   1.921  14.839
  648    HB2  LYS  82           HB2      LYS  82 119.444   4.185  14.733
  649    HB3  LYS  82           HB1      LYS  82 117.882   4.606  14.085
  650    HG2  LYS  82           HG2      LYS  82 118.044   3.524  16.879
  651    HG3  LYS  82           HG1      LYS  82 118.553   5.184  16.589
  652    HD2  LYS  82           HD2      LYS  82 115.835   4.030  15.901
  653    HD3  LYS  82           HD1      LYS  82 116.188   5.033  17.307
  654    HE2  LYS  82           HE2      LYS  82 116.444   5.895  14.402
  655    HE3  LYS  82           HE1      LYS  82 115.151   6.337  15.494
  656    HZ1  LYS  82           HZ1      LYS  82 116.732   7.571  16.855
  657    HZ2  LYS  82           HZ2      LYS  82 116.880   8.083  15.268
  658    HZ3  LYS  82           HZ3      LYS  82 118.009   7.044  15.911
  659    H    ILE  83           HN       ILE  83 115.966   2.741  13.087
  660    HA   ILE  83           HA       ILE  83 114.266   2.019  15.291
  661    HB   ILE  83           HB       ILE  83 113.636   2.459  12.354
  662   HG12  ILE  83          HG12      ILE  83 113.227   4.243  14.763
  663   HG13  ILE  83          HG11      ILE  83 114.488   4.436  13.556
  664   HG21  ILE  83          HG21      ILE  83 111.277   2.605  13.050
  665   HG22  ILE  83          HG22      ILE  83 111.741   2.169  14.694
  666   HG23  ILE  83          HG23      ILE  83 111.952   1.009  13.383
  667   HD11  ILE  83          HD11      ILE  83 112.797   4.854  11.854
  668   HD12  ILE  83          HD12      ILE  83 112.669   5.989  13.204
  669   HD13  ILE  83          HD13      ILE  83 111.535   4.641  13.072
  670    H    PHE  84           HN       PHE  84 115.204   0.675  12.239
  671    HA   PHE  84           HA       PHE  84 113.720  -1.660  12.366
  672    HB2  PHE  84           HB2      PHE  84 115.954  -0.626  10.703
  673    HB3  PHE  84           HB1      PHE  84 115.492  -2.286  10.518
  674    HD1  PHE  84           HD1      PHE  84 113.626   0.954  10.927
  675    HD2  PHE  84           HD2      PHE  84 114.147  -2.588   8.639
  676    HE1  PHE  84           HE1      PHE  84 111.833   1.678   9.407
  677    HE2  PHE  84           HE2      PHE  84 112.358  -1.874   7.117
  678    HZ   PHE  84           HZ       PHE  84 111.195   0.260   7.497
  679    H    GLN  85           HN       GLN  85 116.927  -0.959  13.604
  680    HA   GLN  85           HA       GLN  85 117.340  -3.741  14.279
  681    HB2  GLN  85           HB2      GLN  85 119.428  -3.012  15.357
  682    HB3  GLN  85           HB1      GLN  85 119.304  -2.502  13.673
  683    HG2  GLN  85           HG2      GLN  85 118.633  -0.286  14.442
  684    HG3  GLN  85           HG1      GLN  85 118.901  -0.790  16.117
  685   HE21  GLN  85          HE21      GLN  85 120.888  -1.790  13.412
  686   HE22  GLN  85          HE22      GLN  85 122.281  -0.886  13.859
  687    H    SER  86           HN       SER  86 115.948  -0.987  15.866
  688    HA   SER  86           HA       SER  86 116.280  -2.269  18.444
  689    HB2  SER  86           HB2      SER  86 115.005   0.391  17.768
  690    HB3  SER  86           HB1      SER  86 115.386  -0.193  19.392
  691    HG   SER  86           HG       SER  86 117.034   0.716  17.354
  692    H    ILE  87           HN       ILE  87 114.253  -2.565  15.982
  693    HA   ILE  87           HA       ILE  87 111.703  -2.766  16.789
  694    HB   ILE  87           HB       ILE  87 113.427  -4.285  14.925
  695   HG12  ILE  87          HG12      ILE  87 111.152  -2.373  14.704
  696   HG13  ILE  87          HG11      ILE  87 112.805  -2.214  14.130
  697   HG21  ILE  87          HG21      ILE  87 111.894  -6.049  15.683
  698   HG22  ILE  87          HG22      ILE  87 111.595  -5.519  14.012
  699   HG23  ILE  87          HG23      ILE  87 110.530  -5.001  15.254
  700   HD11  ILE  87          HD11      ILE  87 111.279  -2.584  12.293
  701   HD12  ILE  87          HD12      ILE  87 110.693  -4.041  13.072
  702   HD13  ILE  87          HD13      ILE  87 112.330  -4.001  12.446
  703    HA   PRO  88           HA       PRO  88 111.626  -6.246  19.696
  704    HB2  PRO  88           HB2      PRO  88 108.919  -6.223  20.052
  705    HB3  PRO  88           HB1      PRO  88 110.008  -5.083  20.838
  706    HG2  PRO  88           HG2      PRO  88 108.029  -4.568  18.785
  707    HG3  PRO  88           HG1      PRO  88 109.023  -3.401  19.670
  708    HD2  PRO  88           HD2      PRO  88 109.429  -4.544  16.980
  709    HD3  PRO  88           HD1      PRO  88 110.105  -3.087  17.657
  710    H    ILE  89           HN       ILE  89 111.312  -8.370  19.534
  711    HA   ILE  89           HA       ILE  89 110.728  -9.542  17.029
  712    HB   ILE  89           HB       ILE  89 110.807 -10.948  19.722
  713   HG12  ILE  89          HG12      ILE  89 113.192 -10.362  17.966
  714   HG13  ILE  89          HG11      ILE  89 112.785  -9.450  19.420
  715   HG21  ILE  89          HG21      ILE  89 110.068 -12.319  17.878
  716   HG22  ILE  89          HG22      ILE  89 111.662 -12.844  18.435
  717   HG23  ILE  89          HG23      ILE  89 111.509 -11.889  16.955
  718   HD11  ILE  89          HD11      ILE  89 113.066 -11.470  20.723
  719   HD12  ILE  89          HD12      ILE  89 114.524 -11.059  19.816
  720   HD13  ILE  89          HD13      ILE  89 113.468 -12.364  19.253
  721    H    GLY  90           HN       GLY  90 108.754 -10.546  16.374
  722    HA2  GLY  90           HA2      GLY  90 106.688 -11.580  16.724
  723    HA3  GLY  90           HA1      GLY  90 106.734 -11.055  18.403
  724    H    ALA  91           HN       ALA  91 107.503  -8.705  16.124
  725    HA   ALA  91           HA       ALA  91 104.916  -7.457  16.828
  726    HB1  ALA  91           HB1      ALA  91 106.037  -5.221  16.456
  727    HB2  ALA  91           HB2      ALA  91 107.569  -6.072  16.226
  728    HB3  ALA  91           HB3      ALA  91 106.741  -6.166  17.748
  729    H    SER  92           HN       SER  92 104.852  -5.387  14.910
  730    HA   SER  92           HA       SER  92 104.610  -6.719  12.316
  731    HB2  SER  92           HB2      SER  92 102.658  -7.553  13.311
  732    HB3  SER  92           HB1      SER  92 102.212  -5.982  14.005
  733    HG   SER  92           HG       SER  92 101.524  -5.357  12.069
  734    H    VAL  93           HN       VAL  93 104.502  -5.443  10.678
  735    HA   VAL  93           HA       VAL  93 103.643  -2.730  10.862
  736    HB   VAL  93           HB       VAL  93 105.651  -2.017   9.475
  737   HG11  VAL  93          HG11      VAL  93 106.980  -1.370  11.520
  738   HG12  VAL  93          HG12      VAL  93 105.653  -2.110  12.460
  739   HG13  VAL  93          HG13      VAL  93 105.346  -0.794  11.349
  740   HG21  VAL  93          HG21      VAL  93 106.763  -4.104   9.235
  741   HG22  VAL  93          HG22      VAL  93 106.902  -4.262  10.988
  742   HG23  VAL  93          HG23      VAL  93 107.789  -2.984  10.139
  743    H    ASP  94           HN       ASP  94 103.360  -1.788   8.971
  744    HA   ASP  94           HA       ASP  94 102.629  -3.623   6.844
  745    HB2  ASP  94           HB2      ASP  94 101.941  -0.764   7.501
  746    HB3  ASP  94           HB1      ASP  94 101.283  -1.630   6.154
  747    H    LEU  95           HN       LEU  95 104.319  -3.728   5.440
  748    HA   LEU  95           HA       LEU  95 106.103  -1.449   5.219
  749    HB2  LEU  95           HB2      LEU  95 106.715  -3.894   5.745
  750    HB3  LEU  95           HB1      LEU  95 106.440  -4.164   4.039
  751    HG   LEU  95           HG       LEU  95 108.189  -2.440   3.563
  752   HD11  LEU  95          HD11      LEU  95 109.696  -1.909   5.478
  753   HD12  LEU  95          HD12      LEU  95 108.495  -2.687   6.539
  754   HD13  LEU  95          HD13      LEU  95 108.071  -1.233   5.661
  755   HD21  LEU  95          HD21      LEU  95 108.602  -4.850   3.558
  756   HD22  LEU  95          HD22      LEU  95 108.981  -4.746   5.283
  757   HD23  LEU  95          HD23      LEU  95 110.018  -3.935   4.102
  758    H    GLU  96           HN       GLU  96 105.652  -0.103   3.545
  759    HA   GLU  96           HA       GLU  96 104.552  -1.345   1.170
  760    HB2  GLU  96           HB2      GLU  96 103.794   0.912   0.462
  761    HB3  GLU  96           HB1      GLU  96 103.045   0.335   1.926
  762    HG2  GLU  96           HG2      GLU  96 104.528   1.764   3.249
  763    HG3  GLU  96           HG1      GLU  96 105.251   2.368   1.756
  764    H    LEU  97           HN       LEU  97 105.582  -1.485  -0.566
  765    HA   LEU  97           HA       LEU  97 108.040  -0.031  -0.899
  766    HB2  LEU  97           HB2      LEU  97 109.419  -1.985  -1.129
  767    HB3  LEU  97           HB1      LEU  97 108.642  -2.008   0.426
  768    HG   LEU  97           HG       LEU  97 108.169  -3.906  -1.921
  769   HD11  LEU  97          HD11      LEU  97 108.892  -4.404   0.927
  770   HD12  LEU  97          HD12      LEU  97 110.048  -4.198  -0.366
  771   HD13  LEU  97          HD13      LEU  97 108.925  -5.550  -0.416
  772   HD21  LEU  97          HD21      LEU  97 106.605  -3.805   0.668
  773   HD22  LEU  97          HD22      LEU  97 106.435  -4.992  -0.627
  774   HD23  LEU  97          HD23      LEU  97 105.959  -3.308  -0.894
  775    H    CYS  98           HN       CYS  98 108.975  -0.506  -3.063
  776    HA   CYS  98           HA       CYS  98 106.769  -1.001  -4.920
  777    HB2  CYS  98           HB2      CYS  98 107.576   1.389  -4.743
  778    HB3  CYS  98           HB1      CYS  98 109.107   0.843  -5.408
  779    HG   CYS  98           HG       CYS  98 108.231   0.408  -7.959
  780    H    ARG  99           HN       ARG  99 107.058  -2.464  -6.374
  781    HA   ARG  99           HA       ARG  99 109.602  -3.938  -6.463
  782    HB2  ARG  99           HB2      ARG  99 107.610  -5.144  -5.726
  783    HB3  ARG  99           HB1      ARG  99 106.764  -4.712  -7.190
  784    HG2  ARG  99           HG2      ARG  99 107.415  -6.915  -7.498
  785    HG3  ARG  99           HG1      ARG  99 108.611  -5.978  -8.397
  786    HD2  ARG  99           HD2      ARG  99 109.688  -7.765  -7.043
  787    HD3  ARG  99           HD1      ARG  99 110.150  -6.122  -6.540
  788    HE   ARG  99           HE       ARG  99 109.084  -6.318  -4.650
  789   HH11  ARG  99          HH11      ARG  99 108.443  -9.273  -6.461
  790   HH12  ARG  99          HH12      ARG  99 107.590 -10.003  -5.178
  791   HH21  ARG  99          HH21      ARG  99 108.065  -7.233  -3.042
  792   HH22  ARG  99          HH22      ARG  99 107.325  -8.788  -3.107
  793    H    GLY 100           HN       GLY 100 110.374  -4.539  -8.563
  794    HA2  GLY 100           HA2      GLY 100 109.635  -4.464 -11.003
  795    HA3  GLY 100           HA1      GLY 100 109.470  -2.731 -10.693
  796    H    TYR 101           HN       TYR 101 111.515  -2.299  -9.071
  797    HA   TYR 101           HA       TYR 101 113.778  -2.148 -10.725
  798    HB2  TYR 101           HB2      TYR 101 113.526  -1.853  -7.721
  799    HB3  TYR 101           HB1      TYR 101 114.925  -1.372  -8.667
  800    HD1  TYR 101           HD1      TYR 101 111.376  -0.622  -7.963
  801    HD2  TYR 101           HD2      TYR 101 114.954   0.700  -9.834
  802    HE1  TYR 101           HE1      TYR 101 110.388   1.603  -8.254
  803    HE2  TYR 101           HE2      TYR 101 113.973   2.937 -10.127
  804    HH   TYR 101           HH       TYR 101 111.387   4.027  -8.521
  805    HA   PRO 102           HA       PRO 102 115.562  -6.089  -9.361
  806    HB2  PRO 102           HB2      PRO 102 117.435  -6.267 -11.222
  807    HB3  PRO 102           HB1      PRO 102 115.736  -6.363 -11.699
  808    HG2  PRO 102           HG2      PRO 102 117.654  -4.100 -11.985
  809    HG3  PRO 102           HG1      PRO 102 116.351  -4.610 -13.070
  810    HD2  PRO 102           HD2      PRO 102 116.224  -2.546 -11.135
  811    HD3  PRO 102           HD1      PRO 102 114.871  -3.253 -12.045
  812    H    LEU 103           HN       LEU 103 118.293  -6.491  -9.483
  813    HA   LEU 103           HA       LEU 103 119.411  -4.252  -7.935
  814    HB2  LEU 103           HB2      LEU 103 118.941  -6.725  -6.966
  815    HB3  LEU 103           HB1      LEU 103 120.449  -7.055  -7.788
  816    HG   LEU 103           HG       LEU 103 120.719  -6.688  -5.353
  817   HD11  LEU 103          HD11      LEU 103 122.605  -6.220  -6.805
  818   HD12  LEU 103          HD12      LEU 103 122.537  -5.146  -5.402
  819   HD13  LEU 103          HD13      LEU 103 122.033  -4.553  -6.985
  820   HD21  LEU 103          HD21      LEU 103 120.494  -4.442  -4.435
  821   HD22  LEU 103          HD22      LEU 103 118.951  -5.095  -4.985
  822   HD23  LEU 103          HD23      LEU 103 119.799  -3.891  -5.954
  823    HA   PRO 104           HA       PRO 104 121.592  -4.865 -11.967
  824    HB2  PRO 104           HB2      PRO 104 121.341  -2.391 -12.947
  825    HB3  PRO 104           HB1      PRO 104 119.992  -3.530 -12.926
  826    HG2  PRO 104           HG2      PRO 104 120.447  -1.133 -11.254
  827    HG3  PRO 104           HG1      PRO 104 118.930  -1.932 -11.685
  828    HD2  PRO 104           HD2      PRO 104 120.440  -2.199  -9.245
  829    HD3  PRO 104           HD1      PRO 104 118.926  -3.011  -9.683
  830    H    PHE 105           HN       PHE 105 122.613  -3.411  -9.260
  831    HA   PHE 105           HA       PHE 105 125.274  -2.950 -10.337
  832    HB2  PHE 105           HB2      PHE 105 123.811  -0.972  -8.546
  833    HB3  PHE 105           HB1      PHE 105 125.527  -0.925  -8.896
  834    HD1  PHE 105           HD2      PHE 105 126.260  -0.450 -11.266
  835    HD2  PHE 105           HD1      PHE 105 122.242   0.048  -9.950
  836    HE1  PHE 105           HE2      PHE 105 125.815   1.016 -13.187
  837    HE2  PHE 105           HE1      PHE 105 121.791   1.512 -11.868
  838    HZ   PHE 105           HZ       PHE 105 123.579   2.002 -13.489
  839    H    ASP 106           HN       ASP 106 126.559  -4.190  -9.046
  840    HA   ASP 106           HA       ASP 106 125.356  -5.314  -6.715
  841    HB2  ASP 106           HB2      ASP 106 128.215  -5.439  -7.421
  842    HB3  ASP 106           HB1      ASP 106 127.387  -6.509  -6.338
  843    HA   PRO 107           HA       PRO 107 127.389  -2.184  -4.219
  844    HB2  PRO 107           HB2      PRO 107 125.618  -3.068  -2.078
  845    HB3  PRO 107           HB1      PRO 107 125.460  -1.590  -3.052
  846    HG2  PRO 107           HG2      PRO 107 123.632  -3.609  -3.262
  847    HG3  PRO 107           HG1      PRO 107 124.214  -2.696  -4.692
  848    HD2  PRO 107           HD2      PRO 107 125.402  -5.174  -3.596
  849    HD3  PRO 107           HD1      PRO 107 124.595  -5.065  -5.139
  850    H    ASP 108           HN       ASP 108 127.264  -5.400  -4.195
  851    HA   ASP 108           HA       ASP 108 128.335  -6.163  -1.779
  852    HB2  ASP 108           HB2      ASP 108 127.104  -7.746  -3.132
  853    HB3  ASP 108           HB1      ASP 108 128.270  -7.597  -4.441
  854    H    ASP 109           HN       ASP 109 129.416  -5.372  -4.946
  855    HA   ASP 109           HA       ASP 109 132.203  -5.933  -4.760
  856    HB2  ASP 109           HB2      ASP 109 130.825  -5.784  -6.919
  857    HB3  ASP 109           HB1      ASP 109 130.710  -4.068  -6.614
  858    HA   PRO 110           HA       PRO 110 133.004  -2.436  -2.035
  859    HB2  PRO 110           HB2      PRO 110 135.694  -2.714  -3.219
  860    HB3  PRO 110           HB1      PRO 110 135.231  -2.546  -1.528
  861    HG2  PRO 110           HG2      PRO 110 135.899  -4.940  -2.435
  862    HG3  PRO 110           HG1      PRO 110 134.413  -4.800  -1.467
  863    HD2  PRO 110           HD2      PRO 110 134.714  -4.935  -4.450
  864    HD3  PRO 110           HD1      PRO 110 133.600  -5.846  -3.390
  865    H    ASN 111           HN       ASN 111 134.536  -0.495  -2.117
  866    HA   ASN 111           HA       ASN 111 135.211   1.351  -2.788
  867    HB2  ASN 111           HB2      ASN 111 134.497   0.699  -5.648
  868    HB3  ASN 111           HB1      ASN 111 135.365   2.116  -5.070
  869   HD21  ASN 111          HD21      ASN 111 137.000   0.587  -3.133
  870   HD22  ASN 111          HD22      ASN 111 138.119  -0.302  -4.091
  871    H    THR 112           HN       THR 112 132.826   1.036  -1.707
  872    HA   THR 112           HA       THR 112 131.015   2.821  -3.084
  873    HB   THR 112           HB       THR 112 130.780   1.244  -0.533
  874    HG1  THR 112           HG1      THR 112 130.357  -0.205  -2.035
  875   HG21  THR 112          HG21      THR 112 128.667   2.924  -1.886
  876   HG22  THR 112          HG22      THR 112 129.499   3.327  -0.401
  877   HG23  THR 112          HG23      THR 112 128.414   1.926  -0.445
  878    H    SER 113           HN       SER 113 130.582   4.848  -2.341
  879    HA   SER 113           HA       SER 113 132.310   5.875  -0.270
  880    HB2  SER 113           HB2      SER 113 131.515   6.908  -2.942
  881    HB3  SER 113           HB1      SER 113 132.286   7.872  -1.690
  882    HG   SER 113           HG       SER 113 133.845   5.918  -1.772
  883    H    LEU 114           HN       LEU 114 130.728   6.125   1.390
  884    HA   LEU 114           HA       LEU 114 128.154   7.154   0.873
  885    HB2  LEU 114           HB2      LEU 114 129.808   6.413   3.231
  886    HB3  LEU 114           HB1      LEU 114 128.381   7.391   3.458
  887    HG   LEU 114           HG       LEU 114 128.279   4.881   3.774
  888   HD11  LEU 114          HD11      LEU 114 126.339   6.454   2.068
  889   HD12  LEU 114          HD12      LEU 114 126.239   6.184   3.818
  890   HD13  LEU 114          HD13      LEU 114 125.953   4.862   2.676
  891   HD21  LEU 114          HD21      LEU 114 129.269   4.150   1.696
  892   HD22  LEU 114          HD22      LEU 114 128.013   5.008   0.796
  893   HD23  LEU 114          HD23      LEU 114 127.584   3.602   1.765
  894    H    VAL 115           HN       VAL 115 127.642   9.141   0.718
  895    HA   VAL 115           HA       VAL 115 129.607  11.145   1.506
  896    HB   VAL 115           HB       VAL 115 128.841  12.629  -0.230
  897   HG11  VAL 115          HG11      VAL 115 130.471  11.015  -0.944
  898   HG12  VAL 115          HG12      VAL 115 129.359  11.368  -2.268
  899   HG13  VAL 115          HG13      VAL 115 129.195   9.868  -1.358
  900   HG21  VAL 115          HG21      VAL 115 126.449  12.186  -0.192
  901   HG22  VAL 115          HG22      VAL 115 126.720  10.580  -0.871
  902   HG23  VAL 115          HG23      VAL 115 127.058  12.013  -1.842
  903    H    THR 116           HN       THR 116 128.995  12.713   2.901
  904    HA   THR 116           HA       THR 116 126.514  12.378   4.250
