*HEADER    C-DI-GMP BINDING PROTEIN                02-DEC-10   2L74              
*TITLE     SOLUTION STRUCTURE OF THE PILZ DOMAIN PROTEIN PA4608 COMPLEX WITH C-  
*TITLE    2 DI-GMP IDENTIFIES CHARGE CLUSTERING AS MOLECULAR READOUT             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN PA4608;                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA;                         
*SOURCE   3 ORGANISM_TAXID: 287;                                                 
*SOURCE   4 GENE: PA4608;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 511693;                                     
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET15                                      
*KEYWDS    PILZ, PA4608, C-DI-GMP, UNKNOWN FUNCTION, C-DI-GMP BINDING PROTEIN    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    J.HABAZETTL, M.ALLAN, U.JENAL, S.GRZESIEK                             
*REVDAT   1   09-FEB-11 2L74    0                                                

! NOE in XPLOR format restraints /xplor-nih       
assign (residue 501 and name H1') (residue 501 and name H8) 1.8 0.0 3.2
assign (residue 501 and name H2') (residue 501 and name H8) 1.8 0.0 3.2
assign (residue 501 and name H3') (residue 501 and name H8) 1.8 0.0 2.2
assign (residue 501 and name H4') (residue 501 and name H8) 1.8 0.0 3.2
assign (residue 501 and name H3') (residue 502 and name H3') 1.8 0.0 2.2
assign (residue 501 and name H8) (residue 502 and name H3') 1.8 0.0 3.2
assign (residue 501 and name H3') (residue 503 and name H1) 1.8 0.0 3.2
assign (residue 501 and name H8) (residue 503 and name H1) 1.8 0.0 3.2
assign (resid 501 and name H3') (resid 9 and name HB#) 1.8 0.0 3.2
assign (resid 501 and name H2') (resid 10 and name HE) 1.8 0.0 3.2
assign (resid 501 and name H3') (resid 10 and name HE) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 13 and name HD1) 4.0 2.2 0
assign (resid 501 and name H1) (resid 13 and name HD2) 4.0 2.2 0
assign (resid 501 and name H1) (resid 13 and name HE) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 13 and name HG#) 5.0 3.9 0
assign (resid 501 and name H1') (resid 40 and name HA1) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 40 and name HA2) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 40 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 41 and name HG*) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 41 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 41 and name HA) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 41 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 42 and name HA) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 42 and name HB1) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 42 and name HB2) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 42 and name HD1#) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 42 and name HD2#) 1.8 0.0 3.2
assign (resid 501 and name H1) (resid 42 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H4') (resid 76 and name HB#) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 76 and name HA) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 76 and name HB#) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 76 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 77 and name HD1) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 77 and name HE1) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 85 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 86 and name HB#) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 86 and name HB#) 1.8 0.0 3.2
assign (resid 501 and name H8) (resid 86 and name HN) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 87 and name HB#) 1.8 0.0 3.2
assign (resid 501 and name H1') (resid 87 and name HN) 1.8 0.0 3.2
assign (residue 502 and name H1') (residue 502 and name H8) 1.8 0.0 3.2
assign (residue 502 and name H2') (residue 502 and name H8) 1.8 0.0 3.2
assign (residue 502 and name H3') (residue 502 and name H8) 1.8 0.0 3.2
assign (residue 502 and name H4') (residue 502 and name H5'') 1.8 0 4.2
assign (residue 502 and name H4') (residue 502 and name H5') 1.8 0 4.2
assign (residue 502 and name H5'') (residue 502 and name H3') 1.8 0 4.2
assign (residue 502 and name H5'') (residue 502 and name H8) 1.8 0 4.2
assign (residue 502 and name H5') (residue 502 and name H3') 1.8 0.0 3.2
assign (residue 502 and name H5') (residue 502 and name H8) 1.8 0 4.2
assign (residue 502 and name H1') (residue 503 and name H1) 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 503 and name H1') 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 503 and name H2') 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 503 and name H3') 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 503 and name H4') 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 503 and name H8) 1.8 0.0 3.2
assign (residue 502 and name H2') (residue 503 and name H1) 1.8 0.0 3.2
assign (residue 502 and name H2') (residue 503 and name H21) 1.8 0.0 3.2
assign (residue 502 and name H21) (residue 503 and name H2') 1.8 0.0 3.2
assign (residue 502 and name H21) (residue 503 and name H3') 1.8 0.0 3.2
assign (residue 502 and name H3') (residue 503 and name H1) 1.8 0.0 3.2
assign (residue 502 and name H3') (residue 503 and name H21) 1.8 0.0 3.2
assign (residue 502 and name H5'') (residue 503 and name H1) 1.8 0.0 4.2
assign (residue 502 and name H5') (residue 503 and name H1) 1.8 0.0 4.2