  905    HB   THR 116           HB       THR 116 128.532  13.210   5.473
  906    HG1  THR 116           HG1      THR 116 126.425  15.148   5.421
  907   HG21  THR 116          HG21      THR 116 128.032  15.650   3.857
  908   HG22  THR 116          HG22      THR 116 129.444  14.591   3.684
  909   HG23  THR 116          HG23      THR 116 129.229  15.568   5.163
  910    H    SER 117           HN       SER 117 124.775  13.664   4.196
  911    HA   SER 117           HA       SER 117 124.266  15.091   1.716
  912    HB2  SER 117           HB2      SER 117 122.401  14.654   4.057
  913    HB3  SER 117           HB1      SER 117 121.962  15.035   2.394
  914    HG   SER 117           HG       SER 117 122.805  13.001   1.781
  915    H    VAL 118           HN       VAL 118 123.625  17.329   1.736
  916    HA   VAL 118           HA       VAL 118 124.623  18.774   4.049
  917    HB   VAL 118           HB       VAL 118 123.604  19.907   1.427
  918   HG11  VAL 118          HG11      VAL 118 124.903  21.884   2.019
  919   HG12  VAL 118          HG12      VAL 118 125.395  21.115   3.526
  920   HG13  VAL 118          HG13      VAL 118 123.700  21.515   3.256
  921   HG21  VAL 118          HG21      VAL 118 125.942  20.073   0.702
  922   HG22  VAL 118          HG22      VAL 118 125.458  18.393   0.958
  923   HG23  VAL 118          HG23      VAL 118 126.441  19.224   2.164
  924    H    ALA 119           HN       ALA 119 123.038  18.643   5.554
  925    HA   ALA 119           HA       ALA 119 120.668  20.215   5.059
  926    HB1  ALA 119           HB1      ALA 119 120.551  17.394   6.170
  927    HB2  ALA 119           HB2      ALA 119 119.914  17.901   4.608
  928    HB3  ALA 119           HB3      ALA 119 119.198  18.523   6.096
  929    H    ILE 120           HN       ILE 120 122.125  21.577   6.243
  930    HA   ILE 120           HA       ILE 120 122.146  20.927   9.108
  931    HB   ILE 120           HB       ILE 120 124.124  22.584   7.525
  932   HG12  ILE 120          HG12      ILE 120 125.805  20.785   8.460
  933   HG13  ILE 120          HG11      ILE 120 124.361  19.796   8.611
  934   HG21  ILE 120          HG21      ILE 120 123.908  23.495   9.759
  935   HG22  ILE 120          HG22      ILE 120 125.485  22.724   9.597
  936   HG23  ILE 120          HG23      ILE 120 124.190  21.906  10.471
  937   HD11  ILE 120          HD11      ILE 120 123.958  20.077   6.207
  938   HD12  ILE 120          HD12      ILE 120 125.504  19.306   6.549
  939   HD13  ILE 120          HD13      ILE 120 125.449  21.005   6.075
  940    H    LEU 121           HN       LEU 121 120.950  22.947   6.639
  941    HA   LEU 121           HA       LEU 121 120.909  25.175   8.472
  942    HB2  LEU 121           HB2      LEU 121 120.841  26.654   6.441
  943    HB3  LEU 121           HB1      LEU 121 122.302  25.729   6.729
  944    HG   LEU 121           HG       LEU 121 121.632  24.146   4.971
  945   HD11  LEU 121          HD11      LEU 121 119.245  24.475   4.903
  946   HD12  LEU 121          HD12      LEU 121 119.956  24.829   3.322
  947   HD13  LEU 121          HD13      LEU 121 119.466  26.146   4.387
  948   HD21  LEU 121          HD21      LEU 121 122.211  25.600   3.113
  949   HD22  LEU 121          HD22      LEU 121 123.205  25.914   4.539
  950   HD23  LEU 121          HD23      LEU 121 121.887  27.012   4.119
  951    H    ASP 122           HN       ASP 122 119.130  26.786   7.110
  952    HA   ASP 122           HA       ASP 122 116.727  26.023   8.182
  953    HB2  ASP 122           HB2      ASP 122 115.780  27.861   6.681
  954    HB3  ASP 122           HB1      ASP 122 117.032  28.322   7.823
  955    H    LYS 123           HN       LYS 123 115.770  24.319   7.751
  956    HA   LYS 123           HA       LYS 123 115.181  23.547   4.982
  957    HB2  LYS 123           HB2      LYS 123 115.480  21.903   7.491
  958    HB3  LYS 123           HB1      LYS 123 114.650  21.288   6.080
  959    HG2  LYS 123           HG2      LYS 123 117.547  22.130   6.208
  960    HG3  LYS 123           HG1      LYS 123 116.939  20.470   6.196
  961    HD2  LYS 123           HD2      LYS 123 115.754  21.274   3.975
  962    HD3  LYS 123           HD1      LYS 123 117.033  22.503   4.074
  963    HE2  LYS 123           HE2      LYS 123 118.747  20.904   3.946
  964    HE3  LYS 123           HE1      LYS 123 117.624  19.566   4.184
  965    HZ1  LYS 123           HZ1      LYS 123 118.272  19.775   1.851
  966    HZ2  LYS 123           HZ2      LYS 123 117.678  21.347   1.794
  967    HZ3  LYS 123           HZ3      LYS 123 116.631  20.066   2.034
  968    H    GLU 124           HN       GLU 124 113.267  24.543   4.614
  969    HA   GLU 124           HA       GLU 124 111.184  24.564   6.591
  970    HB2  GLU 124           HB2      GLU 124 111.120  25.271   3.637
  971    HB3  GLU 124           HB1      GLU 124 109.727  25.384   4.684
  972    HG2  GLU 124           HG2      GLU 124 110.622  27.572   4.409
  973    HG3  GLU 124           HG1      GLU 124 110.966  27.053   6.052
  974    HA   PRO 125           HA       PRO 125 110.126  20.440   5.377
  975    HB2  PRO 125           HB2      PRO 125 108.258  20.006   7.322
  976    HB3  PRO 125           HB1      PRO 125 109.999  19.854   7.566
  977    HG2  PRO 125           HG2      PRO 125 108.156  21.945   8.500
  978    HG3  PRO 125           HG1      PRO 125 109.740  21.484   9.122
  979    HD2  PRO 125           HD2      PRO 125 109.120  23.718   7.485
  980    HD3  PRO 125           HD1      PRO 125 110.723  23.152   7.988
  981    H1   ARG 151           HT1      ARG 151 126.769  12.079 -11.935
  982    H2   ARG 151           HT2      ARG 151 126.829  10.420 -11.577
  983    H3   ARG 151           HT3      ARG 151 128.157  11.375 -11.283
  984    HA   ARG 151           HA       ARG 151 126.972  12.598  -9.571
  985    HB2  ARG 151           HB2      ARG 151 124.881  10.443  -9.875
  986    HB3  ARG 151           HB1      ARG 151 124.862  11.801  -8.777
  987    HG2  ARG 151           HG2      ARG 151 124.530  13.312 -10.680
  988    HG3  ARG 151           HG1      ARG 151 124.521  11.917 -11.767
  989    HD2  ARG 151           HD2      ARG 151 122.584  12.496  -9.525
  990    HD3  ARG 151           HD1      ARG 151 122.233  12.482 -11.256
  991    HE   ARG 151           HE       ARG 151 123.003  10.009 -11.009
  992   HH11  ARG 151          HH11      ARG 151 120.918  11.791  -8.745
  993   HH12  ARG 151          HH12      ARG 151 120.227  10.389  -8.081
  994   HH21  ARG 151          HH21      ARG 151 122.027   8.094 -10.089
  995   HH22  ARG 151          HH22      ARG 151 120.889   8.249  -8.830
  996    H    SER 152           HN       SER 152 127.955  11.934  -7.733
  997    HA   SER 152           HA       SER 152 128.685  10.701  -6.042
  998    HB2  SER 152           HB2      SER 152 126.305   9.940  -5.985
  999    HB3  SER 152           HB1      SER 152 126.734   8.603  -7.038
 1000    HG   SER 152           HG       SER 152 126.647   8.181  -4.722
 1001    H    SER 153           HN       SER 153 129.174   8.101  -5.711
 1002    HA   SER 153           HA       SER 153 130.722   6.902  -7.804
 1003    HB2  SER 153           HB2      SER 153 132.090   7.902  -5.275
 1004    HB3  SER 153           HB1      SER 153 132.842   6.926  -6.538
 1005    HG   SER 153           HG       SER 153 131.668   9.063  -7.615
 1006    H    ARG 154           HN       ARG 154 128.551   5.991  -6.807
 1007    HA   ARG 154           HA       ARG 154 127.462   4.306  -5.827
 1008    HB2  ARG 154           HB2      ARG 154 130.180   3.332  -4.896
 1009    HB3  ARG 154           HB1      ARG 154 128.688   2.430  -4.717
 1010    HG2  ARG 154           HG2      ARG 154 128.514   2.296  -7.160
 1011    HG3  ARG 154           HG1      ARG 154 130.029   3.190  -7.301
 1012    HD2  ARG 154           HD2      ARG 154 131.143   1.401  -5.961
 1013    HD3  ARG 154           HD1      ARG 154 129.639   0.486  -6.007
 1014    HE   ARG 154           HE       ARG 154 130.396   1.205  -8.600
 1015   HH11  ARG 154          HH11      ARG 154 131.327  -1.114  -6.043
 1016   HH12  ARG 154          HH12      ARG 154 132.068  -2.178  -7.131
 1017   HH21  ARG 154          HH21      ARG 154 131.410  -0.332 -10.051
 1018   HH22  ARG 154          HH22      ARG 154 132.122  -1.740  -9.413
 1019    H    THR 155           HN       THR 155 126.469   5.843  -4.467
 1020    HA   THR 155           HA       THR 155 127.487   6.255  -1.816
 1021    HB   THR 155           HB       THR 155 124.809   7.020  -1.972
 1022    HG1  THR 155           HG1      THR 155 124.387   7.570  -3.981
 1023   HG21  THR 155          HG21      THR 155 127.278   8.599  -2.706
 1024   HG22  THR 155          HG22      THR 155 126.652   8.363  -1.073
 1025   HG23  THR 155          HG23      THR 155 125.717   9.283  -2.259
 1026    H    ARG 156           HN       ARG 156 124.906   6.005  -0.419
 1027    HA   ARG 156           HA       ARG 156 123.247   4.706   0.290
 1028    HB2  ARG 156           HB2      ARG 156 124.005   2.778  -1.895
 1029    HB3  ARG 156           HB1      ARG 156 122.626   2.585  -0.827
 1030    HG2  ARG 156           HG2      ARG 156 121.701   4.711  -1.716
 1031    HG3  ARG 156           HG1      ARG 156 123.093   4.799  -2.785
 1032    HD2  ARG 156           HD2      ARG 156 122.467   2.906  -4.001
 1033    HD3  ARG 156           HD1      ARG 156 121.341   2.372  -2.755
 1034    HE   ARG 156           HE       ARG 156 120.661   4.901  -3.908
 1035   HH11  ARG 156          HH11      ARG 156 120.544   1.453  -4.576
 1036   HH12  ARG 156          HH12      ARG 156 118.973   1.430  -5.205
 1037   HH21  ARG 156          HH21      ARG 156 118.511   4.975  -4.720
 1038   HH22  ARG 156          HH22      ARG 156 117.754   3.582  -5.353
 1039    H    ARG 157           HN       ARG 157 123.154   3.517   2.100
 1040    HA   ARG 157           HA       ARG 157 125.592   1.969   2.630
 1041    HB2  ARG 157           HB2      ARG 157 125.099   3.998   4.136
 1042    HB3  ARG 157           HB1      ARG 157 123.698   3.116   4.687
 1043    HG2  ARG 157           HG2      ARG 157 125.548   2.936   6.265
 1044    HG3  ARG 157           HG1      ARG 157 125.117   1.362   5.605
 1045    HD2  ARG 157           HD2      ARG 157 127.012   1.395   4.130
 1046    HD3  ARG 157           HD1      ARG 157 127.381   3.063   4.557
 1047    HE   ARG 157           HE       ARG 157 127.675   2.020   6.903
 1048   HH11  ARG 157          HH11      ARG 157 128.435   0.231   3.975
 1049   HH12  ARG 157          HH12      ARG 157 129.918  -0.385   4.522
 1050   HH21  ARG 157          HH21      ARG 157 129.708   1.078   7.738
 1051   HH22  ARG 157          HH22      ARG 157 130.641   0.090   6.708
 1052    H    GLU 158           HN       GLU 158 125.383  -0.084   3.311
 1053    HA   GLU 158           HA       GLU 158 122.884  -1.320   2.894
 1054    HB2  GLU 158           HB2      GLU 158 124.070  -3.410   3.648
 1055    HB3  GLU 158           HB1      GLU 158 124.727  -2.632   2.223
 1056    HG2  GLU 158           HG2      GLU 158 125.896  -2.140   4.944
 1057    HG3  GLU 158           HG1      GLU 158 126.330  -3.562   4.001
 1058    H    THR 159           HN       THR 159 121.396  -1.448   4.202
 1059    HA   THR 159           HA       THR 159 121.884  -1.193   7.072
 1060    HB   THR 159           HB       THR 159 119.269  -0.851   5.563
 1061    HG1  THR 159           HG1      THR 159 120.906   0.682   4.935
 1062   HG21  THR 159          HG21      THR 159 119.012  -1.279   7.984
 1063   HG22  THR 159          HG22      THR 159 118.595   0.396   7.635
 1064   HG23  THR 159          HG23      THR 159 120.153   0.001   8.340
 1065    H    GLN 160           HN       GLN 160 122.001  -3.151   7.928
 1066    HA   GLN 160           HA       GLN 160 120.700  -5.388   6.649
 1067    HB2  GLN 160           HB2      GLN 160 122.550  -5.212   9.038
 1068    HB3  GLN 160           HB1      GLN 160 121.757  -6.695   8.551
 1069    HG2  GLN 160           HG2      GLN 160 124.002  -6.739   7.739
 1070    HG3  GLN 160           HG1      GLN 160 122.918  -6.586   6.379
 1071   HE21  GLN 160          HE21      GLN 160 123.957  -3.941   8.475
 1072   HE22  GLN 160          HE22      GLN 160 124.825  -3.120   7.236
 1073    H    VAL 161           HN       VAL 161 118.546  -5.552   7.049
 1074    HA   VAL 161           HA       VAL 161 117.793  -4.904   9.742
 1075    HB   VAL 161           HB       VAL 161 115.527  -4.415   9.012
 1076   HG11  VAL 161          HG11      VAL 161 117.530  -3.082   7.247
 1077   HG12  VAL 161          HG12      VAL 161 116.994  -2.556   8.870
 1078   HG13  VAL 161          HG13      VAL 161 115.863  -2.586   7.495
 1079   HG21  VAL 161          HG21      VAL 161 116.412  -5.044   6.220
 1080   HG22  VAL 161          HG22      VAL 161 114.847  -4.406   6.706
 1081   HG23  VAL 161          HG23      VAL 161 115.330  -6.040   7.196
  Start of MODEL   10
    1    H1   GLY  -3           HT1      GLY  -3 120.515  15.803 -20.823
    2    H2   GLY  -3           HT2      GLY  -3 120.487  17.379 -21.405
    3    H3   GLY  -3           HT3      GLY  -3 120.498  16.084 -22.496
    4    HA2  GLY  -3           HA1      GLY  -3 118.282  17.026 -22.322
    5    HA3  GLY  -3           HA2      GLY  -3 118.330  15.389 -21.680
    6    H    ALA  -2           HN       ALA  -2 116.382  17.321 -20.968
    7    HA   ALA  -2           HA       ALA  -2 117.151  18.180 -18.301
    8    HB1  ALA  -2           HB1      ALA  -2 115.811  19.705 -19.699
    9    HB2  ALA  -2           HB2      ALA  -2 114.937  19.236 -18.238
   10    HB3  ALA  -2           HB3      ALA  -2 114.533  18.492 -19.785
   11    H    MET  -1           HN       MET  -1 115.150  15.887 -19.958
   12    HA   MET  -1           HA       MET  -1 114.572  14.580 -17.411
   13    HB2  MET  -1           HB2      MET  -1 113.006  14.576 -19.993
   14    HB3  MET  -1           HB1      MET  -1 112.645  13.523 -18.634
   15    HG2  MET  -1           HG2      MET  -1 112.195  15.446 -17.238
   16    HG3  MET  -1           HG1      MET  -1 112.620  16.524 -18.566
   17    HE1  MET  -1           HE1      MET  -1 109.915  16.683 -16.899
   18    HE2  MET  -1           HE2      MET  -1 108.778  17.010 -18.208
   19    HE3  MET  -1           HE3      MET  -1 110.359  17.787 -18.201
   20    H    GLY   0           HN       GLY   0 113.967  12.131 -18.139
   21    HA2  GLY   0           HA2      GLY   0 114.763  10.187 -19.190
   22    HA3  GLY   0           HA1      GLY   0 116.057  11.141 -19.919
   23    H    LYS   1           HN       LYS   1 115.205  11.407 -16.583
   24    HA   LYS   1           HA       LYS   1 117.713  10.098 -15.777
   25    HB2  LYS   1           HB2      LYS   1 116.357  12.577 -14.688
   26    HB3  LYS   1           HB1      LYS   1 117.536  11.679 -13.765
   27    HG2  LYS   1           HG2      LYS   1 118.668  13.513 -14.666
   28    HG3  LYS   1           HG1      LYS   1 119.156  12.131 -15.647
   29    HD2  LYS   1           HD2      LYS   1 117.626  12.819 -17.396
   30    HD3  LYS   1           HD1      LYS   1 117.030  14.140 -16.389
   31    HE2  LYS   1           HE2      LYS   1 119.841  13.833 -17.453
   32    HE3  LYS   1           HE1      LYS   1 118.612  14.957 -18.031
   33    HZ1  LYS   1           HZ1      LYS   1 119.836  14.980 -15.315
   34    HZ2  LYS   1           HZ2      LYS   1 118.641  16.033 -15.844
   35    HZ3  LYS   1           HZ3      LYS   1 120.161  16.067 -16.556
   36    HA   PRO   2           HA       PRO   2 115.092   7.768 -13.007
   37    HB2  PRO   2           HB2      PRO   2 116.729   7.644 -10.795
   38    HB3  PRO   2           HB1      PRO   2 116.837   6.548 -12.174
   39    HG2  PRO   2           HG2      PRO   2 118.473   8.928 -11.492
   40    HG3  PRO   2           HG1      PRO   2 118.984   7.411 -12.266
   41    HD2  PRO   2           HD2      PRO   2 118.594   9.753 -13.602
   42    HD3  PRO   2           HD1      PRO   2 118.370   8.175 -14.367
   43    H    PHE   3           HN       PHE   3 113.629   8.365 -11.598
   44    HA   PHE   3           HA       PHE   3 113.645  11.156 -10.998
   45    HB2  PHE   3           HB2      PHE   3 111.157  10.659 -10.523
   46    HB3  PHE   3           HB1      PHE   3 111.739  10.674 -12.193
   47    HD1  PHE   3           HD1      PHE   3 110.977   8.507  -9.337
   48    HD2  PHE   3           HD2      PHE   3 111.403   8.811 -13.527
   49    HE1  PHE   3           HE1      PHE   3 110.086   6.278  -9.556
   50    HE2  PHE   3           HE2      PHE   3 110.495   6.533 -13.801
   51    HZ   PHE   3           HZ       PHE   3 109.829   5.247 -11.808
   52    H    PHE   4           HN       PHE   4 112.840  11.993  -9.204
   53    HA   PHE   4           HA       PHE   4 112.606  10.473  -6.782
   54    HB2  PHE   4           HB2      PHE   4 114.930  10.928  -6.451
   55    HB3  PHE   4           HB1      PHE   4 114.736  12.493  -7.262
   56    HD1  PHE   4           HD2      PHE   4 114.037  10.718  -4.059
   57    HD2  PHE   4           HD1      PHE   4 114.218  14.454  -6.114
   58    HE1  PHE   4           HE2      PHE   4 113.636  11.921  -1.968
   59    HE2  PHE   4           HE1      PHE   4 113.799  15.636  -4.056
   60    HZ   PHE   4           HZ       PHE   4 113.516  14.376  -1.940
   61    H    THR   5           HN       THR   5 111.012  11.260  -5.727
   62    HA   THR   5           HA       THR   5 110.841  13.949  -4.884
   63    HB   THR   5           HB       THR   5 109.855  14.209  -7.112
   64    HG1  THR   5           HG1      THR   5 108.262  14.689  -4.829
   65   HG21  THR   5          HG21      THR   5 107.639  13.240  -7.674
   66   HG22  THR   5          HG22      THR   5 107.644  12.425  -6.105
   67   HG23  THR   5          HG23      THR   5 108.838  11.981  -7.310
   68    H    ARG   6           HN       ARG   6 110.930  11.153  -4.025
   69    HA   ARG   6           HA       ARG   6 110.441   9.866  -2.260
   70    HB2  ARG   6           HB2      ARG   6 109.942  10.903  -0.196
   71    HB3  ARG   6           HB1      ARG   6 110.931  11.962  -1.206
   72    HG2  ARG   6           HG2      ARG   6 108.848  13.186  -1.808
   73    HG3  ARG   6           HG1      ARG   6 108.022  12.246  -0.556
   74    HD2  ARG   6           HD2      ARG   6 109.698  12.955   1.018
   75    HD3  ARG   6           HD1      ARG   6 110.408  13.908  -0.302
   76    HE   ARG   6           HE       ARG   6 107.833  14.774  -0.153
   77   HH11  ARG   6          HH11      ARG   6 110.464  14.615   2.207
   78   HH12  ARG   6          HH12      ARG   6 109.984  16.004   3.050
   79   HH21  ARG   6          HH21      ARG   6 107.193  16.717   1.009
   80   HH22  ARG   6          HH22      ARG   6 108.078  17.223   2.367
   81    H    ASN   7           HN       ASN   7 108.425  10.488  -4.126
   82    HA   ASN   7           HA       ASN   7 105.997   9.517  -2.799
   83    HB2  ASN   7           HB2      ASN   7 106.490  10.643  -5.482
   84    HB3  ASN   7           HB1      ASN   7 105.149   9.521  -5.319
   85   HD21  ASN   7          HD21      ASN   7 106.374  12.599  -4.539
   86   HD22  ASN   7          HD22      ASN   7 104.938  13.259  -3.841
   87    HA   PRO   8           HA       PRO   8 106.710   5.127  -3.718
   88    HB2  PRO   8           HB2      PRO   8 103.884   5.068  -3.494
   89    HB3  PRO   8           HB1      PRO   8 104.954   4.158  -2.531
   90    HG2  PRO   8           HG2      PRO   8 103.415   6.343  -1.884
   91    HG3  PRO   8           HG1      PRO   8 104.733   5.762  -0.832
   92    HD2  PRO   8           HD2      PRO   8 104.479   8.181  -2.278
   93    HD3  PRO   8           HD1      PRO   8 105.901   7.669  -1.336
   94    H    SER   9           HN       SER   9 104.197   7.237  -4.565
   95    HA   SER   9           HA       SER   9 103.065   5.740  -6.383
   96    HB2  SER   9           HB2      SER   9 101.978   7.439  -5.234
   97    HB3  SER   9           HB1      SER   9 102.963   8.703  -5.974
   98    HG   SER   9           HG       SER   9 101.126   6.983  -7.307
   99    H    GLU  10           HN       GLU  10 105.913   7.828  -6.532
  100    HA   GLU  10           HA       GLU  10 105.825   8.312  -9.375
  101    HB2  GLU  10           HB2      GLU  10 107.920   9.459  -9.149
  102    HB3  GLU  10           HB1      GLU  10 107.048   9.859  -7.671
  103    HG2  GLU  10           HG2      GLU  10 108.411   8.120  -6.516
  104    HG3  GLU  10           HG1      GLU  10 109.267   7.858  -8.029
  105    H    LEU  11           HN       LEU  11 107.317   6.221  -7.059
  106    HA   LEU  11           HA       LEU  11 109.112   4.891  -8.681
  107    HB2  LEU  11           HB2      LEU  11 107.639   3.939  -6.249
  108    HB3  LEU  11           HB1      LEU  11 108.970   3.076  -6.993
  109    HG   LEU  11           HG       LEU  11 109.134   5.828  -5.756
  110   HD11  LEU  11          HD11      LEU  11 110.483   4.734  -4.054
  111   HD12  LEU  11          HD12      LEU  11 110.194   3.174  -4.830
  112   HD13  LEU  11          HD13      LEU  11 108.851   4.067  -4.116
  113   HD21  LEU  11          HD21      LEU  11 111.578   5.528  -6.066
  114   HD22  LEU  11          HD22      LEU  11 110.693   5.647  -7.582
  115   HD23  LEU  11          HD23      LEU  11 111.242   4.075  -7.014
  116    H    LYS  12           HN       LYS  12 109.079   3.433  -9.975
  117    HA   LYS  12           HA       LYS  12 106.693   2.817 -11.457
  118    HB2  LYS  12           HB2      LYS  12 108.229   1.753 -13.000
  119    HB3  LYS  12           HB1      LYS  12 108.733   3.395 -12.584
  120    HG2  LYS  12           HG2      LYS  12 110.388   2.604 -11.120
  121    HG3  LYS  12           HG1      LYS  12 109.729   0.972 -11.210
  122    HD2  LYS  12           HD2      LYS  12 111.754   1.081 -12.565
  123    HD3  LYS  12           HD1      LYS  12 110.352   0.975 -13.638
  124    HE2  LYS  12           HE2      LYS  12 110.423   3.413 -13.941
  125    HE3  LYS  12           HE1      LYS  12 111.842   3.488 -12.905
  126    HZ1  LYS  12           HZ1      LYS  12 112.453   3.514 -15.214
  127    HZ2  LYS  12           HZ2      LYS  12 111.655   2.061 -15.489
  128    HZ3  LYS  12           HZ3      LYS  12 113.021   2.100 -14.497
  129    H    GLY  13           HN       GLY  13 106.635   0.546 -12.466
  130    HA2  GLY  13           HA2      GLY  13 106.427  -1.716 -12.317
  131    HA3  GLY  13           HA1      GLY  13 107.391  -1.679 -10.854
  132    H    LYS  14           HN       LYS  14 106.406  -2.390  -9.219
  133    HA   LYS  14           HA       LYS  14 103.440  -2.364  -9.024
  134    HB2  LYS  14           HB2      LYS  14 105.258  -4.079  -7.386
  135    HB3  LYS  14           HB1      LYS  14 103.557  -4.253  -7.662
  136    HG2  LYS  14           HG2      LYS  14 105.647  -4.551  -9.706
  137    HG3  LYS  14           HG1      LYS  14 104.882  -5.907  -8.812
  138    HD2  LYS  14           HD2      LYS  14 103.509  -3.903 -10.557
  139    HD3  LYS  14           HD1      LYS  14 103.957  -5.514 -11.121
  140    HE2  LYS  14           HE2      LYS  14 102.144  -4.989  -8.756
  141    HE3  LYS  14           HE1      LYS  14 101.556  -5.344 -10.382
  142    HZ1  LYS  14           HZ1      LYS  14 102.662  -7.491 -10.230
  143    HZ2  LYS  14           HZ2      LYS  14 101.556  -7.293  -8.991
  144    HZ3  LYS  14           HZ3      LYS  14 103.198  -7.153  -8.669
  145    H    PHE  15           HN       PHE  15 102.613  -1.933  -7.219
  146    HA   PHE  15           HA       PHE  15 104.266  -0.539  -5.253
  147    HB2  PHE  15           HB2      PHE  15 102.941   1.017  -6.699
  148    HB3  PHE  15           HB1      PHE  15 101.499   0.160  -6.166
  149    HD1  PHE  15           HD2      PHE  15 103.815   0.459  -3.564
  150    HD2  PHE  15           HD1      PHE  15 100.886   2.612  -5.679
  151    HE1  PHE  15           HE2      PHE  15 103.633   2.034  -1.650
  152    HE2  PHE  15           HE1      PHE  15 100.681   4.231  -3.796
  153    HZ   PHE  15           HZ       PHE  15 102.066   3.927  -1.780
  154    H    ILE  16           HN       ILE  16 104.195  -1.824  -3.463
  155    HA   ILE  16           HA       ILE  16 101.641  -2.985  -2.821
  156    HB   ILE  16           HB       ILE  16 102.781  -4.992  -1.903
  157   HG12  ILE  16          HG12      ILE  16 105.133  -4.145  -2.060
  158   HG13  ILE  16          HG11      ILE  16 104.907  -5.768  -2.669
  159   HG21  ILE  16          HG21      ILE  16 102.701  -4.671  -4.876
  160   HG22  ILE  16          HG22      ILE  16 101.394  -5.164  -3.799
  161   HG23  ILE  16          HG23      ILE  16 102.788  -6.219  -4.031
  162   HD11  ILE  16          HD11      ILE  16 104.926  -4.871  -4.996
  163   HD12  ILE  16          HD12      ILE  16 106.429  -4.561  -4.139
  164   HD13  ILE  16          HD13      ILE  16 105.250  -3.265  -4.349
  165    H    HIS  17           HN       HIS  17 101.260  -3.508  -0.726
  166    HA   HIS  17           HA       HIS  17 102.988  -2.287   1.277
  167    HB2  HIS  17           HB2      HIS  17 101.146  -0.757   0.666
  168    HB3  HIS  17           HB1      HIS  17  99.984  -2.041   0.998
  169    HD1  HIS  17           HD1      HIS  17 101.519   0.883   2.491
  170    HD2  HIS  17           HD2      HIS  17  99.986  -2.717   3.884
  171    HE1  HIS  17           HE1      HIS  17 101.020   1.235   4.925
  172    H    THR  18           HN       THR  18 103.613  -4.057   2.200
  173    HA   THR  18           HA       THR  18 101.610  -6.067   2.982
  174    HB   THR  18           HB       THR  18 102.808  -7.003   1.079
  175    HG1  THR  18           HG1      THR  18 103.759  -8.238   3.462
  176   HG21  THR  18          HG21      THR  18 105.235  -7.441   1.139
  177   HG22  THR  18          HG22      THR  18 105.345  -6.588   2.679
  178   HG23  THR  18          HG23      THR  18 104.889  -5.712   1.219
  179    H    LYS  19           HN       LYS  19 101.773  -6.891   4.967
  180    HA   LYS  19           HA       LYS  19 103.428  -5.599   6.897
  181    HB2  LYS  19           HB2      LYS  19 101.165  -6.238   7.495
  182    HB3  LYS  19           HB1      LYS  19 101.463  -7.889   7.024
  183    HG2  LYS  19           HG2      LYS  19 102.852  -6.641   9.406
  184    HG3  LYS  19           HG1      LYS  19 101.247  -7.337   9.537
  185    HD2  LYS  19           HD2      LYS  19 102.324  -9.483   8.483
  186    HD3  LYS  19           HD1      LYS  19 103.853  -8.732   8.939
  187    HE2  LYS  19           HE2      LYS  19 103.209 -10.254  10.662
  188    HE3  LYS  19           HE1      LYS  19 103.068  -8.611  11.269
  189    HZ1  LYS  19           HZ1      LYS  19 100.801 -10.319  10.345
  190    HZ2  LYS  19           HZ2      LYS  19 100.623  -8.763  10.934
  191    HZ3  LYS  19           HZ3      LYS  19 101.183  -9.981  11.937
  192    H    LEU  20           HN       LEU  20 105.286  -6.264   7.762
  193    HA   LEU  20           HA       LEU  20 106.202  -8.971   7.070
  194    HB2  LEU  20           HB2      LEU  20 107.513  -6.466   6.536
  195    HB3  LEU  20           HB1      LEU  20 108.432  -7.320   7.771
  196    HG   LEU  20           HG       LEU  20 108.733  -9.234   6.313
  197   HD11  LEU  20          HD11      LEU  20 106.678  -9.213   5.097
  198   HD12  LEU  20          HD12      LEU  20 108.081  -9.237   4.036
  199   HD13  LEU  20          HD13      LEU  20 107.170  -7.732   4.252
  200   HD21  LEU  20          HD21      LEU  20 110.133  -8.220   4.614
  201   HD22  LEU  20          HD22      LEU  20 110.356  -7.468   6.189
  202   HD23  LEU  20          HD23      LEU  20 109.404  -6.650   4.945
  203    H    ARG  21           HN       ARG  21 106.414 -10.248   8.792
  204    HA   ARG  21           HA       ARG  21 105.784  -9.226  11.309
  205    HB2  ARG  21           HB2      ARG  21 105.142 -11.441  10.480
  206    HB3  ARG  21           HB1      ARG  21 106.831 -11.927  10.482
  207    HG2  ARG  21           HG2      ARG  21 106.727 -11.234  12.991
  208    HG3  ARG  21           HG1      ARG  21 104.990 -11.449  12.769
  209    HD2  ARG  21           HD2      ARG  21 107.068 -13.435  12.024
  210    HD3  ARG  21           HD1      ARG  21 106.205 -13.501  13.576
  211    HE   ARG  21           HE       ARG  21 104.353 -13.511  11.483
  212   HH11  ARG  21          HH11      ARG  21 106.932 -15.591  12.719
  213   HH12  ARG  21          HH12      ARG  21 106.250 -17.053  12.182
  214   HH21  ARG  21          HH21      ARG  21 103.375 -15.540  10.714
  215   HH22  ARG  21          HH22      ARG  21 104.176 -17.014  11.015
  216    H    LYS  22           HN       LYS  22 107.282  -8.338  12.663
  217    HA   LYS  22           HA       LYS  22 109.978  -8.326  12.468
  218    HB2  LYS  22           HB2      LYS  22 108.084  -8.059  14.716
  219    HB3  LYS  22           HB1      LYS  22 109.811  -8.038  15.018
  220    HG2  LYS  22           HG2      LYS  22 108.978  -5.809  14.877
  221    HG3  LYS  22           HG1      LYS  22 110.054  -6.259  13.565
  222    HD2  LYS  22           HD2      LYS  22 107.221  -6.614  12.925
  223    HD3  LYS  22           HD1      LYS  22 107.649  -4.958  13.331
  224    HE2  LYS  22           HE2      LYS  22 107.731  -5.597  10.961
  225    HE3  LYS  22           HE1      LYS  22 109.165  -4.780  11.561
  226    HZ1  LYS  22           HZ1      LYS  22 109.619  -6.649  10.100
  227    HZ2  LYS  22           HZ2      LYS  22 108.854  -7.709  11.155
  228    HZ3  LYS  22           HZ3      LYS  22 110.278  -6.904  11.622
  229    H    SER  23           HN       SER  23 110.979 -10.103  12.172
  230    HA   SER  23           HA       SER  23 110.541 -12.353  13.964
  231    HB2  SER  23           HB2      SER  23 110.193 -12.706  11.492
  232    HB3  SER  23           HB1      SER  23 111.878 -12.289  11.239
  233    HG   SER  23           HG       SER  23 112.488 -14.171  12.009
  234    H    SER  24           HN       SER  24 112.063 -12.754  15.332
  235    HA   SER  24           HA       SER  24 113.901 -12.573  16.641
  236    HB2  SER  24           HB2      SER  24 115.379 -12.821  14.060
  237    HB3  SER  24           HB1      SER  24 115.815 -13.493  15.629
  238    HG   SER  24           HG       SER  24 114.200 -14.504  13.720
  239    H    ARG  25           HN       ARG  25 113.107 -10.033  16.445
  240    HA   ARG  25           HA       ARG  25 113.838  -7.960  17.028
  241    HB2  ARG  25           HB2      ARG  25 116.390  -9.473  17.225
  242    HB3  ARG  25           HB1      ARG  25 116.513  -7.726  17.131
  243    HG2  ARG  25           HG2      ARG  25 114.775  -9.118  19.143
  244    HG3  ARG  25           HG1      ARG  25 116.474  -8.702  19.460
  245    HD2  ARG  25           HD2      ARG  25 115.954  -6.373  19.027
  246    HD3  ARG  25           HD1      ARG  25 114.287  -6.791  18.661
  247    HE   ARG  25           HE       ARG  25 115.019  -7.694  21.224
  248   HH11  ARG  25          HH11      ARG  25 114.116  -4.788  19.429
  249   HH12  ARG  25          HH12      ARG  25 113.542  -3.933  20.782
  250   HH21  ARG  25          HH21      ARG  25 114.212  -6.520  23.124
  251   HH22  ARG  25          HH22      ARG  25 113.576  -4.959  22.926
  252    H    GLY  26           HN       GLY  26 113.200  -8.432  14.454
  253    HA2  GLY  26           HA2      GLY  26 113.796  -6.128  13.247
  254    HA3  GLY  26           HA1      GLY  26 115.179  -7.143  12.859
  255    H    PHE  27           HN       PHE  27 115.059  -7.974  11.022
  256    HA   PHE  27           HA       PHE  27 112.455  -8.717   9.964
  257    HB2  PHE  27           HB2      PHE  27 114.428  -6.786   9.134
  258    HB3  PHE  27           HB1      PHE  27 113.558  -7.647   7.779
  259    HD1  PHE  27           HD1      PHE  27 110.952  -7.217   8.193
  260    HD2  PHE  27           HD2      PHE  27 114.095  -5.047  10.009
  261    HE1  PHE  27           HE1      PHE  27 109.424  -5.372   8.686
  262    HE2  PHE  27           HE2      PHE  27 112.606  -3.236  10.482
  263    HZ   PHE  27           HZ       PHE  27 110.294  -3.368   9.894
  264    H    GLY  28           HN       GLY  28 115.699  -8.636   8.499
  265    HA2  GLY  28           HA2      GLY  28 116.828 -10.750   8.084
  266    HA3  GLY  28           HA1      GLY  28 115.242 -11.474   7.852
  267    H    PHE  29           HN       PHE  29 116.718  -8.471   6.718
  268    HA   PHE  29           HA       PHE  29 117.076  -9.415   4.106
  269    HB2  PHE  29           HB2      PHE  29 115.615  -7.871   2.885
  270    HB3  PHE  29           HB1      PHE  29 114.653  -8.939   3.879
  271    HD1  PHE  29           HD1      PHE  29 116.074  -5.527   3.758
  272    HD2  PHE  29           HD2      PHE  29 113.023  -8.037   5.269
  273    HE1  PHE  29           HE1      PHE  29 114.859  -3.533   4.578
  274    HE2  PHE  29           HE2      PHE  29 111.810  -6.054   6.106
  275    HZ   PHE  29           HZ       PHE  29 112.721  -3.812   5.755
  276    H    THR  30           HN       THR  30 118.502  -8.078   2.998
  277    HA   THR  30           HA       THR  30 119.404  -5.828   4.641
  278    HB   THR  30           HB       THR  30 121.597  -6.202   3.405
  279    HG1  THR  30           HG1      THR  30 121.580  -8.643   2.812
  280   HG21  THR  30          HG21      THR  30 121.228  -6.938   5.745
  281   HG22  THR  30          HG22      THR  30 122.293  -8.039   4.891
  282   HG23  THR  30          HG23      THR  30 120.600  -8.462   5.153
  283    H    VAL  31           HN       VAL  31 119.653  -3.986   3.966
  284    HA   VAL  31           HA       VAL  31 118.516  -3.502   1.354
  285    HB   VAL  31           HB       VAL  31 116.776  -3.428   2.865
  286   HG11  VAL  31          HG11      VAL  31 117.967  -3.253   4.994
  287   HG12  VAL  31          HG12      VAL  31 116.733  -1.993   4.897
  288   HG13  VAL  31          HG13      VAL  31 118.426  -1.597   4.602
  289   HG21  VAL  31          HG21      VAL  31 117.792  -0.754   2.426
  290   HG22  VAL  31          HG22      VAL  31 116.106  -1.142   2.902
  291   HG23  VAL  31          HG23      VAL  31 116.772  -1.700   1.328
  292    H    VAL  32           HN       VAL  32 119.263  -1.763   0.327
  293    HA   VAL  32           HA       VAL  32 121.595  -0.400   1.424
  294    HB   VAL  32           HB       VAL  32 122.357  -0.210  -0.995
  295   HG11  VAL  32          HG11      VAL  32 122.269  -2.860   0.413
  296   HG12  VAL  32          HG12      VAL  32 123.517  -1.620   0.571
  297   HG13  VAL  32          HG13      VAL  32 123.332  -2.501  -0.948
  298   HG21  VAL  32          HG21      VAL  32 120.314  -2.407  -1.240
  299   HG22  VAL  32          HG22      VAL  32 121.538  -2.040  -2.463
  300   HG23  VAL  32          HG23      VAL  32 120.287  -0.855  -2.075
  301    H    GLY  33           HN       GLY  33 122.108   1.614   0.775
  302    HA2  GLY  33           HA2      GLY  33 121.654   3.659  -0.316
  303    HA3  GLY  33           HA1      GLY  33 119.975   3.139  -0.513
  304    H    GLY  34           HN       GLY  34 118.735   4.353   0.607
  305    HA2  GLY  34           HA2      GLY  34 117.915   5.741   2.126
  306    HA3  GLY  34           HA1      GLY  34 118.066   4.421   3.204
  307    H    ASP  35           HN       ASP  35 119.533   7.152   1.895
  308    HA   ASP  35           HA       ASP  35 121.095   7.415   4.388
  309    HB2  ASP  35           HB2      ASP  35 122.255   6.641   2.381
  310    HB3  ASP  35           HB1      ASP  35 121.974   8.189   1.669
  311    H    GLU  36           HN       GLU  36 118.974   8.809   2.121
  312    HA   GLU  36           HA       GLU  36 119.200  11.467   3.303
  313    HB2  GLU  36           HB2      GLU  36 119.941  12.331   1.057
  314    HB3  GLU  36           HB1      GLU  36 121.187  11.533   2.016
  315    HG2  GLU  36           HG2      GLU  36 120.819   9.516   0.837
  316    HG3  GLU  36           HG1      GLU  36 119.625  10.294  -0.218
  317    HA   PRO  37           HA       PRO  37 115.195  12.050   1.953
  318    HB2  PRO  37           HB2      PRO  37 116.313  14.373   0.520
  319    HB3  PRO  37           HB1      PRO  37 114.922  14.395   1.669
  320    HG2  PRO  37           HG2      PRO  37 117.197  15.380   2.486
  321    HG3  PRO  37           HG1      PRO  37 116.522  14.068   3.487
  322    HD2  PRO  37           HD2      PRO  37 118.480  13.849   1.238
  323    HD3  PRO  37           HD1      PRO  37 118.786  13.339   2.881
  324    H    ASP  38           HN       ASP  38 117.656  12.682  -0.282
  325    HA   ASP  38           HA       ASP  38 116.204  12.297  -2.623
  326    HB2  ASP  38           HB2      ASP  38 118.004  13.715  -2.712
  327    HB3  ASP  38           HB1      ASP  38 119.068  12.572  -1.898
  328    H    GLU  39           HN       GLU  39 117.831  10.050  -0.477
  329    HA   GLU  39           HA       GLU  39 117.393   8.064  -2.531
  330    HB2  GLU  39           HB2      GLU  39 119.797   8.593  -2.475
  331    HB3  GLU  39           HB1      GLU  39 119.853   8.067  -0.798
  332    HG2  GLU  39           HG2      GLU  39 119.473   5.829  -1.371
  333    HG3  GLU  39           HG1      GLU  39 118.906   6.257  -2.984
  334    H    PHE  40           HN       PHE  40 116.197   6.674  -2.067
  335    HA   PHE  40           HA       PHE  40 115.109   6.053   0.577
  336    HB2  PHE  40           HB2      PHE  40 114.332   4.712  -2.000