assign (residue 502 and name H8) (residue 503 and name H1) 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 504 and name H3') 1.8 0.0 3.2
assign (residue 502 and name H1) (residue 504 and name H8) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HA) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HB#) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HB2) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HD1) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HD2) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HE) 1.8 0.0 3.2
assign (resid 502 and name H1') (resid 8 and name HG#) 1.8 0.0 3.2
assign (resid 502 and name H1) (resid 8 and name HE) 4.0 0.0 5.2
assign (resid 502 and name H21) (resid 8 and name HE) 1.8 0.0 3.2
assign (resid 502 and name H4') (resid 8 and name HB#) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 8 and name HA) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 8 and name HB1) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 8 and name HB2) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 8 and name HE) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 9 and name HD1) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 9 and name HD2) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 9 and name HE) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 9 and name HG1) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 9 and name HG2) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 9 and name HN) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 10 and name HE) 1.8 0.0 3.2
assign (resid 502 and name H8) (resid 10 and name HN) 1.8 0.0 3.2
assign (resid 502 and name H2') (resid 77 and name HD1) 1.8 0.0 3.2
assign (resid 502 and name H3') (resid 77 and name HE1) 1.8 0.0 4.2
assign (residue 503 and name H1') (residue 503 and name H8) 1.8 0.0 3.2
assign (residue 503 and name H2') (residue 503 and name H8) 1.8 0.0 3.2
assign (residue 503 and name H3') (residue 503 and name H5'') 1.8 0 4.2
assign (residue 503 and name H3') (residue 503 and name H5') 1.8 0 4.2
assign (residue 503 and name H3') (residue 503 and name H8) 1.8 0.0 3.2
assign (residue 503 and name H4') (residue 503 and name H5'') 1.8 0 4.2
assign (residue 503 and name H4') (residue 503 and name H5') 1.8 0 4.2
assign (residue 503 and name H4') (residue 503 and name H8) 1.8 0.0 3.2
assign (residue 503 and name H5'') (residue 503 and name H8) 1.8 0 4.2
assign (residue 503 and name H5') (residue 503 and name H8) 1.8 0 4.2
assign (residue 503 and name H2') (residue 504 and name H3') 1.8 0.0 3.2
assign (residue 503 and name H3') (residue 504 and name H8) 1.8 0.0 3.2
assign (residue 503 and name H4') (residue 504 and name H3') 1.8 0.0 3.2
assign (residue 503 and name H8) (residue 504 and name H3') 1.8 0.0 3.2
assign (resid 503 and name H3') (resid 9 and name HE) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 9 and name HD#) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 9 and name HE) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 9 and name HH11) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 13 and name HH*) 1.8 0.0 2.2
assign (resid 503 and name H1') (resid 42 and name HD1#) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 42 and name HD2#) 1.8 0.0 3.2
assign (resid 503 and name H4') (resid 42 and name HD*) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 42 and name HD1#) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 42 and name HD2#) 1.8 0.0 3.2
assign (resid 503 and name H1) (resid 76 and name HB#) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 77 and name HE3) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 77 and name HH2) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 77 and name HZ2) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 77 and name HZ3) 1.8 0.0 3.2
assign (resid 503 and name H1) (resid 77 and name HB1) 1.8 0.0 3.2
assign (resid 503 and name H1) (resid 77 and name HB2) 1.8 0.0 3.2
assign (resid 503 and name H1) (resid 77 and name HD1) 1.8 0.0 3.2
assign (resid 503 and name H1) (resid 77 and name HE1) 1.8 0.0 3.2
assign (resid 503 and name H21) (resid 77 and name HE1) 1.8 0.0 4.2
assign (resid 503 and name H4') (resid 77 and name HH2) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 77 and name HE1) 1.8 0.0 3.2
assign (resid 503 and name H8) (resid 77 and name HH2) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 79 and name HB1) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 79 and name HB2) 1.8 0.0 3.2
assign (resid 503 and name H1') (resid 79 and name HG#) 1.8 0.0 3.2
assign (resid 503 and name H4') (resid 79 and name HB#) 1.8 0.0 3.2
assign (resid 503 and name H4') (resid 79 and name HD#) 1.8 0.0 3.2
assign (residue 504 and name H1') (residue 504 and name H5'') 1.8 0 4.2
assign (residue 504 and name H1') (residue 504 and name H5') 1.8 0 4.2
assign (residue 504 and name H1') (residue 504 and name H8) 1.8 0.0 3.2
assign (residue 504 and name H3') (residue 504 and name H8) 1.8 0.0 3.2
assign (residue 504 and name H4') (residue 504 and name H5'') 1.8 0 4.2
assign (residue 504 and name H4') (residue 504 and name H5') 1.8 0 4.2
assign (residue 504 and name H4') (residue 504 and name H8) 1.8 0.0 3.2
assign (residue 504 and name H5'') (residue 504 and name H3') 1.8 0 4.2
assign (residue 504 and name H5'') (residue 504 and name H8) 1.8 0 4.2
assign (residue 504 and name H5') (residue 504 and name H3') 1.8 0 4.2
assign (residue 504 and name H5') (residue 504 and name H8) 1.8 0 4.2