  337    HB3  PHE  40           HB1      PHE  40 113.339   5.051  -0.598
  338    HD1  PHE  40           HD2      PHE  40 113.634   7.959  -0.278
  339    HD2  PHE  40           HD1      PHE  40 113.306   5.612  -3.808
  340    HE1  PHE  40           HE2      PHE  40 112.683   9.895  -1.484
  341    HE2  PHE  40           HE1      PHE  40 112.365   7.532  -5.020
  342    HZ   PHE  40           HZ       PHE  40 112.037   9.668  -3.874
  343    H    LEU  41           HN       LEU  41 114.620   3.614   0.948
  344    HA   LEU  41           HA       LEU  41 117.269   2.415   0.665
  345    HB2  LEU  41           HB2      LEU  41 115.035   1.412   2.469
  346    HB3  LEU  41           HB1      LEU  41 116.656   0.807   2.130
  347    HG   LEU  41           HG       LEU  41 117.642   2.682   3.158
  348   HD11  LEU  41          HD11      LEU  41 115.819   4.362   2.996
  349   HD12  LEU  41          HD12      LEU  41 116.255   4.129   4.695
  350   HD13  LEU  41          HD13      LEU  41 114.822   3.356   4.040
  351   HD21  LEU  41          HD21      LEU  41 115.756   1.110   4.863
  352   HD22  LEU  41          HD22      LEU  41 117.202   1.957   5.437
  353   HD23  LEU  41          HD23      LEU  41 117.352   0.623   4.304
  354    H    GLN  42           HN       GLN  42 117.540   0.243  -0.167
  355    HA   GLN  42           HA       GLN  42 115.221  -0.680  -1.693
  356    HB2  GLN  42           HB2      GLN  42 116.787   0.713  -2.863
  357    HB3  GLN  42           HB1      GLN  42 118.072  -0.493  -2.539
  358    HG2  GLN  42           HG2      GLN  42 116.351  -2.062  -3.800
  359    HG3  GLN  42           HG1      GLN  42 115.599  -0.583  -4.285
  360   HE21  GLN  42          HE21      GLN  42 118.161   0.857  -4.492
  361   HE22  GLN  42          HE22      GLN  42 118.857   0.335  -5.975
  362    H    ILE  43           HN       ILE  43 115.321  -2.920  -1.936
  363    HA   ILE  43           HA       ILE  43 116.878  -4.333   0.122
  364    HB   ILE  43           HB       ILE  43 114.925  -5.582  -1.819
  365   HG12  ILE  43          HG12      ILE  43 113.778  -3.854  -0.609
  366   HG13  ILE  43          HG11      ILE  43 113.296  -5.421   0.028
  367   HG21  ILE  43          HG21      ILE  43 116.407  -7.196  -0.711
  368   HG22  ILE  43          HG22      ILE  43 114.748  -7.365  -0.133
  369   HG23  ILE  43          HG23      ILE  43 115.949  -6.548   0.864
  370   HD11  ILE  43          HD11      ILE  43 113.614  -3.841   1.807
  371   HD12  ILE  43          HD12      ILE  43 115.248  -3.504   1.253
  372   HD13  ILE  43          HD13      ILE  43 114.847  -5.097   1.897
  373    H    LYS  44           HN       LYS  44 118.824  -5.179  -0.252
  374    HA   LYS  44           HA       LYS  44 119.484  -5.796  -3.027
  375    HB2  LYS  44           HB2      LYS  44 121.863  -5.710  -2.440
  376    HB3  LYS  44           HB1      LYS  44 121.034  -4.240  -2.027
  377    HG2  LYS  44           HG2      LYS  44 122.580  -4.666  -0.289
  378    HG3  LYS  44           HG1      LYS  44 120.987  -5.025   0.380
  379    HD2  LYS  44           HD2      LYS  44 122.637  -6.674   1.089
  380    HD3  LYS  44           HD1      LYS  44 121.449  -7.427   0.030
  381    HE2  LYS  44           HE2      LYS  44 122.995  -7.272  -1.832
  382    HE3  LYS  44           HE1      LYS  44 124.185  -6.477  -0.816
  383    HZ1  LYS  44           HZ1      LYS  44 123.144  -9.236  -0.478
  384    HZ2  LYS  44           HZ2      LYS  44 124.296  -8.520   0.536
  385    HZ3  LYS  44           HZ3      LYS  44 124.656  -8.832  -1.076
  386    H    SER  45           HN       SER  45 118.831  -7.372  -0.102
  387    HA   SER  45           HA       SER  45 118.863  -9.859  -1.541
  388    HB2  SER  45           HB2      SER  45 120.605  -9.533   0.926
  389    HB3  SER  45           HB1      SER  45 120.223 -11.064   0.147
  390    HG   SER  45           HG       SER  45 121.124  -9.433  -1.704
  391    H    LEU  46           HN       LEU  46 117.016 -10.859  -0.938
  392    HA   LEU  46           HA       LEU  46 115.885 -10.129   1.514
  393    HB2  LEU  46           HB2      LEU  46 114.039 -11.619   0.975
  394    HB3  LEU  46           HB1      LEU  46 114.420 -10.602  -0.386
  395    HG   LEU  46           HG       LEU  46 115.793 -12.833  -1.080
  396   HD11  LEU  46          HD11      LEU  46 113.352 -13.748   0.371
  397   HD12  LEU  46          HD12      LEU  46 115.010 -14.056   0.925
  398   HD13  LEU  46          HD13      LEU  46 114.420 -14.770  -0.591
  399   HD21  LEU  46          HD21      LEU  46 113.914 -13.309  -2.502
  400   HD22  LEU  46          HD22      LEU  46 114.240 -11.564  -2.312
  401   HD23  LEU  46          HD23      LEU  46 112.903 -12.314  -1.427
  402    H    VAL  47           HN       VAL  47 116.508 -11.137   3.372
  403    HA   VAL  47           HA       VAL  47 118.403 -13.265   3.117
  404    HB   VAL  47           HB       VAL  47 117.421 -11.722   5.544
  405   HG11  VAL  47          HG11      VAL  47 118.202 -13.920   6.148
  406   HG12  VAL  47          HG12      VAL  47 119.329 -12.679   6.718
  407   HG13  VAL  47          HG13      VAL  47 119.715 -13.644   5.281
  408   HG21  VAL  47          HG21      VAL  47 119.528 -10.523   5.446
  409   HG22  VAL  47          HG22      VAL  47 118.719 -10.365   3.892
  410   HG23  VAL  47          HG23      VAL  47 120.057 -11.488   4.077
  411    H    LEU  48           HN       LEU  48 117.964 -15.315   3.443
  412    HA   LEU  48           HA       LEU  48 115.344 -16.326   3.806
  413    HB2  LEU  48           HB2      LEU  48 118.010 -17.643   4.268
  414    HB3  LEU  48           HB1      LEU  48 116.474 -18.481   4.178
  415    HG   LEU  48           HG       LEU  48 117.752 -16.954   1.909
  416   HD11  LEU  48          HD11      LEU  48 118.116 -19.164   0.916
  417   HD12  LEU  48          HD12      LEU  48 117.515 -19.919   2.396
  418   HD13  LEU  48          HD13      LEU  48 118.998 -18.966   2.430
  419   HD21  LEU  48          HD21      LEU  48 115.318 -16.945   1.757
  420   HD22  LEU  48          HD22      LEU  48 115.283 -18.694   1.990
  421   HD23  LEU  48          HD23      LEU  48 116.008 -18.014   0.535
  422    H    ASP  49           HN       ASP  49 114.287 -17.146   5.495
  423    HA   ASP  49           HA       ASP  49 113.586 -17.409   7.610
  424    HB2  ASP  49           HB2      ASP  49 115.897 -18.268   8.107
  425    HB3  ASP  49           HB1      ASP  49 116.373 -16.643   8.525
  426    H    GLY  50           HN       GLY  50 114.335 -14.774   6.107
  427    HA2  GLY  50           HA2      GLY  50 113.628 -12.760   8.114
  428    HA3  GLY  50           HA1      GLY  50 113.989 -12.617   6.366
  429    HA   PRO  51           HA       PRO  51 109.450 -13.166   7.257
  430    HB2  PRO  51           HB2      PRO  51 108.393 -10.609   7.569
  431    HB3  PRO  51           HB1      PRO  51 109.025 -11.593   8.845
  432    HG2  PRO  51           HG2      PRO  51 110.208  -9.215   7.670
  433    HG3  PRO  51           HG1      PRO  51 110.508  -9.995   9.224
  434    HD2  PRO  51           HD2      PRO  51 111.940 -10.179   6.725
  435    HD3  PRO  51           HD1      PRO  51 112.475 -10.749   8.285
  436    H    ALA  52           HN       ALA  52 111.122 -10.984   5.309
  437    HA   ALA  52           HA       ALA  52 109.457 -10.577   3.095
  438    HB1  ALA  52           HB1      ALA  52 111.577 -10.187   1.939
  439    HB2  ALA  52           HB2      ALA  52 112.442 -10.896   3.300
  440    HB3  ALA  52           HB3      ALA  52 111.548  -9.392   3.511
  441    H    ALA  53           HN       ALA  53 111.914 -12.984   3.839
  442    HA   ALA  53           HA       ALA  53 111.830 -14.579   1.527
  443    HB1  ALA  53           HB1      ALA  53 112.533 -15.327   4.356
  444    HB2  ALA  53           HB2      ALA  53 113.648 -14.573   3.210
  445    HB3  ALA  53           HB3      ALA  53 113.021 -16.200   2.900
  446    H    LEU  54           HN       LEU  54 110.358 -14.727   4.594
  447    HA   LEU  54           HA       LEU  54 109.285 -17.259   4.401
  448    HB2  LEU  54           HB2      LEU  54 108.811 -15.039   6.203
  449    HB3  LEU  54           HB1      LEU  54 108.361 -16.723   6.471
  450    HG   LEU  54           HG       LEU  54 111.202 -15.700   6.075
  451   HD11  LEU  54          HD11      LEU  54 111.453 -16.437   8.133
  452   HD12  LEU  54          HD12      LEU  54 109.656 -16.901   8.032
  453   HD13  LEU  54          HD13      LEU  54 110.196 -15.160   7.837
  454   HD21  LEU  54          HD21      LEU  54 111.849 -18.001   6.571
  455   HD22  LEU  54          HD22      LEU  54 110.990 -17.913   5.049
  456   HD23  LEU  54          HD23      LEU  54 110.164 -18.506   6.498
  457    H    ASP  55           HN       ASP  55 107.904 -13.992   4.115
  458    HA   ASP  55           HA       ASP  55 105.226 -14.879   3.724
  459    HB2  ASP  55           HB2      ASP  55 105.910 -12.541   4.418
  460    HB3  ASP  55           HB1      ASP  55 106.442 -12.283   2.761
  461    H    GLY  56           HN       GLY  56 108.003 -14.498   1.864
  462    HA2  GLY  56           HA2      GLY  56 108.495 -15.466  -0.192
  463    HA3  GLY  56           HA1      GLY  56 106.823 -15.964  -0.305
  464    H    LYS  57           HN       LYS  57 105.797 -13.142  -0.108
  465    HA   LYS  57           HA       LYS  57 106.025 -12.731  -2.939
  466    HB2  LYS  57           HB2      LYS  57 104.273 -11.096  -2.790
  467    HB3  LYS  57           HB1      LYS  57 103.890 -12.463  -1.757
  468    HG2  LYS  57           HG2      LYS  57 104.604 -11.170   0.205
  469    HG3  LYS  57           HG1      LYS  57 104.923  -9.789  -0.842
  470    HD2  LYS  57           HD2      LYS  57 102.747  -9.552   0.239
  471    HD3  LYS  57           HD1      LYS  57 102.545  -9.765  -1.502
  472    HE2  LYS  57           HE2      LYS  57 101.951 -12.086  -1.198
  473    HE3  LYS  57           HE1      LYS  57 102.314 -11.992   0.525
  474    HZ1  LYS  57           HZ1      LYS  57 100.130 -10.534  -0.879
  475    HZ2  LYS  57           HZ2      LYS  57 100.478 -10.454   0.770
  476    HZ3  LYS  57           HZ3      LYS  57  99.952 -11.891   0.109
  477    H    MET  58           HN       MET  58 107.298 -11.150  -0.175
  478    HA   MET  58           HA       MET  58 108.210  -8.849  -1.677
  479    HB2  MET  58           HB2      MET  58 107.513  -8.646   0.696
  480    HB3  MET  58           HB1      MET  58 108.808  -9.696   1.188
  481    HG2  MET  58           HG2      MET  58 109.267  -7.127  -0.196
  482    HG3  MET  58           HG1      MET  58 109.081  -7.230   1.562
  483    HE1  MET  58           HE1      MET  58 111.208  -6.447   2.442
  484    HE2  MET  58           HE2      MET  58 111.445  -5.774   0.836
  485    HE3  MET  58           HE3      MET  58 112.769  -6.631   1.645
  486    H    GLU  59           HN       GLU  59 110.365  -8.400  -2.311
  487    HA   GLU  59           HA       GLU  59 112.203 -10.657  -2.251
  488    HB2  GLU  59           HB2      GLU  59 111.097  -9.477  -4.797
  489    HB3  GLU  59           HB1      GLU  59 112.488 -10.539  -4.711
  490    HG2  GLU  59           HG2      GLU  59 111.071 -12.321  -3.848
  491    HG3  GLU  59           HG1      GLU  59 109.684 -11.224  -3.911
  492    H    THR  60           HN       THR  60 114.230 -10.120  -3.323
  493    HA   THR  60           HA       THR  60 115.454  -7.735  -2.643
  494    HB   THR  60           HB       THR  60 116.149  -9.673  -4.842
  495    HG1  THR  60           HG1      THR  60 116.549 -11.143  -3.338
  496   HG21  THR  60          HG21      THR  60 117.738  -8.118  -2.882
  497   HG22  THR  60          HG22      THR  60 117.484  -7.646  -4.572
  498   HG23  THR  60          HG23      THR  60 118.401  -9.115  -4.174
  499    H    GLY  61           HN       GLY  61 115.636  -5.851  -3.796
  500    HA2  GLY  61           HA2      GLY  61 115.684  -4.665  -5.850
  501    HA3  GLY  61           HA1      GLY  61 114.527  -5.820  -6.498
  502    H    ASP  62           HN       ASP  62 113.126  -5.656  -3.742
  503    HA   ASP  62           HA       ASP  62 111.265  -3.636  -4.415
  504    HB2  ASP  62           HB2      ASP  62 111.717  -5.237  -1.893
  505    HB3  ASP  62           HB1      ASP  62 110.660  -3.832  -1.900
  506    H    VAL  63           HN       VAL  63 111.276  -1.564  -3.930
  507    HA   VAL  63           HA       VAL  63 113.433  -0.720  -2.221
  508    HB   VAL  63           HB       VAL  63 113.924   0.527  -4.098
  509   HG11  VAL  63          HG11      VAL  63 112.298   1.509  -5.630
  510   HG12  VAL  63          HG12      VAL  63 110.998   0.755  -4.672
  511   HG13  VAL  63          HG13      VAL  63 112.245  -0.240  -5.459
  512   HG21  VAL  63          HG21      VAL  63 113.626   2.172  -2.322
  513   HG22  VAL  63          HG22      VAL  63 111.927   2.354  -2.759
  514   HG23  VAL  63          HG23      VAL  63 113.183   2.863  -3.886
  515    H    ILE  64           HN       ILE  64 113.217   0.034  -0.404
  516    HA   ILE  64           HA       ILE  64 110.700  -0.099   0.798
  517    HB   ILE  64           HB       ILE  64 113.381   0.640   1.960
  518   HG12  ILE  64          HG12      ILE  64 113.232  -1.678   1.241
  519   HG13  ILE  64          HG11      ILE  64 113.297  -1.587   2.995
  520   HG21  ILE  64          HG21      ILE  64 111.649   1.692   3.313
  521   HG22  ILE  64          HG22      ILE  64 112.380   0.351   4.197
  522   HG23  ILE  64          HG23      ILE  64 110.795   0.153   3.448
  523   HD11  ILE  64          HD11      ILE  64 111.701  -3.267   2.319
  524   HD12  ILE  64          HD12      ILE  64 110.859  -2.108   1.304
  525   HD13  ILE  64          HD13      ILE  64 110.846  -1.914   3.058
  526    H    VAL  65           HN       VAL  65 109.359   1.429   0.903
  527    HA   VAL  65           HA       VAL  65 110.017   4.212   0.371
  528    HB   VAL  65           HB       VAL  65 107.407   2.664   0.251
  529   HG11  VAL  65          HG11      VAL  65 106.998   5.014   0.688
  530   HG12  VAL  65          HG12      VAL  65 106.481   4.559  -0.937
  531   HG13  VAL  65          HG13      VAL  65 107.976   5.454  -0.714
  532   HG21  VAL  65          HG21      VAL  65 107.616   2.840  -2.181
  533   HG22  VAL  65          HG22      VAL  65 108.947   1.928  -1.464
  534   HG23  VAL  65          HG23      VAL  65 109.196   3.594  -1.977
  535    H    SER  66           HN       SER  66 107.792   2.241   2.397
  536    HA   SER  66           HA       SER  66 108.176   4.126   4.583
  537    HB2  SER  66           HB2      SER  66 105.353   3.538   3.618
  538    HB3  SER  66           HB1      SER  66 105.847   4.624   4.898
  539    HG   SER  66           HG       SER  66 105.642   5.004   2.253
  540    H    VAL  67           HN       VAL  67 106.841   3.389   6.518
  541    HA   VAL  67           HA       VAL  67 106.188   0.571   6.681
  542    HB   VAL  67           HB       VAL  67 108.643   0.849   7.308
  543   HG11  VAL  67          HG11      VAL  67 109.228   1.882   9.382
  544   HG12  VAL  67          HG12      VAL  67 107.575   2.497   9.556
  545   HG13  VAL  67          HG13      VAL  67 108.601   3.052   8.216
  546   HG21  VAL  67          HG21      VAL  67 106.799   0.063   9.527
  547   HG22  VAL  67          HG22      VAL  67 108.508  -0.361   9.409
  548   HG23  VAL  67          HG23      VAL  67 107.361  -0.966   8.211
  549    H    ASN  68           HN       ASN  68 104.733   0.287   8.452
  550    HA   ASN  68           HA       ASN  68 102.722   1.946   8.803
  551    HB2  ASN  68           HB2      ASN  68 102.180   1.027  11.019
  552    HB3  ASN  68           HB1      ASN  68 102.648  -0.223   9.887
  553   HD21  ASN  68          HD21      ASN  68 102.600  -0.077  12.801
  554   HD22  ASN  68          HD22      ASN  68 104.166  -0.537  13.340
  555    H    ASP  69           HN       ASP  69 102.516   3.936   9.107
  556    HA   ASP  69           HA       ASP  69 102.422   5.967   9.970
  557    HB2  ASP  69           HB2      ASP  69 103.227   4.541  12.491
  558    HB3  ASP  69           HB1      ASP  69 102.942   6.280  12.389
  559    H    THR  70           HN       THR  70 105.134   4.812   8.997
  560    HA   THR  70           HA       THR  70 106.498   7.265   9.668
  561    HB   THR  70           HB       THR  70 107.762   4.551   9.966
  562    HG1  THR  70           HG1      THR  70 106.358   6.028  11.599
  563   HG21  THR  70          HG21      THR  70 109.312   6.182   9.058
  564   HG22  THR  70          HG22      THR  70 109.742   5.801  10.732
  565   HG23  THR  70          HG23      THR  70 108.908   7.316  10.348
  566    H    CYS  71           HN       CYS  71 107.235   8.194   8.064
  567    HA   CYS  71           HA       CYS  71 107.375   7.052   5.388
  568    HB2  CYS  71           HB2      CYS  71 106.541   9.365   5.989
  569    HB3  CYS  71           HB1      CYS  71 108.185   9.752   6.458
  570    HG   CYS  71           HG       CYS  71 106.891   9.347   3.382
  571    H    VAL  72           HN       VAL  72 109.028   5.759   4.990
  572    HA   VAL  72           HA       VAL  72 111.543   6.187   6.317
  573    HB   VAL  72           HB       VAL  72 110.722   4.028   4.316
  574   HG11  VAL  72          HG11      VAL  72 112.630   2.761   5.168
  575   HG12  VAL  72          HG12      VAL  72 113.045   4.101   6.240
  576   HG13  VAL  72          HG13      VAL  72 113.139   4.310   4.490
  577   HG21  VAL  72          HG21      VAL  72 110.799   3.922   7.318
  578   HG22  VAL  72          HG22      VAL  72 110.440   2.570   6.243
  579   HG23  VAL  72          HG23      VAL  72 109.349   3.955   6.319
  580    H    LEU  73           HN       LEU  73 109.986   7.414   3.716
  581    HA   LEU  73           HA       LEU  73 112.145   7.548   1.888
  582    HB2  LEU  73           HB2      LEU  73 109.873   9.499   2.180
  583    HB3  LEU  73           HB1      LEU  73 111.090   9.561   0.929
  584    HG   LEU  73           HG       LEU  73 109.347   8.681  -0.132
  585   HD11  LEU  73          HD11      LEU  73 111.237   7.302  -0.539
  586   HD12  LEU  73          HD12      LEU  73 109.756   6.361  -0.645
  587   HD13  LEU  73          HD13      LEU  73 110.781   6.229   0.787
  588   HD21  LEU  73          HD21      LEU  73 108.682   6.923   2.206
  589   HD22  LEU  73          HD22      LEU  73 107.764   7.042   0.699
  590   HD23  LEU  73          HD23      LEU  73 107.886   8.431   1.780
  591    H    GLY  74           HN       GLY  74 113.816   8.548   1.977
  592    HA2  GLY  74           HA2      GLY  74 115.358  10.202   2.436
  593    HA3  GLY  74           HA1      GLY  74 114.068  11.081   3.277