assign (resid 504 and name H1') (resid 5 and name HA) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 5 and name HA) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 5 and name HB1) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 5 and name HB2) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 5 and name HD2) 1.8 0.0 3.2
assign (resid 504 and name H1') (resid 7 and name HB#) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 7 and name HA) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 7 and name HB#) 5.0 3.9 0
assign (resid 504 and name H1) (resid 7 and name HG#) 5.0 3.9 0
assign (resid 504 and name H1) (resid 8 and name HN) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 8 and name HD#) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 8 and name HE) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 9 and name HB1) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 9 and name HB2) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 9 and name HD1) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 9 and name HD2) 1.8 0.0 3.2
assign (resid 504 and name H1) (resid 9 and name HN) 1.8 0.0 3.2
assign (resid 504 and name H3') (resid 9 and name HE) 1.8 0.0 3.2
assign (resid 504 and name H8) (resid 9 and name HE) 1.8 0.0 3.2
assign (resid 1 and name HA) (resid 2 and name HN) 3.5 1.6 0.0
assign (resid 2 and name HB#) (resid 2 and name HN) 4.2 2.5 0.0
assign (resid 2 and name HA) (resid 3 and name HN) 4.4 2.6 0.0
assign (resid 2 and name HA) (resid 4 and name HN) 5.0 3.2 0.0
assign (resid 2 and name HB#) (resid 4 and name HN) 5.0 3.2 0.0
assign (resid 3 and name HA) (resid 3 and name HN) 5.1 3.3 0.0
assign (resid 3 and name HB#) (resid 3 and name HN) 4.9 3.1 0.0
assign (resid 3 and name HA) (resid 4 and name HN) 4.5 2.7 0.0
assign (resid 3 and name HB#) (resid 4 and name HN) 5.7 3.9 0.0
assign (resid 3 and name HN) (resid 4 and name HB#) 6.0 4.2 0.0
assign (resid 3 and name HN) (resid 4 and name HG#) 6.0 4.2 0.0
assign (resid 3 and name HN) (resid 4 and name HN) 5.0 3.2 0.0
assign (resid 4 and name HA) (resid 4 and name HN) 4.8 3.0 0.0
assign (resid 4 and name HB#) (resid 4 and name HN) 4.8 3.0 0.0
assign (resid 4 and name HE21) (resid 4 and name HA) 5.0 3.2 0.0
assign (resid 4 and name HE21) (resid 4 and name HB1) 5.0 3.2 0.0
assign (resid 4 and name HE22) (resid 4 and name HA) 5.0 3.2 0.0
assign (resid 4 and name HE22) (resid 4 and name HB1) 5.0 3.2 0.0
assign (resid 4 and name HG#) (resid 4 and name HN) 5.5 3.7 0.0
assign (resid 4 and name HA) (resid 5 and name HN) 4.2 2.4 0.0
assign (resid 4 and name HB1) (resid 5 and name HD2) 5.0 3.2 0.0
assign (resid 4 and name HB2) (resid 5 and name HD2) 5.0 3.2 0.0
assign (resid 4 and name HE21) (resid 6 and name HB#) 5.0 3.2 0.0
assign (resid 4 and name HE22) (resid 6 and name HB#) 5.0 3.2 0.0
assign (resid 5 and name HD2) (resid 5 and name HA) 5.0 3.2 0.0
assign (resid 5 and name HA) (resid 6 and name HN) 3.4 1.6 0.0
assign (resid 5 and name HB#) (resid 6 and name HN) 4.3 2.5 0.0
assign (resid 6 and name HA) (resid 7 and name HA) 5.0 3.0 0.0
assign (resid 6 and name HA) (resid 7 and name HN) 5.0 3.2 0.0
assign (resid 6 and name HB1) (resid 7 and name HN) 4.7 2.9 0.0
assign (resid 6 and name HB2) (resid 7 and name HN) 4.8 3.0 0.0
assign (resid 7 and name HA) (resid 7 and name HN) 4.8 3.0 0.0
assign (resid 7 and name HG#) (resid 8 and name HN) 4.6 2.8 0.0
assign (resid 7 and name HN) (resid 8 and name HG#) 6.0 4.2 0.0
assign (resid 7 and name HA) (resid 9 and name HN) 5.0 3.0 0.0
assign (resid 7 and name HB1) (resid 9 and name HN) 5.0 3.0 0.0
assign (resid 7 and name HB2) (resid 9 and name HN) 5.0 3.0 0.0
assign (resid 7 and name HG#) (resid 9 and name HN) 5.0 3.2 0.0
assign (resid 7 and name HG1) (resid 9 and name HN) 5.0 3.0 0.0
assign (resid 7 and name HG2) (resid 9 and name HN) 5.0 3.0 0.0
assign (resid 8 and name HA) (resid 8 and name HE) 1.8 0.0 3.2
assign (resid 8 and name HA) (resid 8 and name HN) 3.9 2.1 0.0
assign (resid 8 and name HD1) (resid 8 and name HE) 1.8 0.0 3.0
assign (resid 8 and name HD2) (resid 8 and name HE) 1.8 0.0 3.0
assign (resid 8 and name HN) (resid 8 and name HE) 1.8 0.0 3.2
assign (resid 8 and name HB#) (resid 9 and name HN) 5.0 3.0 0.0
assign (resid 8 and name HD#) (resid 9 and name HN) 4.7 2.9 0.0
assign (resid 8 and name HE) (resid 9 and name HE) 4.0 0.0 5.2
assign (resid 8 and name HE) (resid 9 and name HN) 4.5 2.7 0.0
assign (resid 8 and name HH11) (resid 9 and name HE) 1.8 0.0 3.2
assign (resid 8 and name HN) (resid 9 and name HN) 3.8 1.9 0.0
assign (resid 9 and name HA) (resid 10 and name HD#) 3.3 1.5 0.0
assign (resid 9 and name HA) (resid 11 and name HN) 5.0 3.0 0.0
assign (resid 9 and name HD1) (resid 13 and name HD#) 5.0 3.0 0.0
assign (resid 9 and name HD2) (resid 13 and name HD#) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 10 and name HB1) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 10 and name HB2) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 10 and name HD1) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 10 and name HD2) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 10 and name HG1) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 10 and name HG2) 5.0 3.0 0.0
assign (resid 10 and name HN) (resid 10 and name HB1) 5.0 3.0 0.0
assign (resid 10 and name HN) (resid 10 and name HB2) 5.0 3.0 0.0
assign (resid 10 and name HN) (resid 10 and name HD#) 5.0 3.0 0.0
assign (resid 10 and name HN) (resid 10 and name HE) 1.8 0.0 3.2
assign (resid 10 and name HN) (resid 10 and name HG1) 5.0 3.0 0.0