  594    H    HIS  75           HN       HIS  75 114.354   7.856   4.427
  595    HA   HIS  75           HA       HIS  75 115.290   8.861   6.864
  596    HB2  HIS  75           HB2      HIS  75 113.917   6.553   5.864
  597    HB3  HIS  75           HB1      HIS  75 115.331   6.099   6.814
  598    HD1  HIS  75           HD1      HIS  75 112.033   8.029   7.166
  599    HD2  HIS  75           HD2      HIS  75 115.052   6.299   9.415
  600    HE1  HIS  75           HE1      HIS  75 111.237   8.091   9.511
  601    H    THR  76           HN       THR  76 117.203   9.268   7.065
  602    HA   THR  76           HA       THR  76 119.448   8.410   5.600
  603    HB   THR  76           HB       THR  76 119.246   9.509   8.401
  604    HG1  THR  76           HG1      THR  76 119.692  10.786   5.917
  605   HG21  THR  76          HG21      THR  76 121.461   8.519   8.060
  606   HG22  THR  76          HG22      THR  76 121.564  10.269   8.158
  607   HG23  THR  76          HG23      THR  76 121.673   9.468   6.583
  608    H    HIS  77           HN       HIS  77 121.039   6.754   6.125
  609    HA   HIS  77           HA       HIS  77 120.235   4.391   7.055
  610    HB2  HIS  77           HB2      HIS  77 122.297   4.561   5.913
  611    HB3  HIS  77           HB1      HIS  77 122.964   5.623   7.147
  612    HD1  HIS  77           HD1      HIS  77 121.951   1.918   6.699
  613    HD2  HIS  77           HD2      HIS  77 124.331   4.296   9.149
  614    HE1  HIS  77           HE1      HIS  77 123.269   0.352   8.130
  615    H    ALA  78           HN       ALA  78 121.656   6.905   9.020
  616    HA   ALA  78           HA       ALA  78 121.883   5.481  11.421
  617    HB1  ALA  78           HB1      ALA  78 123.064   7.540  10.895
  618    HB2  ALA  78           HB2      ALA  78 122.189   7.678  12.426
  619    HB3  ALA  78           HB3      ALA  78 121.550   8.436  10.963
  620    H    GLN  79           HN       GLN  79 119.230   7.256   9.948
  621    HA   GLN  79           HA       GLN  79 117.709   7.340  12.360
  622    HB2  GLN  79           HB2      GLN  79 116.918   7.974   9.528
  623    HB3  GLN  79           HB1      GLN  79 115.900   8.254  10.918
  624    HG2  GLN  79           HG2      GLN  79 118.467   9.641  10.156
  625    HG3  GLN  79           HG1      GLN  79 116.859  10.349  10.298
  626   HE21  GLN  79          HE21      GLN  79 119.724   9.405  11.878
  627   HE22  GLN  79          HE22      GLN  79 119.348  10.034  13.426
  628    H    VAL  80           HN       VAL  80 117.560   5.721   9.242
  629    HA   VAL  80           HA       VAL  80 115.282   4.176   9.815
  630    HB   VAL  80           HB       VAL  80 116.026   4.602   7.466
  631   HG11  VAL  80          HG11      VAL  80 117.833   3.451   6.455
  632   HG12  VAL  80          HG12      VAL  80 118.178   2.587   7.954
  633   HG13  VAL  80          HG13      VAL  80 118.416   4.332   7.869
  634   HG21  VAL  80          HG21      VAL  80 115.506   2.391   6.604
  635   HG22  VAL  80          HG22      VAL  80 114.472   2.786   7.974
  636   HG23  VAL  80          HG23      VAL  80 115.830   1.683   8.185
  637    H    VAL  81           HN       VAL  81 118.732   3.472  10.230
  638    HA   VAL  81           HA       VAL  81 118.329   0.808  11.056
  639    HB   VAL  81           HB       VAL  81 120.593   1.805  10.377
  640   HG11  VAL  81          HG11      VAL  81 120.677   2.767  13.222
  641   HG12  VAL  81          HG12      VAL  81 120.630   3.770  11.774
  642   HG13  VAL  81          HG13      VAL  81 122.037   2.754  12.096
  643   HG21  VAL  81          HG21      VAL  81 121.914   0.352  11.836
  644   HG22  VAL  81          HG22      VAL  81 120.438  -0.436  11.274
  645   HG23  VAL  81          HG23      VAL  81 120.529   0.206  12.915
  646    H    LYS  82           HN       LYS  82 118.300   3.829  12.772
  647    HA   LYS  82           HA       LYS  82 118.172   2.879  15.348
  648    HB2  LYS  82           HB2      LYS  82 118.547   5.176  14.913
  649    HB3  LYS  82           HB1      LYS  82 117.074   5.308  13.983
  650    HG2  LYS  82           HG2      LYS  82 116.863   4.662  16.893
  651    HG3  LYS  82           HG1      LYS  82 117.280   6.312  16.439
  652    HD2  LYS  82           HD2      LYS  82 114.856   4.826  15.406
  653    HD3  LYS  82           HD1      LYS  82 114.822   5.902  16.798
  654    HE2  LYS  82           HE2      LYS  82 115.656   6.732  14.000
  655    HE3  LYS  82           HE1      LYS  82 114.055   6.972  14.679
  656    HZ1  LYS  82           HZ1      LYS  82 116.562   8.146  15.788
  657    HZ2  LYS  82           HZ2      LYS  82 114.990   8.412  16.356
  658    HZ3  LYS  82           HZ3      LYS  82 115.431   8.954  14.841
  659    H    ILE  83           HN       ILE  83 115.496   3.283  13.016
  660    HA   ILE  83           HA       ILE  83 113.516   2.589  15.000
  661    HB   ILE  83           HB       ILE  83 113.235   2.687  11.984
  662   HG12  ILE  83          HG12      ILE  83 112.658   4.771  14.102
  663   HG13  ILE  83          HG11      ILE  83 113.861   4.856  12.831
  664   HG21  ILE  83          HG21      ILE  83 110.808   2.829  12.406
  665   HG22  ILE  83          HG22      ILE  83 111.101   2.616  14.130
  666   HG23  ILE  83          HG23      ILE  83 111.492   1.317  13.003
  667   HD11  ILE  83          HD11      ILE  83 112.096   4.927  11.155
  668   HD12  ILE  83          HD12      ILE  83 111.950   6.242  12.322
  669   HD13  ILE  83          HD13      ILE  83 110.887   4.838  12.435
  670    H    PHE  84           HN       PHE  84 114.965   1.097  12.246
  671    HA   PHE  84           HA       PHE  84 113.521  -1.267  12.280
  672    HB2  PHE  84           HB2      PHE  84 115.881  -0.197  10.895
  673    HB3  PHE  84           HB1      PHE  84 115.608  -1.919  10.787
  674    HD1  PHE  84           HD2      PHE  84 113.403   1.118  10.699
  675    HD2  PHE  84           HD1      PHE  84 114.589  -2.469   8.748
  676    HE1  PHE  84           HE2      PHE  84 111.727   1.517   8.939
  677    HE2  PHE  84           HE1      PHE  84 112.931  -2.072   7.000
  678    HZ   PHE  84           HZ       PHE  84 111.490  -0.100   7.091
  679    H    GLN  85           HN       GLN  85 116.658  -0.497  13.762
  680    HA   GLN  85           HA       GLN  85 116.880  -3.256  14.532
  681    HB2  GLN  85           HB2      GLN  85 118.697  -0.922  15.110
  682    HB3  GLN  85           HB1      GLN  85 119.051  -2.598  15.554
  683    HG2  GLN  85           HG2      GLN  85 118.662  -1.518  12.775
  684    HG3  GLN  85           HG1      GLN  85 120.206  -1.861  13.538
  685   HE21  GLN  85          HE21      GLN  85 120.712  -3.227  11.872
  686   HE22  GLN  85          HE22      GLN  85 120.035  -4.790  11.680
  687    H    SER  86           HN       SER  86 115.595  -0.372  15.933
  688    HA   SER  86           HA       SER  86 115.681  -1.379  18.605
  689    HB2  SER  86           HB2      SER  86 113.952   0.779  17.384
  690    HB3  SER  86           HB1      SER  86 114.048   0.423  19.111
  691    HG   SER  86           HG       SER  86 115.773   1.727  17.451
  692    H    ILE  87           HN       ILE  87 113.756  -1.965  15.872
  693    HA   ILE  87           HA       ILE  87 111.389  -2.762  16.667
  694    HB   ILE  87           HB       ILE  87 113.259  -3.703  14.607
  695   HG12  ILE  87          HG12      ILE  87 110.550  -2.471  14.671
  696   HG13  ILE  87          HG11      ILE  87 112.032  -1.892  13.912
  697   HG21  ILE  87          HG21      ILE  87 111.742  -5.298  13.664
  698   HG22  ILE  87          HG22      ILE  87 110.782  -5.255  15.132
  699   HG23  ILE  87          HG23      ILE  87 112.452  -5.878  15.187
  700   HD11  ILE  87          HD11      ILE  87 110.263  -4.141  13.021
  701   HD12  ILE  87          HD12      ILE  87 111.790  -3.811  12.250
  702   HD13  ILE  87          HD13      ILE  87 110.481  -2.610  12.183
  703    HA   PRO  88           HA       PRO  88 112.071  -6.383  19.385
  704    HB2  PRO  88           HB2      PRO  88 109.537  -6.524  20.230
  705    HB3  PRO  88           HB1      PRO  88 110.577  -5.181  20.706
  706    HG2  PRO  88           HG2      PRO  88 108.259  -5.176  18.902
  707    HG3  PRO  88           HG1      PRO  88 109.054  -3.814  19.701
  708    HD2  PRO  88           HD2      PRO  88 109.413  -4.805  16.964
  709    HD3  PRO  88           HD1      PRO  88 109.976  -3.303  17.657
  710    H    ILE  89           HN       ILE  89 111.577  -8.532  19.492
  711    HA   ILE  89           HA       ILE  89 110.912  -9.835  17.066
  712    HB   ILE  89           HB       ILE  89 110.935 -11.143  19.793
  713   HG12  ILE  89          HG12      ILE  89 113.351 -10.380  18.133
  714   HG13  ILE  89          HG11      ILE  89 112.904  -9.727  19.696
  715   HG21  ILE  89          HG21      ILE  89 110.267 -12.538  17.939
  716   HG22  ILE  89          HG22      ILE  89 111.843 -13.056  18.557
  717   HG23  ILE  89          HG23      ILE  89 111.739 -12.111  17.066
  718   HD11  ILE  89          HD11      ILE  89 114.681 -11.235  19.897
  719   HD12  ILE  89          HD12      ILE  89 113.783 -12.493  19.046
  720   HD13  ILE  89          HD13      ILE  89 113.245 -11.942  20.657
  721    H    GLY  90           HN       GLY  90 108.968 -10.943  16.508
  722    HA2  GLY  90           HA2      GLY  90 106.896 -11.933  16.896
  723    HA3  GLY  90           HA1      GLY  90 106.924 -11.296  18.536
  724    H    ALA  91           HN       ALA  91 107.698  -9.103  16.118
  725    HA   ALA  91           HA       ALA  91 105.103  -7.818  16.721
  726    HB1  ALA  91           HB1      ALA  91 107.691  -6.399  16.066
  727    HB2  ALA  91           HB2      ALA  91 107.026  -6.627  17.669
  728    HB3  ALA  91           HB3      ALA  91 106.168  -5.626  16.501
  729    H    SER  92           HN       SER  92 105.192  -5.721  14.791
  730    HA   SER  92           HA       SER  92 105.015  -7.081  12.221
  731    HB2  SER  92           HB2      SER  92 102.576  -6.644  12.014
  732    HB3  SER  92           HB1      SER  92 103.000  -7.876  13.208
  733    HG   SER  92           HG       SER  92 102.462  -5.153  13.808
  734    H    VAL  93           HN       VAL  93 105.222  -5.694  10.530
  735    HA   VAL  93           HA       VAL  93 104.353  -2.970  11.012
  736    HB   VAL  93           HB       VAL  93 106.067  -2.004   9.672
  737   HG11  VAL  93          HG11      VAL  93 107.987  -2.107  11.073
  738   HG12  VAL  93          HG12      VAL  93 107.256  -3.466  11.970
  739   HG13  VAL  93          HG13      VAL  93 106.456  -1.877  11.910
  740   HG21  VAL  93          HG21      VAL  93 107.261  -4.758   9.385
  741   HG22  VAL  93          HG22      VAL  93 108.168  -3.284   9.085
  742   HG23  VAL  93          HG23      VAL  93 106.728  -3.634   8.138
  743    H    ASP  94           HN       ASP  94 103.704  -1.899   9.306
  744    HA   ASP  94           HA       ASP  94 102.797  -3.487   7.047
  745    HB2  ASP  94           HB2      ASP  94 102.314  -0.661   7.979
  746    HB3  ASP  94           HB1      ASP  94 101.611  -1.321   6.533
  747    H    LEU  95           HN       LEU  95 104.435  -3.605   5.535
  748    HA   LEU  95           HA       LEU  95 106.235  -1.346   5.429
  749    HB2  LEU  95           HB2      LEU  95 106.854  -3.837   5.809
  750    HB3  LEU  95           HB1      LEU  95 106.618  -3.965   4.080
  751    HG   LEU  95           HG       LEU  95 108.361  -2.230   3.752
  752   HD11  LEU  95          HD11      LEU  95 109.819  -1.719   5.715
  753   HD12  LEU  95          HD12      LEU  95 108.660  -2.566   6.743
  754   HD13  LEU  95          HD13      LEU  95 108.193  -1.081   5.940
  755   HD21  LEU  95          HD21      LEU  95 108.820  -4.604   3.638
  756   HD22  LEU  95          HD22      LEU  95 109.093  -4.628   5.379
  757   HD23  LEU  95          HD23      LEU  95 110.207  -3.736   4.322
  758    H    GLU  96           HN       GLU  96 106.121  -0.039   3.810
  759    HA   GLU  96           HA       GLU  96 104.468  -0.701   1.488
  760    HB2  GLU  96           HB2      GLU  96 103.842   1.262   2.881
  761    HB3  GLU  96           HB1      GLU  96 105.446   1.917   2.583
  762    HG2  GLU  96           HG2      GLU  96 104.943   2.187   0.247
  763    HG3  GLU  96           HG1      GLU  96 103.369   1.415   0.475
  764    H    LEU  97           HN       LEU  97 105.625  -1.263  -0.245
  765    HA   LEU  97           HA       LEU  97 108.130   0.044  -0.717
  766    HB2  LEU  97           HB2      LEU  97 109.438  -1.962  -0.947
  767    HB3  LEU  97           HB1      LEU  97 108.753  -1.881   0.648
  768    HG   LEU  97           HG       LEU  97 108.134  -3.852  -1.569
  769   HD11  LEU  97          HD11      LEU  97 109.997  -4.370  -0.189
  770   HD12  LEU  97          HD12      LEU  97 108.653  -5.420   0.291
  771   HD13  LEU  97          HD13      LEU  97 109.077  -4.018   1.261
  772   HD21  LEU  97          HD21      LEU  97 106.397  -4.827  -0.191
  773   HD22  LEU  97          HD22      LEU  97 105.961  -3.138  -0.523
  774   HD23  LEU  97          HD23      LEU  97 106.625  -3.590   1.043
  775    H    CYS  98           HN       CYS  98 108.982  -0.456  -2.865
  776    HA   CYS  98           HA       CYS  98 106.716  -0.936  -4.654
  777    HB2  CYS  98           HB2      CYS  98 107.485   1.495  -4.274
  778    HB3  CYS  98           HB1      CYS  98 108.910   1.047  -5.199
  779    HG   CYS  98           HG       CYS  98 106.283   2.298  -6.347
  780    H    ARG  99           HN       ARG  99 107.177  -2.037  -6.473
  781    HA   ARG  99           HA       ARG  99 109.755  -3.479  -6.504
  782    HB2  ARG  99           HB2      ARG  99 107.663  -4.799  -6.050
  783    HB3  ARG  99           HB1      ARG  99 107.097  -4.278  -7.635
  784    HG2  ARG  99           HG2      ARG  99 107.921  -6.455  -7.877
  785    HG3  ARG  99           HG1      ARG  99 109.088  -5.364  -8.630
  786    HD2  ARG  99           HD2      ARG  99 110.355  -6.947  -7.309
  787    HD3  ARG  99           HD1      ARG  99 110.307  -5.395  -6.432
  788    HE   ARG  99           HE       ARG  99 109.080  -6.189  -4.879
  789   HH11  ARG  99          HH11      ARG  99 109.075  -8.614  -7.439
  790   HH12  ARG  99          HH12      ARG  99 108.732  -9.915  -6.403
  791   HH21  ARG  99          HH21      ARG  99 108.620  -7.802  -3.534
  792   HH22  ARG  99          HH22      ARG  99 108.297  -9.422  -4.020
  793    H    GLY 100           HN       GLY 100 110.824  -3.569  -8.512
  794    HA2  GLY 100           HA2      GLY 100 110.080  -3.420 -11.007
  795    HA3  GLY 100           HA1      GLY 100 109.770  -1.751 -10.544
  796    H    TYR 101           HN       TYR 101 112.118  -2.156  -8.639
  797    HA   TYR 101           HA       TYR 101 114.100  -1.296 -10.582
  798    HB2  TYR 101           HB2      TYR 101 113.857  -0.973  -7.612
  799    HB3  TYR 101           HB1      TYR 101 115.345  -0.599  -8.464
  800    HD1  TYR 101           HD2      TYR 101 111.757   0.283  -8.204
  801    HD2  TYR 101           HD1      TYR 101 115.603   1.427  -9.606
  802    HE1  TYR 101           HE2      TYR 101 110.898   2.519  -8.722
  803    HE2  TYR 101           HE1      TYR 101 114.754   3.665 -10.128
  804    HH   TYR 101           HH       TYR 101 112.760   4.814 -10.526
  805    HA   PRO 102           HA       PRO 102 116.314  -5.119  -9.602
  806    HB2  PRO 102           HB2      PRO 102 117.866  -4.544 -11.987
  807    HB3  PRO 102           HB1      PRO 102 116.766  -5.897 -11.723
  808    HG2  PRO 102           HG2      PRO 102 116.295  -3.879 -13.521
  809    HG3  PRO 102           HG1      PRO 102 115.018  -4.837 -12.754
  810    HD2  PRO 102           HD2      PRO 102 115.999  -2.094 -12.075
  811    HD3  PRO 102           HD1      PRO 102 114.341  -2.737 -12.073
  812    H    LEU 103           HN       LEU 103 118.083  -4.921  -8.337
  813    HA   LEU 103           HA       LEU 103 119.187  -2.640  -7.303
  814    HB2  LEU 103           HB2      LEU 103 119.619  -5.374  -7.159
  815    HB3  LEU 103           HB1      LEU 103 121.191  -4.745  -7.634
  816    HG   LEU 103           HG       LEU 103 121.076  -5.092  -5.248
  817   HD11  LEU 103          HD11      LEU 103 121.690  -2.941  -4.392
  818   HD12  LEU 103          HD12      LEU 103 120.978  -2.135  -5.791
  819   HD13  LEU 103          HD13      LEU 103 122.388  -3.179  -5.988
  820   HD21  LEU 103          HD21      LEU 103 118.692  -4.993  -4.928
  821   HD22  LEU 103          HD22      LEU 103 118.682  -3.274  -5.303
  822   HD23  LEU 103          HD23      LEU 103 119.482  -3.850  -3.848
  823    HA   PRO 104           HA       PRO 104 121.183  -1.408 -11.208
  824    HB2  PRO 104           HB2      PRO 104 120.954   1.236 -10.923
  825    HB3  PRO 104           HB1      PRO 104 119.559   0.213 -11.276
  826    HG2  PRO 104           HG2      PRO 104 120.367   1.480  -8.708
  827    HG3  PRO 104           HG1      PRO 104 118.748   1.178  -9.356
  828    HD2  PRO 104           HD2      PRO 104 120.087  -0.395  -7.450
  829    HD3  PRO 104           HD1      PRO 104 118.638  -0.859  -8.360
  830    H    PHE 105           HN       PHE 105 122.640  -1.830  -8.593
  831    HA   PHE 105           HA       PHE 105 125.115  -0.852  -9.483
  832    HB2  PHE 105           HB2      PHE 105 125.699   0.429  -7.446
  833    HB3  PHE 105           HB1      PHE 105 124.396   1.206  -8.324
  834    HD1  PHE 105           HD2      PHE 105 122.097   1.132  -7.397
  835    HD2  PHE 105           HD1      PHE 105 125.439  -0.349  -5.223
  836    HE1  PHE 105           HE2      PHE 105 120.787   1.230  -5.324
  837    HE2  PHE 105           HE1      PHE 105 124.134  -0.249  -3.143
  838    HZ   PHE 105           HZ       PHE 105 121.804   0.544  -3.195
  839    H    ASP 106           HN       ASP 106 126.785  -1.848  -8.194
  840    HA   ASP 106           HA       ASP 106 125.709  -4.201  -6.872
  841    HB2  ASP 106           HB2      ASP 106 128.471  -3.585  -7.685
  842    HB3  ASP 106           HB1      ASP 106 127.928  -5.136  -7.103
  843    HA   PRO 107           HA       PRO 107 127.360  -2.053  -3.334
  844    HB2  PRO 107           HB2      PRO 107 125.968  -3.996  -1.679
  845    HB3  PRO 107           HB1      PRO 107 125.407  -2.375  -2.114
  846    HG2  PRO 107           HG2      PRO 107 124.121  -4.628  -3.030
  847    HG3  PRO 107           HG1      PRO 107 124.297  -3.131  -4.004
  848    HD2  PRO 107           HD2      PRO 107 126.168  -5.430  -3.973
  849    HD3  PRO 107           HD1      PRO 107 125.253  -4.959  -5.343
  850    H    ASP 108           HN       ASP 108 127.986  -4.988  -4.607