assign (resid 10 and name HN) (resid 10 and name HG2) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 11 and name HD#) 5.0 3.0 0.0
assign (resid 10 and name HA) (resid 11 and name HN) 5.0 3.0 0.0
assign (resid 10 and name HB#) (resid 11 and name HN) 5.2 3.0 0.0
assign (resid 10 and name HG#) (resid 11 and name HN) 5.2 3.0 0.0
assign (resid 10 and name HN) (resid 11 and name HN) 5.0 3.0 0.0
assign (resid 11 and name HA) (resid 11 and name HD#) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 12 and name HD2) 5.0 3.0 0.0
assign (resid 11 and name HD#) (resid 118 and name HB#) 5.0 3.0 0.0
assign (resid 11 and name HD#) (resid 118 and name HD*) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 118 and name HB1) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 118 and name HB2) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 118 and name HD*) 5.0 3.0 0.0
assign (resid 11 and name HZ) (resid 118 and name HB1) 5.0 3.0 0.0
assign (resid 11 and name HZ) (resid 118 and name HB2) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 119 and name HA) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 119 and name HD1#) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 119 and name HD2#) 5.0 3.0 0.0
assign (resid 11 and name HE#) (resid 119 and name HG) 5.0 3.0 0.0
assign (resid 11 and name HZ) (resid 119 and name HA) 5.0 3.0 0.0
assign (resid 11 and name HZ) (resid 119 and name HD1#) 5.0 3.0 0.0
assign (resid 11 and name HZ) (resid 119 and name HD2#) 5.0 3.0 0.0
assign (resid 12 and name HD2) (resid 118 and name HD*) 5.0 3.0 0.0
assign (resid 12 and name HE1) (resid 118 and name HD*) 5.0 3.0 0.0
assign (resid 13 and name HH*) (resid 13 and name HD1) 1.8 0.0 3.2
assign (resid 13 and name HH*) (resid 13 and name HD2) 1.8 0.0 3.2
assign (resid 13 and name HH*) (resid 13 and name HG1) 1.8 0.0 3.2
assign (resid 13 and name HH*) (resid 13 and name HG2) 1.8 0.0 3.2
assign (resid 13 and name HB1) (resid 36 and name HA) 1.8 0.0 3.2
assign (resid 13 and name HB2) (resid 36 and name HA) 1.8 0.0 3.2
assign (resid 13 and name HB#) (resid 37 and name HB#) 1.8 0.0 3.2
assign (resid 14 and name HA) (resid 15 and name HB#) 5.1 3.3 0.0
assign (resid 14 and name HA) (resid 15 and name HN) 3.8 2.0 0.0
assign (resid 14 and name HB) (resid 15 and name HN) 4.4 2.6 0.0
assign (resid 14 and name HD1#) (resid 15 and name HN) 4.6 2.8 0.0
assign (resid 14 and name HG2#) (resid 15 and name HB#) 5.4 3.6 0.0
assign (resid 14 and name HG2#) (resid 15 and name HN) 4.9 3.1 0.0
assign (resid 14 and name HG2#) (resid 16 and name HB#) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 16 and name HD#) 5.0 3.0 0.0
assign (resid 14 and name HG2#) (resid 16 and name HE#) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 16 and name HN) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 16 and name HZ) 5.0 3.2 0.0
assign (resid 14 and name HA) (resid 36 and name HN) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 36 and name HG*) 5.0 3.2 0.0
assign (resid 14 and name HN) (resid 36 and name HG*) 5.0 3.2 0.0
assign (resid 14 and name HN) (resid 36 and name HN) 5.0 3.2 0.0
assign (resid 14 and name HN) (resid 37 and name HB#) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 14 and name HG1#) (resid 102 and name HA) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 102 and name HA) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 102 and name HG*) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 105 and name HB#) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 105 and name HD2#) 5.0 3.2 0.0
assign (resid 14 and name HG2#) (resid 105 and name HN) 5.0 3.2 0.0
assign (resid 15 and name HB#) (resid 15 and name HN) 3.9 2.1 0.0
assign (resid 15 and name HA) (resid 16 and name HN) 3.3 1.5 0.0
assign (resid 15 and name HB#) (resid 16 and name HN) 3.9 2.1 0.0
assign (resid 15 and name HN) (resid 16 and name HN) 5.0 3.0 0.0
assign (resid 15 and name HB#) (resid 17 and name HN) 5.5 3.2 0.0
assign (resid 15 and name HA) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 15 and name HA) (resid 35 and name HA) 5.0 3.2 0.0
assign (resid 15 and name HA) (resid 35 and name HB#) 5.0 3.2 0.0
assign (resid 15 and name HA) (resid 35 and name HB1) 1.8 0.0 3.2
assign (resid 15 and name HA) (resid 35 and name HB2) 1.8 0.0 3.2
assign (resid 15 and name HB#) (resid 35 and name HA) 5.0 3.2 0.0
assign (resid 15 and name HA) (resid 36 and name HN) 5.0 3.2 0.0
assign (resid 16 and name HA) (resid 17 and name HN) 4.5 2.7 0.0
assign (resid 16 and name HB#) (resid 17 and name HN) 4.9 3.1 0.0
assign (resid 16 and name HD#) (resid 17 and name HA) 5.0 3.0 0.0
assign (resid 16 and name HD#) (resid 17 and name HN) 5.1 3.3 0.0
assign (resid 16 and name HN) (resid 17 and name HN) 5.3 3.5 0.0
assign (resid 16 and name HD#) (resid 18 and name HB#) 5.0 3.0 0.0
assign (resid 16 and name HE#) (resid 18 and name HB#) 5.0 3.0 0.0
assign (resid 16 and name HZ) (resid 18 and name HB#) 5.0 3.2 0.0
assign (resid 16 and name HB#) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HD#) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HN) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HN) (resid 35 and name HA) 5.0 3.2 0.0
assign (resid 16 and name HN) (resid 35 and name HB1) 3.2 0.5 1.0
assign (resid 16 and name HN) (resid 35 and name HB2) 3.2 0.2 1.0
assign (resid 16 and name HB#) (resid 36 and name HG*) 5.0 3.2 0.0
assign (resid 16 and name HD#) (resid 36 and name HB) 5.0 3.0 0.0
assign (resid 16 and name HD#) (resid 36 and name HG*) 5.0 3.2 0.0
assign (resid 16 and name HE#) (resid 36 and name HG#) 5.0 3.0 0.0
assign (resid 16 and name HN) (resid 36 and name HG*) 5.0 3.2 0.0
assign (resid 16 and name HN) (resid 36 and name HN) 5.0 3.2 0.0
assign (resid 16 and name HE#) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HD#) (resid 63 and name HD*) 5.0 3.0 0.0
assign (resid 16 and name HD#) (resid 63 and name HG) 5.0 3.2 0.0
assign (resid 16 and name HE#) (resid 63 and name HA) 5.0 3.2 0.0
assign (resid 16 and name HE#) (resid 63 and name HB#) 5.0 3.2 0.0
assign (resid 16 and name HE#) (resid 63 and name HD*) 5.0 3.0 0.0
assign (resid 16 and name HE#) (resid 63 and name HG) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 63 and name HB#) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 63 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 63 and name HG) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 98 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HB#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HD#) (resid 101 and name HB#) 5.0 3.2 0.0
assign (resid 16 and name HD#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HE#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 101 and name HB#) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 16 and name HZ) (resid 101 and name HG) 5.0 3.2 0.0
assign (resid 17 and name HA) (resid 17 and name HN) 4.5 2.7 0.0
assign (resid 17 and name HB#) (resid 17 and name HN) 4.2 2.4 0.0
assign (resid 17 and name HA) (resid 18 and name HA) 5.2 3.4 0.0
assign (resid 17 and name HA) (resid 18 and name HB#) 6.0 4.2 0.0
assign (resid 17 and name HA) (resid 18 and name HN) 3.5 1.8 0.0
assign (resid 17 and name HB#) (resid 18 and name HA) 5.4 3.6 0.0
assign (resid 17 and name HB#) (resid 18 and name HB#) 6.0 4.2 0.0
assign (resid 17 and name HB#) (resid 18 and name HN) 4.8 3.0 0.0
assign (resid 17 and name HN) (resid 18 and name HB#) 6.0 4.2 0.0
assign (resid 17 and name HN) (resid 18 and name HN) 4.9 3.1 0.0
assign (resid 18 and name HB#) (resid 18 and name HN) 4.4 2.6 0.0
assign (resid 18 and name HA) (resid 19 and name HB1) 5.5 3.7 0.0
assign (resid 18 and name HA) (resid 19 and name HB2) 5.6 3.8 0.0
assign (resid 18 and name HA) (resid 19 and name HN) 3.5 1.8 0.0
assign (resid 18 and name HB#) (resid 19 and name HB1) 5.6 2.8 0.0
assign (resid 18 and name HB#) (resid 19 and name HB2) 6.0 4.2 0.0
assign (resid 18 and name HB#) (resid 19 and name HN) 4.3 2.5 0.0
assign (resid 18 and name HN) (resid 19 and name HN) 5.2 3.4 0.0
assign (resid 18 and name HB#) (resid 20 and name HB#) 5.0 3.2 0.0
assign (resid 18 and name HA) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 18 and name HB#) (resid 33 and name HB#) 5.0 3.2 0.0
assign (resid 18 and name HB#) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 18 and name HN) (resid 33 and name HB#) 5.0 3.2 0.0
assign (resid 18 and name HN) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 18 and name HN) (resid 33 and name HN) 3.8 2.0 0.0
assign (resid 18 and name HB#) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 18 and name HB#) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 18 and name HB#) (resid 62 and name HN) 5.0 3.2 0.0
assign (resid 18 and name HB#) (resid 63 and name HD*) 5.0 3.2 0.0
assign (resid 18 and name HB#) (resid 63 and name HN) 5.0 3.2 0.0
assign (resid 19 and name HA) (resid 19 and name HN) 4.5 2.7 0.0
assign (resid 19 and name HB2) (resid 19 and name HN) 4.2 2.4 0.0
assign (resid 19 and name HA) (resid 20 and name HN) 2.7 0.9 0.0
assign (resid 19 and name HB1) (resid 20 and name HN) 5.0 3.2 0.0
assign (resid 19 and name HB2) (resid 20 and name HN) 5.1 3.3 0.0
assign (resid 19 and name HN) (resid 20 and name HN) 4.8 3.0 0.0
assign (resid 19 and name HA) (resid 32 and name HA) 2.8 1.0 0.0
assign (resid 19 and name HA) (resid 33 and name HN) 3.7 1.9 0.0
assign (resid 19 and name HB1) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 19 and name HB2) (resid 62 and name HB#) 5.0 3.2 0.0
assign (resid 19 and name HB2) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 19 and name HN) (resid 62 and name HB#) 5.0 3.2 0.0
assign (resid 19 and name HN) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 19 and name HN) (resid 63 and name HA) 4.7 1.9 0.0
assign (resid 20 and name HA) (resid 20 and name HN) 4.3 2.5 0.0
assign (resid 20 and name HB#) (resid 20 and name HN) 4.4 2.6 0.0
assign (resid 20 and name HA) (resid 21 and name HG#) 4.5 2.7 0.0
assign (resid 20 and name HA) (resid 21 and name HN) 2.7 0.9 0.0
assign (resid 20 and name HB#) (resid 21 and name HA) 4.6 2.8 0.0
assign (resid 20 and name HB#) (resid 21 and name HG#) 5.7 3.9 0.0
assign (resid 20 and name HB#) (resid 21 and name HN) 5.0 3.2 0.0
assign (resid 20 and name HN) (resid 21 and name HG#) 6.0 4.2 0.0
assign (resid 20 and name HB#) (resid 22 and name HG1#) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 31 and name HN) 5.0 3.2 0.0
assign (resid 20 and name HN) (resid 31 and name HN) 3.8 2.0 0.0
assign (resid 20 and name HB#) (resid 32 and name HA) 5.0 3.2 0.0
assign (resid 20 and name HN) (resid 32 and name HA) 3.7 1.9 0.0
assign (resid 20 and name HB#) (resid 33 and name HA) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 33 and name HB#) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 33 and name HD*) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 33 and name HG) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 33 and name HN) 5.0 3.2 0.0