  851    HA   ASP 108           HA       ASP 108 129.609  -5.989  -2.642
  852    HB2  ASP 108           HB2      ASP 108 129.090  -6.811  -5.488
  853    HB3  ASP 108           HB1      ASP 108 130.298  -7.640  -4.520
  854    H    ASP 109           HN       ASP 109 129.611  -3.839  -5.160
  855    HA   ASP 109           HA       ASP 109 132.402  -3.727  -5.904
  856    HB2  ASP 109           HB2      ASP 109 130.540  -3.765  -7.600
  857    HB3  ASP 109           HB1      ASP 109 129.884  -2.310  -6.875
  858    HA   PRO 110           HA       PRO 110 133.513  -0.274  -3.207
  859    HB2  PRO 110           HB2      PRO 110 133.664   1.257  -5.755
  860    HB3  PRO 110           HB1      PRO 110 134.737   1.331  -4.353
  861    HG2  PRO 110           HG2      PRO 110 135.478  -0.134  -6.396
  862    HG3  PRO 110           HG1      PRO 110 135.569  -0.862  -4.780
  863    HD2  PRO 110           HD2      PRO 110 133.506  -1.275  -6.918
  864    HD3  PRO 110           HD1      PRO 110 134.212  -2.484  -5.818
  865    H    ASN 111           HN       ASN 111 133.291   2.328  -3.350
  866    HA   ASN 111           HA       ASN 111 132.147   4.054  -2.810
  867    HB2  ASN 111           HB2      ASN 111 129.752   2.957  -4.289
  868    HB3  ASN 111           HB1      ASN 111 130.049   4.629  -3.812
  869   HD21  ASN 111          HD21      ASN 111 132.907   4.535  -4.652
  870   HD22  ASN 111          HD22      ASN 111 132.870   4.471  -6.381
  871    H    THR 112           HN       THR 112 132.457   3.024  -0.877
  872    HA   THR 112           HA       THR 112 130.386   1.387   0.255
  873    HB   THR 112           HB       THR 112 132.810   0.809   0.371
  874    HG1  THR 112           HG1      THR 112 132.473  -0.164   2.147
  875   HG21  THR 112          HG21      THR 112 132.953   3.133   2.308
  876   HG22  THR 112          HG22      THR 112 133.723   3.060   0.724
  877   HG23  THR 112          HG23      THR 112 134.236   1.960   2.003
  878    H    SER 113           HN       SER 113 130.290   1.838   2.738
  879    HA   SER 113           HA       SER 113 128.791   4.317   3.015
  880    HB2  SER 113           HB2      SER 113 127.850   2.084   3.716
  881    HB3  SER 113           HB1      SER 113 129.146   1.973   4.878
  882    HG   SER 113           HG       SER 113 126.853   3.519   4.913
  883    H    LEU 114           HN       LEU 114 130.351   5.912   3.328
  884    HA   LEU 114           HA       LEU 114 132.005   5.489   5.567
  885    HB2  LEU 114           HB2      LEU 114 132.896   7.750   5.060
  886    HB3  LEU 114           HB1      LEU 114 133.080   6.604   3.767
  887    HG   LEU 114           HG       LEU 114 132.674   8.710   2.838
  888   HD11  LEU 114          HD11      LEU 114 130.054   7.398   2.406
  889   HD12  LEU 114          HD12      LEU 114 131.580   6.903   1.673
  890   HD13  LEU 114          HD13      LEU 114 130.935   8.510   1.368
  891   HD21  LEU 114          HD21      LEU 114 130.242   8.920   4.524
  892   HD22  LEU 114          HD22      LEU 114 130.675  10.088   3.265
  893   HD23  LEU 114          HD23      LEU 114 131.707   9.879   4.699
  894    H    VAL 115           HN       VAL 115 131.511   6.045   7.483
  895    HA   VAL 115           HA       VAL 115 128.917   7.274   7.932
  896    HB   VAL 115           HB       VAL 115 130.792   5.997   9.953
  897   HG11  VAL 115          HG11      VAL 115 129.248   7.589  10.952
  898   HG12  VAL 115          HG12      VAL 115 128.830   5.939  11.412
  899   HG13  VAL 115          HG13      VAL 115 127.889   6.775  10.175
  900   HG21  VAL 115          HG21      VAL 115 129.324   4.046   9.866
  901   HG22  VAL 115          HG22      VAL 115 130.013   4.369   8.266
  902   HG23  VAL 115          HG23      VAL 115 128.356   4.825   8.620
  903    H    THR 116           HN       THR 116 129.009   9.359   7.905
  904    HA   THR 116           HA       THR 116 131.387  10.714   8.534
  905    HB   THR 116           HB       THR 116 129.684  11.555   6.862
  906    HG1  THR 116           HG1      THR 116 130.989  13.135   7.324
  907   HG21  THR 116          HG21      THR 116 127.766  12.842   7.727
  908   HG22  THR 116          HG22      THR 116 128.224  12.339   9.362
  909   HG23  THR 116          HG23      THR 116 127.669  11.132   8.199
  910    H    SER 117           HN       SER 117 131.810  11.941  10.326
  911    HA   SER 117           HA       SER 117 130.176  11.204  12.644
  912    HB2  SER 117           HB2      SER 117 133.085  12.037  12.641
  913    HB3  SER 117           HB1      SER 117 132.191  11.228  13.935
  914    HG   SER 117           HG       SER 117 131.990   9.841  11.670
  915    H    VAL 118           HN       VAL 118 128.826  12.848  12.510
  916    HA   VAL 118           HA       VAL 118 129.968  15.512  12.396
  917    HB   VAL 118           HB       VAL 118 128.602  15.111  10.484
  918   HG11  VAL 118          HG11      VAL 118 126.356  14.290  12.308
  919   HG12  VAL 118          HG12      VAL 118 127.365  13.219  11.354
  920   HG13  VAL 118          HG13      VAL 118 126.293  14.373  10.537
  921   HG21  VAL 118          HG21      VAL 118 126.848  16.841  10.701
  922   HG22  VAL 118          HG22      VAL 118 128.371  17.348  11.437
  923   HG23  VAL 118          HG23      VAL 118 127.044  16.793  12.453
  924    H    ALA 119           HN       ALA 119 130.273  16.080  14.388
  925    HA   ALA 119           HA       ALA 119 127.954  16.014  16.173
  926    HB1  ALA 119           HB1      ALA 119 130.894  16.035  16.916
  927    HB2  ALA 119           HB2      ALA 119 129.834  14.633  16.994
  928    HB3  ALA 119           HB3      ALA 119 129.542  16.012  18.051
  929    H    ILE 120           HN       ILE 120 127.402  17.822  14.896
  930    HA   ILE 120           HA       ILE 120 128.648  20.320  15.839
  931    HB   ILE 120           HB       ILE 120 127.356  19.744  13.149
  932   HG12  ILE 120          HG12      ILE 120 129.552  18.686  13.283
  933   HG13  ILE 120          HG11      ILE 120 129.570  20.015  12.129
  934   HG21  ILE 120          HG21      ILE 120 127.014  22.078  13.793
  935   HG22  ILE 120          HG22      ILE 120 128.146  21.983  12.445
  936   HG23  ILE 120          HG23      ILE 120 128.744  22.268  14.079
  937   HD11  ILE 120          HD11      ILE 120 130.670  20.061  14.928
  938   HD12  ILE 120          HD12      ILE 120 130.657  21.425  13.810
  939   HD13  ILE 120          HD13      ILE 120 131.598  19.980  13.428
  940    H    LEU 121           HN       LEU 121 126.111  18.258  16.017
  941    HA   LEU 121           HA       LEU 121 124.219  20.345  16.578
  942    HB2  LEU 121           HB2      LEU 121 122.428  19.184  15.428
  943    HB3  LEU 121           HB1      LEU 121 123.715  19.569  14.325
  944    HG   LEU 121           HG       LEU 121 122.856  17.590  13.655
  945   HD11  LEU 121          HD11      LEU 121 125.193  17.457  13.484
  946   HD12  LEU 121          HD12      LEU 121 124.556  15.856  13.845
  947   HD13  LEU 121          HD13      LEU 121 125.333  16.800  15.117
  948   HD21  LEU 121          HD21      LEU 121 122.912  16.510  16.449
  949   HD22  LEU 121          HD22      LEU 121 122.534  15.541  15.025
  950   HD23  LEU 121          HD23      LEU 121 121.498  16.896  15.469
  951    H    ASP 122           HN       ASP 122 122.364  19.405  17.864
  952    HA   ASP 122           HA       ASP 122 123.507  17.628  19.825
  953    HB2  ASP 122           HB2      ASP 122 121.917  18.564  21.371
  954    HB3  ASP 122           HB1      ASP 122 122.760  19.888  20.587
  955    H    LYS 123           HN       LYS 123 122.543  15.851  20.256
  956    HA   LYS 123           HA       LYS 123 120.600  14.928  18.314
  957    HB2  LYS 123           HB2      LYS 123 122.431  13.443  20.170
  958    HB3  LYS 123           HB1      LYS 123 121.037  12.629  19.487
  959    HG2  LYS 123           HG2      LYS 123 122.943  12.118  18.121
  960    HG3  LYS 123           HG1      LYS 123 121.889  13.187  17.210
  961    HD2  LYS 123           HD2      LYS 123 124.094  13.955  16.822
  962    HD3  LYS 123           HD1      LYS 123 123.375  15.082  17.966
  963    HE2  LYS 123           HE2      LYS 123 125.644  14.569  18.608
  964    HE3  LYS 123           HE1      LYS 123 124.521  13.950  19.814
  965    HZ1  LYS 123           HZ1      LYS 123 124.810  11.720  18.925
  966    HZ2  LYS 123           HZ2      LYS 123 126.327  12.375  19.237
  967    HZ3  LYS 123           HZ3      LYS 123 125.757  12.308  17.663
  968    H    GLU 124           HN       GLU 124 118.663  15.477  18.795
  969    HA   GLU 124           HA       GLU 124 117.644  15.280  21.506
  970    HB2  GLU 124           HB2      GLU 124 117.098  17.180  19.891
  971    HB3  GLU 124           HB1      GLU 124 116.188  16.016  18.948
  972    HG2  GLU 124           HG2      GLU 124 114.684  17.285  20.327
  973    HG3  GLU 124           HG1      GLU 124 114.732  15.618  20.901
  974    HA   PRO 125           HA       PRO 125 116.595  11.034  20.245
  975    HB2  PRO 125           HB2      PRO 125 115.603  10.738  22.988
  976    HB3  PRO 125           HB1      PRO 125 116.923   9.884  22.191
  977    HG2  PRO 125           HG2      PRO 125 117.357  11.686  24.145
  978    HG3  PRO 125           HG1      PRO 125 118.489  11.456  22.800
  979    HD2  PRO 125           HD2      PRO 125 116.440  13.597  23.208
  980    HD3  PRO 125           HD1      PRO 125 118.104  13.712  22.594
  981    H1   ARG 151           HT1      ARG 151 122.018  10.041  -2.428
  982    H2   ARG 151           HT2      ARG 151 121.382   8.864  -3.457
  983    H3   ARG 151           HT3      ARG 151 121.446  10.501  -3.961
  984    HA   ARG 151           HA       ARG 151 123.599   8.574  -3.313
  985    HB2  ARG 151           HB2      ARG 151 124.373   9.011  -5.658
  986    HB3  ARG 151           HB1      ARG 151 122.863   8.136  -5.505
  987    HG2  ARG 151           HG2      ARG 151 121.636  10.154  -6.024
  988    HG3  ARG 151           HG1      ARG 151 123.145  11.062  -6.135
  989    HD2  ARG 151           HD2      ARG 151 122.246  10.312  -8.341
  990    HD3  ARG 151           HD1      ARG 151 123.884   9.755  -7.990
  991    HE   ARG 151           HE       ARG 151 121.683   7.959  -7.342
  992   HH11  ARG 151          HH11      ARG 151 124.228   8.828  -9.618
  993   HH12  ARG 151          HH12      ARG 151 124.385   7.273 -10.292
  994   HH21  ARG 151          HH21      ARG 151 121.872   5.792  -8.262
  995   HH22  ARG 151          HH22      ARG 151 122.976   5.499  -9.510
  996    H    SER 152           HN       SER 152 125.741   9.217  -3.658
  997    HA   SER 152           HA       SER 152 127.513  10.362  -3.177
  998    HB2  SER 152           HB2      SER 152 127.751  12.717  -4.083
  999    HB3  SER 152           HB1      SER 152 127.267  11.503  -5.260
 1000    HG   SER 152           HG       SER 152 125.077  12.534  -4.183
 1001    H    SER 153           HN       SER 153 125.188  10.494  -1.132
 1002    HA   SER 153           HA       SER 153 126.262  12.735   0.257
 1003    HB2  SER 153           HB2      SER 153 123.938  10.970   0.961
 1004    HB3  SER 153           HB1      SER 153 124.590  12.154   2.093
 1005    HG   SER 153           HG       SER 153 123.104  12.500  -0.216
 1006    H    ARG 154           HN       ARG 154 125.534   9.879   2.309
 1007    HA   ARG 154           HA       ARG 154 128.413   9.826   2.691
 1008    HB2  ARG 154           HB2      ARG 154 126.515  10.382   4.985
 1009    HB3  ARG 154           HB1      ARG 154 128.177   9.884   5.202
 1010    HG2  ARG 154           HG2      ARG 154 128.232  12.207   5.511
 1011    HG3  ARG 154           HG1      ARG 154 128.777  12.006   3.850
 1012    HD2  ARG 154           HD2      ARG 154 126.436  12.476   3.116
 1013    HD3  ARG 154           HD1      ARG 154 126.030  12.830   4.795
 1014    HE   ARG 154           HE       ARG 154 128.255  14.364   3.948
 1015   HH11  ARG 154          HH11      ARG 154 124.721  14.245   3.682
 1016   HH12  ARG 154          HH12      ARG 154 124.565  15.875   3.264
 1017   HH21  ARG 154          HH21      ARG 154 128.022  16.614   3.395
 1018   HH22  ARG 154          HH22      ARG 154 126.485  17.268   3.109
 1019    H    THR 155           HN       THR 155 125.764   8.366   4.576
 1020    HA   THR 155           HA       THR 155 127.487   6.073   4.928
 1021    HB   THR 155           HB       THR 155 124.903   6.847   6.309
 1022    HG1  THR 155           HG1      THR 155 127.581   7.611   6.480
 1023   HG21  THR 155          HG21      THR 155 127.261   5.128   7.077
 1024   HG22  THR 155          HG22      THR 155 125.623   4.545   6.766
 1025   HG23  THR 155          HG23      THR 155 125.951   5.562   8.176
 1026    H    ARG 156           HN       ARG 156 125.532   6.763   2.607
 1027    HA   ARG 156           HA       ARG 156 123.516   4.910   2.309
 1028    HB2  ARG 156           HB2      ARG 156 124.116   5.183  -0.260
 1029    HB3  ARG 156           HB1      ARG 156 123.398   6.492   0.651
 1030    HG2  ARG 156           HG2      ARG 156 125.146   7.410  -0.711
 1031    HG3  ARG 156           HG1      ARG 156 125.709   7.453   0.952
 1032    HD2  ARG 156           HD2      ARG 156 126.985   5.371   0.504
 1033    HD3  ARG 156           HD1      ARG 156 126.478   5.470  -1.178
 1034    HE   ARG 156           HE       ARG 156 128.071   7.530   0.174
 1035   HH11  ARG 156          HH11      ARG 156 127.475   5.428  -2.626
 1036   HH12  ARG 156          HH12      ARG 156 128.662   6.115  -3.606
 1037   HH21  ARG 156          HH21      ARG 156 129.838   8.451  -1.190
 1038   HH22  ARG 156          HH22      ARG 156 130.045   7.866  -2.763
 1039    H    ARG 157           HN       ARG 157 123.513   2.804   2.546
 1040    HA   ARG 157           HA       ARG 157 124.696   0.983   0.841
 1041    HB2  ARG 157           HB2      ARG 157 126.753   1.915   2.249
 1042    HB3  ARG 157           HB1      ARG 157 126.256   0.662   3.406
 1043    HG2  ARG 157           HG2      ARG 157 126.505  -0.998   1.531
 1044    HG3  ARG 157           HG1      ARG 157 127.123   0.302   0.515
 1045    HD2  ARG 157           HD2      ARG 157 129.016  -0.898   1.377
 1046    HD3  ARG 157           HD1      ARG 157 128.945   0.642   2.237
 1047    HE   ARG 157           HE       ARG 157 127.576  -1.563   3.477
 1048   HH11  ARG 157          HH11      ARG 157 130.802   0.018   3.388
 1049   HH12  ARG 157          HH12      ARG 157 131.151  -0.462   4.984
 1050   HH21  ARG 157          HH21      ARG 157 128.168  -2.216   5.560
 1051   HH22  ARG 157          HH22      ARG 157 129.659  -1.756   6.261
 1052    H    GLU 158           HN       GLU 158 125.150  -1.157   3.041
 1053    HA   GLU 158           HA       GLU 158 122.337  -1.575   3.191
 1054    HB2  GLU 158           HB2      GLU 158 122.726  -3.842   3.648
 1055    HB3  GLU 158           HB1      GLU 158 123.932  -3.384   2.466
 1056    HG2  GLU 158           HG2      GLU 158 124.342  -3.862   5.414
 1057    HG3  GLU 158           HG1      GLU 158 124.921  -4.853   4.079
 1058    H    THR 159           HN       THR 159 121.116  -1.789   4.785
 1059    HA   THR 159           HA       THR 159 122.048  -1.468   7.545
 1060    HB   THR 159           HB       THR 159 119.230  -1.095   6.406
 1061    HG1  THR 159           HG1      THR 159 120.529   0.468   5.448
 1062   HG21  THR 159          HG21      THR 159 120.477  -0.092   9.003
 1063   HG22  THR 159          HG22      THR 159 119.327  -1.414   8.888
 1064   HG23  THR 159          HG23      THR 159 118.828   0.223   8.490
 1065    H    GLN 160           HN       GLN 160 122.209  -3.539   8.324
 1066    HA   GLN 160           HA       GLN 160 120.777  -5.634   6.937
 1067    HB2  GLN 160           HB2      GLN 160 123.055  -6.116   7.234
 1068    HB3  GLN 160           HB1      GLN 160 123.021  -5.728   8.960
 1069    HG2  GLN 160           HG2      GLN 160 121.598  -7.734   9.272
 1070    HG3  GLN 160           HG1      GLN 160 121.777  -8.082   7.555
 1071   HE21  GLN 160          HE21      GLN 160 122.574  -9.558   9.923
 1072   HE22  GLN 160          HE22      GLN 160 124.263  -9.858   9.773
 1073    H    VAL 161           HN       VAL 161 118.743  -5.770   7.510
 1074    HA   VAL 161           HA       VAL 161 118.249  -5.616  10.325
 1075    HB   VAL 161           HB       VAL 161 115.966  -4.852   9.822
 1076   HG11  VAL 161          HG11      VAL 161 116.496  -2.690   8.890
 1077   HG12  VAL 161          HG12      VAL 161 118.030  -3.313   8.315
 1078   HG13  VAL 161          HG13      VAL 161 117.726  -3.186  10.069
 1079   HG21  VAL 161          HG21      VAL 161 116.827  -4.887   6.941
 1080   HG22  VAL 161          HG22      VAL 161 115.291  -4.278   7.556
 1081   HG23  VAL 161          HG23      VAL 161 115.676  -5.997   7.671
  Start of MODEL   11
    1    H1   GLY  -3           HT1      GLY  -3 115.867  12.225 -23.477
    2    H2   GLY  -3           HT2      GLY  -3 114.644  11.453 -24.317
    3    H3   GLY  -3           HT3      GLY  -3 116.265  11.219 -24.774
    4    HA2  GLY  -3           HA1      GLY  -3 115.418   9.325 -23.525
    5    HA3  GLY  -3           HA2      GLY  -3 116.690  10.175 -22.647
    6    H    ALA  -2           HN       ALA  -2 113.600   8.942 -22.462
    7    HA   ALA  -2           HA       ALA  -2 112.435  10.804 -20.687
    8    HB1  ALA  -2           HB1      ALA  -2 110.756   9.075 -20.313
    9    HB2  ALA  -2           HB2      ALA  -2 111.786   7.890 -21.114
   10    HB3  ALA  -2           HB3      ALA  -2 111.111   9.232 -22.035
   11    H    MET  -1           HN       MET  -1 113.754  11.245 -19.025
   12    HA   MET  -1           HA       MET  -1 114.509  11.171 -16.951
   13    HB2  MET  -1           HB2      MET  -1 112.967   8.588 -16.689
   14    HB3  MET  -1           HB1      MET  -1 113.722   9.440 -15.352
   15    HG2  MET  -1           HG2      MET  -1 111.484  10.430 -17.095
   16    HG3  MET  -1           HG1      MET  -1 111.369   9.923 -15.409
   17    HE1  MET  -1           HE1      MET  -1 113.337  12.775 -13.566
   18    HE2  MET  -1           HE2      MET  -1 113.989  11.234 -14.133
   19    HE3  MET  -1           HE3      MET  -1 112.378  11.302 -13.406
   20    H    GLY   0           HN       GLY   0 116.500  10.936 -18.181
   21    HA2  GLY   0           HA2      GLY   0 117.912   8.433 -17.747
   22    HA3  GLY   0           HA1      GLY   0 118.554   9.893 -18.493
   23    H    LYS   1           HN       LYS   1 116.967  10.726 -15.798
   24    HA   LYS   1           HA       LYS   1 119.332  10.621 -14.065
   25    HB2  LYS   1           HB2      LYS   1 117.214  12.782 -14.330
   26    HB3  LYS   1           HB1      LYS   1 118.317  12.692 -12.977
   27    HG2  LYS   1           HG2      LYS   1 119.223  14.313 -14.387
   28    HG3  LYS   1           HG1      LYS   1 120.191  12.874 -14.668
   29    HD2  LYS   1           HD2      LYS   1 119.742  13.943 -16.800
   30    HD3  LYS   1           HD1      LYS   1 118.820  12.444 -16.718
   31    HE2  LYS   1           HE2      LYS   1 116.805  13.584 -16.310
   32    HE3  LYS   1           HE1      LYS   1 117.631  15.099 -15.956
   33    HZ1  LYS   1           HZ1      LYS   1 117.412  13.757 -18.606
   34    HZ2  LYS   1           HZ2      LYS   1 118.350  15.112 -18.313
   35    HZ3  LYS   1           HZ3      LYS   1 116.694  15.213 -18.155
   36    HA   PRO   2           HA       PRO   2 116.497   8.453 -11.434
   37    HB2  PRO   2           HB2      PRO   2 117.597   8.953  -8.990
   38    HB3  PRO   2           HB1      PRO   2 118.244   7.757 -10.116
   39    HG2  PRO   2           HG2      PRO   2 119.224  10.496  -9.482
   40    HG3  PRO   2           HG1      PRO   2 120.145   9.052  -9.927
   41    HD2  PRO   2           HD2      PRO   2 119.560  11.143 -11.638
   42    HD3  PRO   2           HD1      PRO   2 119.972   9.506 -12.158
   43    H    PHE   3           HN       PHE   3 114.707   8.903 -10.290
   44    HA   PHE   3           HA       PHE   3 114.270  11.718  -9.903
   45    HB2  PHE   3           HB2      PHE   3 111.811  11.009 -10.052
   46    HB3  PHE   3           HB1      PHE   3 112.791  11.075 -11.529
   47    HD1  PHE   3           HD1      PHE   3 111.534   8.833  -8.919
   48    HD2  PHE   3           HD2      PHE   3 112.828   9.229 -12.917
   49    HE1  PHE   3           HE1      PHE   3 110.802   6.560  -9.345
   50    HE2  PHE   3           HE2      PHE   3 112.102   6.921 -13.401
   51    HZ   PHE   3           HZ       PHE   3 111.083   5.569 -11.611
   52    H    PHE   4           HN       PHE   4 113.351  12.478  -8.190
   53    HA   PHE   4           HA       PHE   4 112.572  10.773  -6.025
   54    HB2  PHE   4           HB2      PHE   4 114.883  11.124  -5.325
   55    HB3  PHE   4           HB1      PHE   4 114.767  12.824  -5.814
   56    HD1  PHE   4           HD1      PHE   4 113.692  14.479  -4.437
   57    HD2  PHE   4           HD2      PHE   4 113.877  10.425  -3.163
   58    HE1  PHE   4           HE1      PHE   4 112.884  15.165  -2.288
   59    HE2  PHE   4           HE2      PHE   4 113.066  11.106  -0.936
   60    HZ   PHE   4           HZ       PHE   4 112.562  13.475  -0.477
   61    H    THR   5           HN       THR   5 110.796  11.588  -5.297
   62    HA   THR   5           HA       THR   5 110.708  14.204  -4.270
   63    HB   THR   5           HB       THR   5 110.084  14.706  -6.557
   64    HG1  THR   5           HG1      THR   5 109.139  16.041  -5.119
   65   HG21  THR   5          HG21      THR   5 107.960  13.901  -7.560
   66   HG22  THR   5          HG22      THR   5 107.687  12.923  -6.116
   67   HG23  THR   5          HG23      THR   5 109.041  12.550  -7.163
   68    H    ARG   6           HN       ARG   6 110.784  11.698  -3.297
   69    HA   ARG   6           HA       ARG   6 109.895  10.177  -1.863
   70    HB2  ARG   6           HB2      ARG   6 108.859  11.128   0.079
   71    HB3  ARG   6           HB1      ARG   6 110.214  12.077  -0.532
   72    HG2  ARG   6           HG2      ARG   6 108.741  13.722  -1.433
   73    HG3  ARG   6           HG1      ARG   6 107.332  12.739  -0.999
   74    HD2  ARG   6           HD2      ARG   6 107.995  12.754   1.193
   75    HD3  ARG   6           HD1      ARG   6 109.406  13.764   0.766
   76    HE   ARG   6           HE       ARG   6 107.232  15.164  -0.137
   77   HH11  ARG   6          HH11      ARG   6 108.240  14.099   3.086
   78   HH12  ARG   6          HH12      ARG   6 107.344  15.274   3.920
   79   HH21  ARG   6          HH21      ARG   6 106.047  16.837   1.021
   80   HH22  ARG   6          HH22      ARG   6 106.118  16.900   2.720
   81    H    ASN   7           HN       ASN   7 108.675  10.412  -3.982
   82    HA   ASN   7           HA       ASN   7 105.871   9.646  -3.433
   83    HB2  ASN   7           HB2      ASN   7 107.080  10.962  -5.684
   84    HB3  ASN   7           HB1      ASN   7 106.085   9.604  -6.192
   85   HD21  ASN   7          HD21      ASN   7 106.121  12.642  -4.547
   86   HD22  ASN   7          HD22      ASN   7 104.422  12.908  -4.571
   87    HA   PRO   8           HA       PRO   8 107.000   5.224  -3.911
   88    HB2  PRO   8           HB2      PRO   8 104.154   5.166  -4.020
   89    HB3  PRO   8           HB1      PRO   8 105.125   4.261  -2.963
   90    HG2  PRO   8           HG2      PRO   8 103.545   6.422  -2.470
   91    HG3  PRO   8           HG1      PRO   8 104.763   5.860  -1.292
   92    HD2  PRO   8           HD2      PRO   8 104.590   8.249  -2.722
   93    HD3  PRO   8           HD1      PRO   8 105.967   7.758  -1.712
   94    H    SER   9           HN       SER   9 104.472   7.100  -5.059
   95    HA   SER   9           HA       SER   9 103.566   5.580  -6.977
   96    HB2  SER   9           HB2      SER   9 103.454   8.245  -6.073
   97    HB3  SER   9           HB1      SER   9 102.527   7.966  -7.608
   98    HG   SER   9           HG       SER   9 101.332   6.488  -6.395
   99    H    GLU  10           HN       GLU  10 106.288   7.935  -6.960
  100    HA   GLU  10           HA       GLU  10 106.408   8.281  -9.815
  101    HB2  GLU  10           HB2      GLU  10 108.439   9.572  -9.438
  102    HB3  GLU  10           HB1      GLU  10 107.335   9.996  -8.140
  103    HG2  GLU  10           HG2      GLU  10 108.596   8.310  -6.723
  104    HG3  GLU  10           HG1      GLU  10 109.764   8.235  -8.032
  105    H    LEU  11           HN       LEU  11 107.769   6.279  -7.331
  106    HA   LEU  11           HA       LEU  11 109.619   4.868  -8.904
  107    HB2  LEU  11           HB2      LEU  11 108.070   3.993  -6.473
  108    HB3  LEU  11           HB1      LEU  11 109.392   3.090  -7.181
  109    HG   LEU  11           HG       LEU  11 109.618   5.836  -5.937
  110   HD11  LEU  11          HD11      LEU  11 110.503   3.131  -4.990
  111   HD12  LEU  11          HD12      LEU  11 109.174   4.082  -4.322
  112   HD13  LEU  11          HD13      LEU  11 110.841   4.664  -4.180
  113   HD21  LEU  11          HD21      LEU  11 111.254   5.515  -7.723
  114   HD22  LEU  11          HD22      LEU  11 111.713   3.964  -7.042
  115   HD23  LEU  11          HD23      LEU  11 112.046   5.450  -6.147
  116    H    LYS  12           HN       LYS  12 109.423   3.336 -10.181
  117    HA   LYS  12           HA       LYS  12 106.862   2.821 -11.382
  118    HB2  LYS  12           HB2      LYS  12 108.150   1.603 -13.086
  119    HB3  LYS  12           HB1      LYS  12 108.672   3.261 -12.834
  120    HG2  LYS  12           HG2      LYS  12 110.621   2.653 -11.818
  121    HG3  LYS  12           HG1      LYS  12 109.942   1.093 -11.332
  122    HD2  LYS  12           HD2      LYS  12 110.343   1.798 -14.193
  123    HD3  LYS  12           HD1      LYS  12 111.706   1.120 -13.258
  124    HE2  LYS  12           HE2      LYS  12 110.292  -0.843 -12.795
  125    HE3  LYS  12           HE1      LYS  12 108.992  -0.130 -13.742
  126    HZ1  LYS  12           HZ1      LYS  12 111.662  -0.929 -14.800
  127    HZ2  LYS  12           HZ2      LYS  12 110.427  -0.201 -15.676
  128    HZ3  LYS  12           HZ3      LYS  12 110.194  -1.729 -15.046
  129    H    GLY  13           HN       GLY  13 106.898   0.452 -12.446
  130    HA2  GLY  13           HA2      GLY  13 106.626  -1.802 -12.123
  131    HA3  GLY  13           HA1      GLY  13 107.383  -1.637 -10.545
  132    H    LYS  14           HN       LYS  14 106.148  -2.095  -8.969
  133    HA   LYS  14           HA       LYS  14 103.316  -1.368  -8.972
  134    HB2  LYS  14           HB2      LYS  14 102.780  -3.502  -7.810
  135    HB3  LYS  14           HB1      LYS  14 103.221  -3.718  -9.504
  136    HG2  LYS  14           HG2      LYS  14 105.323  -3.925  -7.495
  137    HG3  LYS  14           HG1      LYS  14 104.156  -5.244  -7.508
  138    HD2  LYS  14           HD2      LYS  14 105.687  -4.296  -9.942
  139    HD3  LYS  14           HD1      LYS  14 106.210  -5.642  -8.929
  140    HE2  LYS  14           HE2      LYS  14 104.104  -6.787  -9.383
  141    HE3  LYS  14           HE1      LYS  14 103.596  -5.467 -10.425
  142    HZ1  LYS  14           HZ1      LYS  14 105.994  -7.167 -10.909
  143    HZ2  LYS  14           HZ2      LYS  14 105.412  -5.966 -11.924
  144    HZ3  LYS  14           HZ3      LYS  14 104.500  -7.364 -11.651
  145    H    PHE  15           HN       PHE  15 102.449  -1.372  -6.806
  146    HA   PHE  15           HA       PHE  15 104.450  -0.545  -4.859
  147    HB2  PHE  15           HB2      PHE  15 103.255   1.288  -6.044
  148    HB3  PHE  15           HB1      PHE  15 101.746   0.552  -5.543
  149    HD1  PHE  15           HD1      PHE  15 104.168   0.410  -2.963
  150    HD2  PHE  15           HD2      PHE  15 101.390   2.930  -4.896
  151    HE1  PHE  15           HE1      PHE  15 104.182   1.918  -0.988
  152    HE2  PHE  15           HE2      PHE  15 101.370   4.448  -2.966
  153    HZ   PHE  15           HZ       PHE  15 102.772   3.976  -1.021
  154    H    ILE  16           HN       ILE  16 104.294  -2.074  -3.304
  155    HA   ILE  16           HA       ILE  16 101.643  -3.088  -2.725
  156    HB   ILE  16           HB       ILE  16 102.733  -5.203  -1.875
  157   HG12  ILE  16          HG12      ILE  16 105.090  -4.286  -2.034
  158   HG13  ILE  16          HG11      ILE  16 104.859  -5.925  -2.601
  159   HG21  ILE  16          HG21      ILE  16 102.659  -4.701  -4.829
  160   HG22  ILE  16          HG22      ILE  16 101.341  -5.276  -3.800
  161   HG23  ILE  16          HG23      ILE  16 102.757  -6.294  -4.084
  162   HD11  ILE  16          HD11      ILE  16 105.052  -3.500  -4.438
  163   HD12  ILE  16          HD12      ILE  16 104.911  -5.177  -4.934
  164   HD13  ILE  16          HD13      ILE  16 106.362  -4.647  -4.107
  165    H    HIS  17           HN       HIS  17 101.004  -3.204  -0.743
  166    HA   HIS  17           HA       HIS  17 102.800  -2.187   1.343
  167    HB2  HIS  17           HB2      HIS  17 100.991  -0.686   0.739
  168    HB3  HIS  17           HB1      HIS  17  99.810  -1.981   0.957
  169    HD1  HIS  17           HD1      HIS  17 101.495   0.828   2.776
  170    HD2  HIS  17           HD2      HIS  17  99.367  -2.630   3.732
  171    HE1  HIS  17           HE1      HIS  17 100.729   1.110   5.107
  172    H    THR  18           HN       THR  18 103.511  -3.952   2.197
  173    HA   THR  18           HA       THR  18 101.645  -6.138   2.879
  174    HB   THR  18           HB       THR  18 103.189  -6.779   1.103
  175    HG1  THR  18           HG1      THR  18 103.653  -8.073   3.609
  176   HG21  THR  18          HG21      THR  18 105.639  -6.994   1.512
  177   HG22  THR  18          HG22      THR  18 105.428  -6.211   3.072
  178   HG23  THR  18          HG23      THR  18 105.099  -5.319   1.588
  179    H    LYS  19           HN       LYS  19 101.721  -6.984   4.947
  180    HA   LYS  19           HA       LYS  19 103.120  -5.423   6.927
  181    HB2  LYS  19           HB2      LYS  19 100.821  -6.089   7.368
  182    HB3  LYS  19           HB1      LYS  19 101.204  -7.767   7.083
  183    HG2  LYS  19           HG2      LYS  19 102.339  -6.216   9.430
  184    HG3  LYS  19           HG1      LYS  19 100.784  -7.031   9.498
  185    HD2  LYS  19           HD2      LYS  19 102.203  -9.143   8.682
  186    HD3  LYS  19           HD1      LYS  19 103.543  -8.209   9.349
  187    HE2  LYS  19           HE2      LYS  19 102.683  -9.770  10.969
  188    HE3  LYS  19           HE1      LYS  19 102.465  -8.101  11.485
  189    HZ1  LYS  19           HZ1      LYS  19 100.147  -8.214  10.948
  190    HZ2  LYS  19           HZ2      LYS  19 100.520  -9.566  11.881
  191    HZ3  LYS  19           HZ3      LYS  19 100.326  -9.727  10.224
  192    H    LEU  20           HN       LEU  20 105.022  -5.973   7.887
  193    HA   LEU  20           HA       LEU  20 105.910  -8.713   7.434
  194    HB2  LEU  20           HB2      LEU  20 107.348  -6.298   6.787
  195    HB3  LEU  20           HB1      LEU  20 108.174  -7.142   8.100
  196    HG   LEU  20           HG       LEU  20 108.380  -9.139   6.817
  197   HD11  LEU  20          HD11      LEU  20 106.358  -9.044   5.489
  198   HD12  LEU  20          HD12      LEU  20 107.807  -9.291   4.529
  199   HD13  LEU  20          HD13      LEU  20 107.037  -7.695   4.556
  200   HD21  LEU  20          HD21      LEU  20 109.947  -8.362   5.196
  201   HD22  LEU  20          HD22      LEU  20 110.054  -7.370   6.659
  202   HD23  LEU  20          HD23      LEU  20 109.233  -6.754   5.230
  203    H    ARG  21           HN       ARG  21 106.446  -9.826   9.096
  204    HA   ARG  21           HA       ARG  21 105.683  -8.703  11.578
  205    HB2  ARG  21           HB2      ARG  21 104.864 -10.826  10.714
  206    HB3  ARG  21           HB1      ARG  21 106.498 -11.463  10.731
  207    HG2  ARG  21           HG2      ARG  21 106.390 -10.888  13.264
  208    HG3  ARG  21           HG1      ARG  21 104.652 -10.874  12.983
  209    HD2  ARG  21           HD2      ARG  21 106.518 -13.094  12.293
  210    HD3  ARG  21           HD1      ARG  21 105.387 -13.125  13.661
  211    HE   ARG  21           HE       ARG  21 103.997 -12.680  11.248
  212   HH11  ARG  21          HH11      ARG  21 105.698 -15.300  12.922
  213   HH12  ARG  21          HH12      ARG  21 104.938 -16.539  12.040
  214   HH21  ARG  21          HH21      ARG  21 102.930 -14.399  10.067
  215   HH22  ARG  21          HH22      ARG  21 103.287 -16.024  10.427
  216    H    LYS  22           HN       LYS  22 107.496  -7.774  12.724
  217    HA   LYS  22           HA       LYS  22 110.189  -8.368  12.598
  218    HB2  LYS  22           HB2      LYS  22 108.312  -7.531  14.750
  219    HB3  LYS  22           HB1      LYS  22 109.900  -8.068  15.211
  220    HG2  LYS  22           HG2      LYS  22 109.780  -5.678  15.020
  221    HG3  LYS  22           HG1      LYS  22 110.935  -6.469  13.942
  222    HD2  LYS  22           HD2      LYS  22 109.825  -4.669  12.693
  223    HD3  LYS  22           HD1      LYS  22 109.241  -6.207  12.087
  224    HE2  LYS  22           HE2      LYS  22 107.353  -4.829  12.261
  225    HE3  LYS  22           HE1      LYS  22 107.269  -5.896  13.645
  226    HZ1  LYS  22           HZ1      LYS  22 108.242  -3.069  13.734
  227    HZ2  LYS  22           HZ2      LYS  22 108.054  -4.053  15.075
  228    HZ3  LYS  22           HZ3      LYS  22 106.725  -3.581  14.183
  229    H    SER  23           HN       SER  23 110.809 -10.377  12.464
  230    HA   SER  23           HA       SER  23 109.169 -12.369  13.745
  231    HB2  SER  23           HB2      SER  23 111.115 -12.536  11.453
  232    HB3  SER  23           HB1      SER  23 110.422 -14.011  12.189
  233    HG   SER  23           HG       SER  23 109.052 -11.769  11.144
  234    H    SER  24           HN       SER  24 112.662 -11.784  13.583
  235    HA   SER  24           HA       SER  24 112.840 -12.721  16.305
  236    HB2  SER  24           HB2      SER  24 114.557 -13.850  14.065
  237    HB3  SER  24           HB1      SER  24 114.736 -14.206  15.778
  238    HG   SER  24           HG       SER  24 113.214 -15.466  14.044
  239    H    ARG  25           HN       ARG  25 112.976 -10.354  16.317
  240    HA   ARG  25           HA       ARG  25 114.041  -8.440  16.638
  241    HB2  ARG  25           HB2      ARG  25 116.419 -10.263  16.718
  242    HB3  ARG  25           HB1      ARG  25 116.675  -8.526  16.701
  243    HG2  ARG  25           HG2      ARG  25 114.904  -9.893  18.710
  244    HG3  ARG  25           HG1      ARG  25 116.631  -9.593  18.997
  245    HD2  ARG  25           HD2      ARG  25 116.190  -7.187  18.664
  246    HD3  ARG  25           HD1      ARG  25 114.485  -7.545  18.421
  247    HE   ARG  25           HE       ARG  25 115.253  -8.652  20.836
  248   HH11  ARG  25          HH11      ARG  25 114.760  -5.435  19.416
  249   HH12  ARG  25          HH12      ARG  25 114.504  -4.639  20.887
  250   HH21  ARG  25          HH21      ARG  25 114.850  -7.584  22.883
  251   HH22  ARG  25          HH22      ARG  25 114.549  -5.921  22.939
  252    H    GLY  26           HN       GLY  26 113.137  -7.790  14.764
  253    HA2  GLY  26           HA2      GLY  26 113.702  -6.190  13.084
  254    HA3  GLY  26           HA1      GLY  26 115.153  -7.135  12.767
  255    H    PHE  27           HN       PHE  27 114.922  -7.578  10.752
  256    HA   PHE  27           HA       PHE  27 112.422  -8.765   9.835
  257    HB2  PHE  27           HB2      PHE  27 114.330  -6.831   8.684
  258    HB3  PHE  27           HB1      PHE  27 113.169  -7.661   7.647
  259    HD1  PHE  27           HD2      PHE  27 110.672  -7.437   8.524
  260    HD2  PHE  27           HD1      PHE  27 113.856  -4.905   9.691
  261    HE1  PHE  27           HE2      PHE  27 109.051  -5.726   9.259
  262    HE2  PHE  27           HE1      PHE  27 112.273  -3.231  10.433
  263    HZ   PHE  27           HZ       PHE  27 109.872  -3.611  10.230
  264    H    GLY  28           HN       GLY  28 115.703  -8.442   8.354
  265    HA2  GLY  28           HA2      GLY  28 116.997 -10.519   8.121
  266    HA3  GLY  28           HA1      GLY  28 115.466 -11.346   7.863
  267    H    PHE  29           HN       PHE  29 116.762  -8.353   6.566
  268    HA   PHE  29           HA       PHE  29 117.474  -9.493   4.121
  269    HB2  PHE  29           HB2      PHE  29 115.992  -8.133   2.643
  270    HB3  PHE  29           HB1      PHE  29 115.143  -9.383   3.506
  271    HD1  PHE  29           HD2      PHE  29 113.567  -8.840   5.210
  272    HD2  PHE  29           HD1      PHE  29 115.617  -5.835   3.105
  273    HE1  PHE  29           HE2      PHE  29 111.913  -7.187   5.999
  274    HE2  PHE  29           HE1      PHE  29 113.971  -4.142   3.874
  275    HZ   PHE  29           HZ       PHE  29 112.116  -4.833   5.328
  276    H    THR  30           HN       THR  30 118.821  -8.055   3.008
  277    HA   THR  30           HA       THR  30 119.394  -5.801   4.734
  278    HB   THR  30           HB       THR  30 121.701  -5.888   3.811
  279    HG1  THR  30           HG1      THR  30 121.863  -8.267   2.857
  280   HG21  THR  30          HG21      THR  30 122.380  -7.897   5.030
  281   HG22  THR  30          HG22      THR  30 120.739  -8.523   4.921
  282   HG23  THR  30          HG23      THR  30 121.055  -7.110   5.903