assign (resid 20 and name HN) (resid 33 and name HA) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 41 and name HG1#) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 20 and name HA) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 20 and name HA) (resid 61 and name HA) 2.8 1.0 0.0
assign (resid 20 and name HA) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 61 and name HB1) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 61 and name HB2) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 20 and name HA) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 20 and name HA) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 20 and name HA) (resid 62 and name HN) 3.7 1.9 0.0
assign (resid 20 and name HB#) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 20 and name HB#) (resid 62 and name HN) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 21 and name HN) 4.5 2.7 0.0
assign (resid 21 and name HG#) (resid 21 and name HN) 4.6 2.8 0.0
assign (resid 21 and name HA) (resid 22 and name HB) 4.3 2.5 0.0
assign (resid 21 and name HA) (resid 22 and name HG1#) 4.7 2.9 0.0
assign (resid 21 and name HA) (resid 22 and name HN) 2.7 0.9 0.0
assign (resid 21 and name HB#) (resid 22 and name HN) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 22 and name HN) 4.7 2.9 0.0
assign (resid 21 and name HN) (resid 22 and name HN) 4.8 3.0 0.0
assign (resid 21 and name HB#) (resid 23 and name HD*) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 23 and name HD*) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 23 and name HD*) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 28 and name HE) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 28 and name HD#) 5.0 3.2 0.0
assign (resid 21 and name HA) (resid 30 and name HA) 2.8 1.0 0.0
assign (resid 21 and name HA) (resid 30 and name HN) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 30 and name HB#) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 30 and name HG#) 5.0 3.2 0.0
assign (resid 21 and name HA) (resid 31 and name HG1#) 5.0 3.2 0.0
assign (resid 21 and name HA) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 21 and name HA) (resid 31 and name HN) 3.7 1.9 0.0
assign (resid 21 and name HB#) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 31 and name HN) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 60 and name HG#) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 60 and name HB1) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 60 and name HB1) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 60 and name HB2) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 60 and name HN) 3.8 2.0 0.0
assign (resid 21 and name HN) (resid 61 and name HA) 3.7 1.9 0.0
assign (resid 21 and name HN) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 21 and name HB#) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 21 and name HG#) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 62 and name HD#) 5.0 3.2 0.0
assign (resid 21 and name HN) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 22 and name HN) 3.9 2.1 0.0
assign (resid 22 and name HA) (resid 23 and name HD*) 4.9 3.1 0.0
assign (resid 22 and name HA) (resid 23 and name HG) 4.5 2.8 0.0
assign (resid 22 and name HA) (resid 23 and name HN) 2.7 0.9 0.0
assign (resid 22 and name HB) (resid 23 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 23 and name HD*) 5.1 3.3 0.0
assign (resid 22 and name HD1#) (resid 23 and name HN) 5.5 3.6 0.0
assign (resid 22 and name HG1#) (resid 23 and name HN) 4.7 2.9 0.0
assign (resid 22 and name HG2#) (resid 23 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 23 and name HN) 4.0 2.2 0.0
assign (resid 22 and name HN) (resid 23 and name HD*) 5.3 3.5 0.0
assign (resid 22 and name HN) (resid 23 and name HN) 4.8 3.0 0.0
assign (resid 22 and name HG2#) (resid 24 and name HN) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 28 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 28 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 29 and name HB#) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 29 and name HE3) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 29 and name HN) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 29 and name HE3) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 29 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 29 and name HB#) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 29 and name HN) 3.8 2.0 0.0
assign (resid 22 and name HN) (resid 30 and name HA) 3.7 1.9 0.0
assign (resid 22 and name HA) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 31 and name HG1#) 5.0 3.2 0.0
assign (resid 22 and name HB) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 22 and name HG1#) (resid 31 and name HG1#) 5.0 3.2 0.0
assign (resid 22 and name HG1#) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 31 and name HG1#) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 31 and name HG1#) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 31 and name HG2#) 5.0 3.2 0.0
assign (resid 22 and name HN) (resid 31 and name HN) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 22 and name HG1#) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 22 and name HD#) (resid 49 and name HH2) 5.0 3.0 0.0
assign (resid 22 and name HG2#) (resid 49 and name HH2) 5.0 3.0 0.0
assign (resid 22 and name HG2#) (resid 49 and name HZ2) 5.0 3.0 0.0
assign (resid 22 and name HG2#) (resid 49 and name HZ3) 5.0 3.0 0.0
assign (resid 22 and name HD1#) (resid 57 and name HB2) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 57 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 57 and name HB1) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 57 and name HB2) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 57 and name HD#) 5.8 3.0 0.0
assign (resid 22 and name HG2#) (resid 58 and name HN) 5.0 3.2 0.0
assign (resid 22 and name HA) (resid 59 and name HA) 2.8 1.0 0.0
assign (resid 22 and name HD1#) (resid 59 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 59 and name HA) 5.0 3.2 0.0
assign (resid 22 and name HA) (resid 60 and name HN) 3.7 1.9 0.0
assign (resid 22 and name HD1#) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 22 and name HG1#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 22 and name HG2#) (resid 75 and name HD*) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 22 and name HD1#) (resid 85 and name HZ) 5.0 3.2 0.0
assign (resid 23 and name HB#) (resid 23 and name HN) 3.8 2.0 0.0
assign (resid 23 and name HA) (resid 24 and name HN) 2.7 0.9 0.0
assign (resid 23 and name HB#) (resid 24 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 24 and name HN) 4.8 3.0 0.0
assign (resid 23 and name HG) (resid 24 and name HN) 4.6 2.8 0.0
assign (resid 23 and name HN) (resid 24 and name HN) 4.8 3.0 0.0
assign (resid 23 and name HA) (resid 27 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HA) (resid 28 and name HA) 2.8 1.0 0.0
assign (resid 23 and name HA) (resid 28 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HA) (resid 28 and name HG#) 5.0 3.2 0.0
assign (resid 23 and name HA) (resid 28 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HB#) (resid 28 and name HA) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 28 and name HA) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 28 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 28 and name HD#) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 28 and name HG#) 5.0 3.2 0.0
assign (resid 23 and name HG) (resid 28 and name HA) 5.0 3.2 0.0
assign (resid 23 and name HG) (resid 28 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HG) (resid 28 and name HD#) 5.0 3.2 0.0
assign (resid 23 and name HG) (resid 28 and name HG#) 5.0 3.2 0.0
assign (resid 23 and name HA) (resid 29 and name HE3) 5.0 3.2 0.0
assign (resid 23 and name HA) (resid 29 and name HN) 3.7 1.9 0.0
assign (resid 23 and name HA) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 23 and name HB#) (resid 29 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HB#) (resid 58 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HB#) (resid 58 and name HG#) 5.0 3.2 0.0
assign (resid 23 and name HB#) (resid 58 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 58 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 58 and name HG#) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 58 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HG) (resid 58 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HN) (resid 58 and name HB#) 5.0 3.2 0.0
assign (resid 23 and name HN) (resid 58 and name HN) 3.8 2.0 0.0
assign (resid 23 and name HD*) (resid 59 and name HA) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 59 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HG) (resid 59 and name HA) 5.0 3.2 0.0
assign (resid 23 and name HN) (resid 59 and name HA) 3.7 1.9 0.0
assign (resid 23 and name HD*) (resid 60 and name HD#) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 60 and name HG#) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 23 and name HD*) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 24 and name HA) (resid 25 and name HA#) 5.0 3.2 0.0
assign (resid 24 and name HA) (resid 25 and name HN) 4.0 2.2 0.0
assign (resid 24 and name HG#) (resid 25 and name HN) 3.8 2.0 0.0
assign (resid 24 and name HN) (resid 25 and name HN) 5.1 3.3 0.0
assign (resid 24 and name HB#) (resid 27 and name HB1) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 27 and name HA) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 27 and name HB1) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 27 and name HB2) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 27 and name HN) 3.8 2.0 0.0
assign (resid 24 and name HN) (resid 28 and name HA) 3.7 1.9 0.0
assign (resid 24 and name HN) (resid 28 and name HB#) 5.0 3.2 0.0
assign (resid 24 and name HB#) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 24 and name HB#) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 24 and name HG#) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 29 and name HN) 5.0 3.2 0.0
assign (resid 24 and name HN) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 50 and name HD2#) 5.0 3.0 0.0
assign (resid 24 and name HE2#) (resid 52 and name HB#) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 52 and name HN) 5.0 3.2 0.0
assign (resid 24 and name HG#) (resid 52 and name HN) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 53 and name HA) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 54 and name HN) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 55 and name HB#) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 55 and name HD#) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 55 and name HG#) 5.0 3.2 0.0
assign (resid 24 and name HE2#) (resid 55 and name HN) 5.0 3.2 0.0
assign (resid 24 and name HA) (resid 57 and name HA) 2.8 1.0 0.0
assign (resid 24 and name HE2#) (resid 57 and name HD#) 5.8 3.0 0.0