  283    H    VAL  31           HN       VAL  31 119.814  -3.789   3.786
  284    HA   VAL  31           HA       VAL  31 118.686  -3.557   1.090
  285    HB   VAL  31           HB       VAL  31 117.459  -1.494   1.884
  286   HG11  VAL  31          HG11      VAL  31 116.765  -4.053   3.277
  287   HG12  VAL  31          HG12      VAL  31 116.206  -3.522   1.681
  288   HG13  VAL  31          HG13      VAL  31 115.711  -2.652   3.125
  289   HG21  VAL  31          HG21      VAL  31 117.106  -1.233   4.227
  290   HG22  VAL  31          HG22      VAL  31 118.828  -1.048   3.776
  291   HG23  VAL  31          HG23      VAL  31 118.241  -2.563   4.516
  292    H    VAL  32           HN       VAL  32 119.201  -1.649  -0.038
  293    HA   VAL  32           HA       VAL  32 121.551  -0.172   0.850
  294    HB   VAL  32           HB       VAL  32 122.070   0.198  -1.594
  295   HG11  VAL  32          HG11      VAL  32 122.174  -2.593  -0.576
  296   HG12  VAL  32          HG12      VAL  32 123.361  -1.323  -0.250
  297   HG13  VAL  32          HG13      VAL  32 123.171  -1.961  -1.891
  298   HG21  VAL  32          HG21      VAL  32 120.103  -2.092  -2.019
  299   HG22  VAL  32          HG22      VAL  32 121.183  -1.473  -3.249
  300   HG23  VAL  32          HG23      VAL  32 119.918  -0.456  -2.620
  301    H    GLY  33           HN       GLY  33 121.346   1.908   0.947
  302    HA2  GLY  33           HA2      GLY  33 120.542   3.865  -0.411
  303    HA3  GLY  33           HA1      GLY  33 118.975   3.075  -0.311
  304    H    GLY  34           HN       GLY  34 118.004   4.558   0.745
  305    HA2  GLY  34           HA2      GLY  34 117.338   6.002   2.365
  306    HA3  GLY  34           HA1      GLY  34 117.567   4.671   3.449
  307    H    ASP  35           HN       ASP  35 119.262   7.103   1.738
  308    HA   ASP  35           HA       ASP  35 121.102   7.398   4.043
  309    HB2  ASP  35           HB2      ASP  35 121.891   6.587   1.742
  310    HB3  ASP  35           HB1      ASP  35 121.636   8.232   1.225
  311    H    GLU  36           HN       GLU  36 118.855   8.987   1.894
  312    HA   GLU  36           HA       GLU  36 118.911  11.366   3.485
  313    HB2  GLU  36           HB2      GLU  36 119.751  12.706   1.477
  314    HB3  GLU  36           HB1      GLU  36 120.970  11.887   2.437
  315    HG2  GLU  36           HG2      GLU  36 121.086  10.148   0.904
  316    HG3  GLU  36           HG1      GLU  36 119.820  10.840  -0.123
  317    HA   PRO  37           HA       PRO  37 115.095  11.895   1.599
  318    HB2  PRO  37           HB2      PRO  37 115.778  14.706   1.436
  319    HB3  PRO  37           HB1      PRO  37 114.452  13.935   2.409
  320    HG2  PRO  37           HG2      PRO  37 116.571  15.062   3.571
  321    HG3  PRO  37           HG1      PRO  37 116.085  13.431   4.103
  322    HD2  PRO  37           HD2      PRO  37 118.100  14.106   1.958
  323    HD3  PRO  37           HD1      PRO  37 118.433  13.158   3.387
  324    H    ASP  38           HN       ASP  38 116.460  11.043  -0.060
  325    HA   ASP  38           HA       ASP  38 116.162  12.162  -2.657
  326    HB2  ASP  38           HB2      ASP  38 117.973  13.554  -1.981
  327    HB3  ASP  38           HB1      ASP  38 118.913  12.222  -1.354
  328    H    GLU  39           HN       GLU  39 118.093  10.087  -0.546
  329    HA   GLU  39           HA       GLU  39 117.927   7.962  -2.510
  330    HB2  GLU  39           HB2      GLU  39 120.173   8.673  -1.748
  331    HB3  GLU  39           HB1      GLU  39 119.728   8.253  -0.102
  332    HG2  GLU  39           HG2      GLU  39 121.099   6.551  -1.089
  333    HG3  GLU  39           HG1      GLU  39 119.481   5.922  -0.770
  334    H    PHE  40           HN       PHE  40 116.570   6.421  -2.192
  335    HA   PHE  40           HA       PHE  40 114.986   5.957   0.289
  336    HB2  PHE  40           HB2      PHE  40 114.604   4.701  -2.449
  337    HB3  PHE  40           HB1      PHE  40 113.472   4.709  -1.125
  338    HD1  PHE  40           HD2      PHE  40 112.855   7.320  -0.437
  339    HD2  PHE  40           HD1      PHE  40 114.026   5.889  -4.266
  340    HE1  PHE  40           HE2      PHE  40 111.665   9.188  -1.500
  341    HE2  PHE  40           HE1      PHE  40 112.839   7.756  -5.343
  342    HZ   PHE  40           HZ       PHE  40 111.643   9.410  -3.971
  343    H    LEU  41           HN       LEU  41 114.436   3.445   0.688
  344    HA   LEU  41           HA       LEU  41 117.091   2.228   0.467
  345    HB2  LEU  41           HB2      LEU  41 114.888   1.241   2.312
  346    HB3  LEU  41           HB1      LEU  41 116.552   0.706   2.103
  347    HG   LEU  41           HG       LEU  41 117.259   2.928   2.907
  348   HD11  LEU  41          HD11      LEU  41 115.153   4.152   2.792
  349   HD12  LEU  41          HD12      LEU  41 115.673   4.067   4.479
  350   HD13  LEU  41          HD13      LEU  41 114.400   3.002   3.895
  351   HD21  LEU  41          HD21      LEU  41 115.880   1.009   4.755
  352   HD22  LEU  41          HD22      LEU  41 117.100   2.197   5.234
  353   HD23  LEU  41          HD23      LEU  41 117.524   0.895   4.135
  354    H    GLN  42           HN       GLN  42 117.320   0.184  -0.341
  355    HA   GLN  42           HA       GLN  42 114.974  -0.928  -1.699
  356    HB2  GLN  42           HB2      GLN  42 116.330   0.362  -3.185
  357    HB3  GLN  42           HB1      GLN  42 117.780  -0.543  -2.674
  358    HG2  GLN  42           HG2      GLN  42 116.243  -2.568  -3.590
  359    HG3  GLN  42           HG1      GLN  42 115.515  -1.257  -4.452
  360   HE21  GLN  42          HE21      GLN  42 116.257  -2.289  -6.343
  361   HE22  GLN  42          HE22      GLN  42 117.904  -1.992  -6.825
  362    H    ILE  43           HN       ILE  43 115.214  -3.234  -1.951
  363    HA   ILE  43           HA       ILE  43 116.791  -4.468   0.185
  364    HB   ILE  43           HB       ILE  43 115.445  -6.045  -2.016
  365   HG12  ILE  43          HG12      ILE  43 113.674  -4.552  -1.292
  366   HG13  ILE  43          HG11      ILE  43 113.350  -6.166  -0.689
  367   HG21  ILE  43          HG21      ILE  43 115.954  -6.707   0.875
  368   HG22  ILE  43          HG22      ILE  43 116.814  -7.318  -0.536
  369   HG23  ILE  43          HG23      ILE  43 115.123  -7.747  -0.283
  370   HD11  ILE  43          HD11      ILE  43 114.194  -5.467   1.499
  371   HD12  ILE  43          HD12      ILE  43 112.805  -4.529   0.947
  372   HD13  ILE  43          HD13      ILE  43 114.426  -3.841   0.852
  373    H    LYS  44           HN       LYS  44 118.801  -5.255  -0.081
  374    HA   LYS  44           HA       LYS  44 119.894  -5.604  -2.826
  375    HB2  LYS  44           HB2      LYS  44 122.117  -5.355  -1.892
  376    HB3  LYS  44           HB1      LYS  44 121.103  -3.990  -1.466
  377    HG2  LYS  44           HG2      LYS  44 120.875  -4.653   0.786
  378    HG3  LYS  44           HG1      LYS  44 121.404  -6.290   0.441
  379    HD2  LYS  44           HD2      LYS  44 123.267  -3.907   0.241
  380    HD3  LYS  44           HD1      LYS  44 123.011  -4.801   1.732
  381    HE2  LYS  44           HE2      LYS  44 123.956  -6.018  -0.856
  382    HE3  LYS  44           HE1      LYS  44 125.023  -5.498   0.445
  383    HZ1  LYS  44           HZ1      LYS  44 124.636  -7.846   0.558
  384    HZ2  LYS  44           HZ2      LYS  44 122.993  -7.693   0.559
  385    HZ3  LYS  44           HZ3      LYS  44 123.882  -7.160   1.897
  386    H    SER  45           HN       SER  45 119.184  -7.290   0.101
  387    HA   SER  45           HA       SER  45 119.718  -9.732  -1.335
  388    HB2  SER  45           HB2      SER  45 121.050  -9.256   1.353
  389    HB3  SER  45           HB1      SER  45 121.174 -10.700   0.352
  390    HG   SER  45           HG       SER  45 121.948  -8.918  -1.240
  391    H    LEU  46           HN       LEU  46 117.989 -10.974  -0.917
  392    HA   LEU  46           HA       LEU  46 116.352 -10.458   1.273
  393    HB2  LEU  46           HB2      LEU  46 115.368 -11.074  -0.795
  394    HB3  LEU  46           HB1      LEU  46 116.414 -12.470  -0.926
  395    HG   LEU  46           HG       LEU  46 115.224 -13.585   0.863
  396   HD11  LEU  46          HD11      LEU  46 114.734 -11.592   2.127
  397   HD12  LEU  46          HD12      LEU  46 113.326 -12.638   1.896
  398   HD13  LEU  46          HD13      LEU  46 113.494 -11.133   0.945
  399   HD21  LEU  46          HD21      LEU  46 114.392 -13.832  -1.399
  400   HD22  LEU  46          HD22      LEU  46 113.386 -12.397  -1.186
  401   HD23  LEU  46          HD23      LEU  46 113.066 -13.848  -0.233
  402    H    VAL  47           HN       VAL  47 116.904 -11.328   3.289
  403    HA   VAL  47           HA       VAL  47 118.723 -13.541   3.333
  404    HB   VAL  47           HB       VAL  47 117.592 -11.842   5.575
  405   HG11  VAL  47          HG11      VAL  47 119.833 -13.833   5.579
  406   HG12  VAL  47          HG12      VAL  47 118.234 -14.044   6.303
  407   HG13  VAL  47          HG13      VAL  47 119.344 -12.823   6.949
  408   HG21  VAL  47          HG21      VAL  47 119.754 -10.738   5.634
  409   HG22  VAL  47          HG22      VAL  47 119.034 -10.571   4.032
  410   HG23  VAL  47          HG23      VAL  47 120.325 -11.738   4.300
  411    H    LEU  48           HN       LEU  48 117.936 -15.517   3.464
  412    HA   LEU  48           HA       LEU  48 115.167 -15.979   3.787
  413    HB2  LEU  48           HB2      LEU  48 117.445 -17.894   3.859
  414    HB3  LEU  48           HB1      LEU  48 115.769 -18.329   3.644
  415    HG   LEU  48           HG       LEU  48 117.424 -16.723   1.712
  416   HD11  LEU  48          HD11      LEU  48 117.030 -18.560   0.167
  417   HD12  LEU  48          HD12      LEU  48 116.135 -19.415   1.420
  418   HD13  LEU  48          HD13      LEU  48 117.861 -19.096   1.629
  419   HD21  LEU  48          HD21      LEU  48 114.481 -17.403   1.562
  420   HD22  LEU  48          HD22      LEU  48 115.427 -16.725   0.243
  421   HD23  LEU  48          HD23      LEU  48 115.176 -15.784   1.702
  422    H    ASP  49           HN       ASP  49 114.071 -17.001   5.284
  423    HA   ASP  49           HA       ASP  49 113.298 -17.368   7.326
  424    HB2  ASP  49           HB2      ASP  49 115.399 -18.509   7.817
  425    HB3  ASP  49           HB1      ASP  49 116.136 -17.017   8.325
  426    H    GLY  50           HN       GLY  50 114.256 -14.737   6.033
  427    HA2  GLY  50           HA2      GLY  50 113.632 -12.749   8.088
  428    HA3  GLY  50           HA1      GLY  50 113.898 -12.607   6.322
  429    HA   PRO  51           HA       PRO  51 109.411 -13.235   7.307
  430    HB2  PRO  51           HB2      PRO  51 108.247 -10.827   7.927
  431    HB3  PRO  51           HB1      PRO  51 109.074 -11.822   9.066
  432    HG2  PRO  51           HG2      PRO  51 110.025  -9.320   7.874
  433    HG3  PRO  51           HG1      PRO  51 110.409 -10.064   9.429
  434    HD2  PRO  51           HD2      PRO  51 111.815 -10.159   6.946
  435    HD3  PRO  51           HD1      PRO  51 112.367 -10.796   8.467
  436    H    ALA  52           HN       ALA  52 110.983 -10.817   5.502
  437    HA   ALA  52           HA       ALA  52 109.207 -10.399   3.347
  438    HB1  ALA  52           HB1      ALA  52 111.129  -8.948   3.659
  439    HB2  ALA  52           HB2      ALA  52 111.368  -9.808   2.129
  440    HB3  ALA  52           HB3      ALA  52 112.219 -10.317   3.564
  441    H    ALA  53           HN       ALA  53 111.700 -12.777   4.054
  442    HA   ALA  53           HA       ALA  53 111.773 -14.173   1.572
  443    HB1  ALA  53           HB1      ALA  53 113.013 -15.838   2.840
  444    HB2  ALA  53           HB2      ALA  53 112.473 -15.109   4.343
  445    HB3  ALA  53           HB3      ALA  53 113.585 -14.222   3.291
  446    H    LEU  54           HN       LEU  54 110.301 -14.595   4.603
  447    HA   LEU  54           HA       LEU  54 109.331 -17.138   4.210
  448    HB2  LEU  54           HB2      LEU  54 108.808 -15.056   6.152
  449    HB3  LEU  54           HB1      LEU  54 108.327 -16.747   6.302
  450    HG   LEU  54           HG       LEU  54 111.192 -15.771   5.975
  451   HD11  LEU  54          HD11      LEU  54 110.151 -15.298   7.840
  452   HD12  LEU  54          HD12      LEU  54 111.445 -16.580   7.972
  453   HD13  LEU  54          HD13      LEU  54 109.642 -17.017   7.962
  454   HD21  LEU  54          HD21      LEU  54 110.947 -17.929   4.857
  455   HD22  LEU  54          HD22      LEU  54 110.008 -18.538   6.207
  456   HD23  LEU  54          HD23      LEU  54 111.713 -18.171   6.429
  457    H    ASP  55           HN       ASP  55 107.724 -13.971   4.411
  458    HA   ASP  55           HA       ASP  55 105.152 -14.967   3.656
  459    HB2  ASP  55           HB2      ASP  55 105.735 -12.689   4.796
  460    HB3  ASP  55           HB1      ASP  55 106.168 -12.170   3.190
  461    H    GLY  56           HN       GLY  56 107.995 -13.982   2.163
  462    HA2  GLY  56           HA2      GLY  56 108.797 -13.963   0.090
  463    HA3  GLY  56           HA1      GLY  56 107.529 -15.162  -0.305
  464    H    LYS  57           HN       LYS  57 106.959 -12.043   0.821
  465    HA   LYS  57           HA       LYS  57 105.462 -11.312  -1.558
  466    HB2  LYS  57           HB2      LYS  57 104.690 -11.054   0.788
  467    HB3  LYS  57           HB1      LYS  57 105.981  -9.881   0.993
  468    HG2  LYS  57           HG2      LYS  57 104.053  -8.571   0.595
  469    HG3  LYS  57           HG1      LYS  57 104.828  -8.643  -0.991
  470    HD2  LYS  57           HD2      LYS  57 102.803  -9.296  -1.711
  471    HD3  LYS  57           HD1      LYS  57 103.260 -10.865  -1.061
  472    HE2  LYS  57           HE2      LYS  57 101.517  -8.747   0.210
  473    HE3  LYS  57           HE1      LYS  57 101.065 -10.382  -0.238
  474    HZ1  LYS  57           HZ1      LYS  57 102.639 -11.146   1.622
  475    HZ2  LYS  57           HZ2      LYS  57 101.290 -10.270   2.103
  476    HZ3  LYS  57           HZ3      LYS  57 102.755  -9.511   2.040
  477    H    MET  58           HN       MET  58 108.542 -10.804  -0.129
  478    HA   MET  58           HA       MET  58 109.096  -8.422  -1.762
  479    HB2  MET  58           HB2      MET  58 109.951  -9.047   1.061
  480    HB3  MET  58           HB1      MET  58 110.579  -7.716   0.099
  481    HG2  MET  58           HG2      MET  58 108.478  -6.628   0.109
  482    HG3  MET  58           HG1      MET  58 107.699  -8.041   0.816
  483    HE1  MET  58           HE1      MET  58 110.906  -5.677   3.124
  484    HE2  MET  58           HE2      MET  58 110.589  -5.446   1.399
  485    HE3  MET  58           HE3      MET  58 111.271  -6.959   1.978
  486    H    GLU  59           HN       GLU  59 111.336  -8.294  -2.442
  487    HA   GLU  59           HA       GLU  59 112.975 -10.640  -2.096
  488    HB2  GLU  59           HB2      GLU  59 111.669  -9.905  -4.684
  489    HB3  GLU  59           HB1      GLU  59 113.201 -10.789  -4.673
  490    HG2  GLU  59           HG2      GLU  59 112.099 -12.571  -3.364
  491    HG3  GLU  59           HG1      GLU  59 110.590 -11.665  -3.445
  492    H    THR  60           HN       THR  60 115.110 -10.387  -3.264
  493    HA   THR  60           HA       THR  60 116.334  -7.978  -2.758
  494    HB   THR  60           HB       THR  60 117.101  -9.935  -4.876
  495    HG1  THR  60           HG1      THR  60 117.474 -11.403  -3.385
  496   HG21  THR  60          HG21      THR  60 119.336  -9.438  -4.097
  497   HG22  THR  60          HG22      THR  60 118.624  -8.361  -2.892
  498   HG23  THR  60          HG23      THR  60 118.479  -7.978  -4.623
  499    H    GLY  61           HN       GLY  61 115.915  -6.101  -3.837
  500    HA2  GLY  61           HA2      GLY  61 116.382  -5.214  -6.146
  501    HA3  GLY  61           HA1      GLY  61 115.082  -6.283  -6.631
  502    H    ASP  62           HN       ASP  62 113.331  -5.909  -4.399
  503    HA   ASP  62           HA       ASP  62 112.107  -3.558  -5.393
  504    HB2  ASP  62           HB2      ASP  62 110.468  -4.173  -3.271
  505    HB3  ASP  62           HB1      ASP  62 110.282  -4.792  -4.892
  506    H    VAL  63           HN       VAL  63 111.301  -1.766  -4.258
  507    HA   VAL  63           HA       VAL  63 113.333  -1.025  -2.377
  508    HB   VAL  63           HB       VAL  63 114.066   0.279  -4.096
  509   HG11  VAL  63          HG11      VAL  63 112.643   1.359  -5.764
  510   HG12  VAL  63          HG12      VAL  63 111.226   0.615  -4.982
  511   HG13  VAL  63          HG13      VAL  63 112.519  -0.396  -5.663
  512   HG21  VAL  63          HG21      VAL  63 113.578   1.885  -2.312
  513   HG22  VAL  63          HG22      VAL  63 111.955   2.124  -2.956
  514   HG23  VAL  63          HG23      VAL  63 113.359   2.628  -3.897
  515    H    ILE  64           HN       ILE  64 112.998  -0.447  -0.557
  516    HA   ILE  64           HA       ILE  64 110.487  -0.294   0.672
  517    HB   ILE  64           HB       ILE  64 113.230   0.432   1.695
  518   HG12  ILE  64          HG12      ILE  64 113.001  -1.935   1.114
  519   HG13  ILE  64          HG11      ILE  64 113.187  -1.724   2.850
  520   HG21  ILE  64          HG21      ILE  64 111.575   1.597   3.035
  521   HG22  ILE  64          HG22      ILE  64 112.293   0.289   3.977
  522   HG23  ILE  64          HG23      ILE  64 110.683   0.095   3.284
  523   HD11  ILE  64          HD11      ILE  64 111.536  -3.419   2.371
  524   HD12  ILE  64          HD12      ILE  64 110.625  -2.288   1.377
  525   HD13  ILE  64          HD13      ILE  64 110.760  -2.021   3.116
  526    H    VAL  65           HN       VAL  65 109.192   1.239   0.603
  527    HA   VAL  65           HA       VAL  65 109.939   3.991   0.072
  528    HB   VAL  65           HB       VAL  65 107.266   2.547  -0.034
  529   HG11  VAL  65          HG11      VAL  65 107.930   5.337  -0.955
  530   HG12  VAL  65          HG12      VAL  65 106.984   4.942   0.485
  531   HG13  VAL  65          HG13      VAL  65 106.381   4.525  -1.124
  532   HG21  VAL  65          HG21      VAL  65 109.052   3.529  -2.237
  533   HG22  VAL  65          HG22      VAL  65 107.468   2.787  -2.456
  534   HG23  VAL  65          HG23      VAL  65 108.803   1.848  -1.784
  535    H    SER  66           HN       SER  66 107.686   2.165   2.249
  536    HA   SER  66           HA       SER  66 108.358   3.995   4.402
  537    HB2  SER  66           HB2      SER  66 105.532   3.973   3.303
  538    HB3  SER  66           HB1      SER  66 106.064   4.812   4.758
  539    HG   SER  66           HG       SER  66 107.647   5.447   2.7