assign (resid 24 and name HE2#) (resid 57 and name HZ) 5.0 3.0 0.0
assign (resid 24 and name HG#) (resid 57 and name HA) 5.0 3.2 0.0
assign (resid 24 and name HA) (resid 58 and name HN) 3.7 1.9 0.0
assign (resid 25 and name HA#) (resid 26 and name HA) 4.0 2.2 0.0
assign (resid 25 and name HA#) (resid 26 and name HG#) 3.9 2.1 0.0
assign (resid 25 and name HA#) (resid 26 and name HN) 3.4 1.6 0.0
assign (resid 25 and name HA#) (resid 27 and name HN) 5.0 3.2 0.0
assign (resid 26 and name HA) (resid 26 and name HN) 4.5 2.7 0.0
assign (resid 26 and name HB2) (resid 26 and name HN) 4.1 2.3 0.0
assign (resid 26 and name HA) (resid 27 and name HN) 5.1 3.3 0.0
assign (resid 26 and name HB1) (resid 27 and name HD#) 5.7 3.9 0.0
assign (resid 26 and name HB1) (resid 27 and name HG#) 5.5 3.7 0.0
assign (resid 26 and name HB1) (resid 27 and name HN) 5.7 3.9 0.0
assign (resid 26 and name HB2) (resid 27 and name HA) 5.0 3.2 0.0
assign (resid 26 and name HB2) (resid 27 and name HG#) 5.2 3.4 0.0
assign (resid 26 and name HB2) (resid 27 and name HN) 4.9 3.1 0.0
assign (resid 26 and name HG#) (resid 27 and name HA) 5.1 3.3 0.0
assign (resid 26 and name HG#) (resid 27 and name HN) 6.0 4.2 0.0
assign (resid 26 and name HN) (resid 27 and name HN) 4.0 2.2 0.0
assign (resid 27 and name HA) (resid 27 and name HN) 4.4 2.6 0.0
assign (resid 27 and name HB2) (resid 27 and name HN) 4.0 2.2 0.0
assign (resid 27 and name HG#) (resid 27 and name HN) 4.7 2.9 0.0
assign (resid 27 and name HA) (resid 28 and name HA) 4.8 3.0 0.0
assign (resid 27 and name HA) (resid 28 and name HB#) 4.5 2.7 0.0
assign (resid 27 and name HA) (resid 28 and name HN) 2.7 0.9 0.0
assign (resid 27 and name HB1) (resid 28 and name HB#) 5.5 3.7 0.0
assign (resid 27 and name HB1) (resid 28 and name HN) 4.0 2.1 0.0
assign (resid 27 and name HB2) (resid 28 and name HN) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 28 and name HN) 5.1 3.3 0.0
assign (resid 27 and name HG#) (resid 28 and name HN) 4.8 3.0 0.0
assign (resid 27 and name HN) (resid 28 and name HN) 4.8 3.0 0.0
assign (resid 27 and name HB1) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 27 and name HB1) (resid 29 and name HZ2) 5.0 3.2 0.0
assign (resid 27 and name HB2) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 27 and name HB2) (resid 29 and name HZ2) 5.0 3.2 0.0
assign (resid 27 and name HB2) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 29 and name HZ2) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 29 and name HZ3) 5.0 3.2 0.0
assign (resid 27 and name HG#) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 27 and name HG#) (resid 29 and name HZ2) 5.0 3.2 0.0
assign (resid 27 and name HN) (resid 29 and name HH2) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 50 and name HD2#) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 50 and name HN) 5.0 3.2 0.0
assign (resid 27 and name HD#) (resid 51 and name HA#) 5.0 3.2 0.0
assign (resid 28 and name HA) (resid 28 and name HN) 4.5 2.7 0.0
assign (resid 28 and name HB#) (resid 28 and name HN) 4.2 2.4 0.0
assign (resid 28 and name HD#) (resid 28 and name HE) 3.7 1.9 0.0
assign (resid 28 and name HA) (resid 29 and name HB#) 4.0 2.2 0.0
assign (resid 28 and name HA) (resid 29 and name HE3) 3.8 2.0 0.0
assign (resid 28 and name HA) (resid 29 and name HN) 2.7 0.9 0.0
assign (resid 28 and name HB#) (resid 29 and name HA) 4.8 3.0 0.0
assign (resid 28 and name HB#) (resid 29 and name HN) 5.0 3.2 0.0
assign (resid 28 and name HD#) (resid 29 and name HN) 6.0 4.2 0.0
assign (resid 28 and name HG#) (resid 29 and name HN) 4.7 2.9 0.0
assign (resid 28 and name HN) (resid 29 and name HN) 4.8 3.0 0.0
assign (resid 28 and name HG#) (resid 30 and name HG#) 5.0 3.2 0.0
assign (resid 28 and name HG#) (resid 30 and name HN) 5.0 3.2 0.0
assign (resid 28 and name HE) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 29 and name HA) (resid 30 and name HB#) 5.5 3.7 0.0
assign (resid 29 and name HA) (resid 30 and name HG#) 5.0 3.2 0.0
assign (resid 29 and name HA) (resid 30 and name HN) 2.7 0.9 0.0
assign (resid 29 and name HB#) (resid 30 and name HA) 5.0 3.0 0.0
assign (resid 29 and name HD1) (resid 30 and name HN) 5.5 3.7 0.0
assign (resid 29 and name HN) (resid 30 and name HN) 4.8 3.0 0.0
assign (resid 29 and name HB#) (resid 31 and name HG1#) 5.0 3.2 0.0
assign (resid 29 and name HD1) (resid 49 and name HA) 5.0 3.0 0.0
assign (resid 29 and name HE1) (resid 49 and name HA) 5.0 3.0 0.0
assign (resid 29 and name HZ3) (resid 49 and name HH2) 5.0 3.0 0.0
assign (resid 29 and name HE1) (resid 50 and name HN) 5.0 3.2 0.0
assign (resid 29 and name HZ2) (resid 50 and name HN) 5.0 3.2 0.0
assign (resid 29 and name HH2) (resid 51 and name HA1) 5.0 3.0 0.0
assign (resid 29 and name HH2) (resid 51 and name HA2) 5.0 3.0 0.0
assign (resid 29 and name HZ2) (resid 51 and name HA1) 5.0 3.0 0.0
assign (resid 29 and name HZ2) (resid 51 and name HA2) 5.0 3.0 0.0
assign (resid 29 and name HH2) (resid 52 and name HN) 5.0 3.2 0.0
assign (resid 29 and name HH2) (resid 57 and name HD#) 5.8 3.0 0.0
assign (resid 30 and name HB#) (resid 30 and name HN) 4.2 2.4 0.0
assign (resid 30 and name HG#) (resid 30 and name HN) 4.5 2.7 0.0
assign (resid 30 and name HA) (resid 31 and name HG2#) 4.5 2.7 0.0
assign (resid 30 and name HA) (resid 31 and name HN) 2.7 0.9 0.0
assign (resid 30 and name HB#) (resid 31 and name HN) 5.0 3.2 0.0
assign (resid 30 and name HG#) (resid 31 and name HN) 5.1 3.3 0.0
assign (resid 30 and name HN) (resid 31 and name HG1#) 5.5 3.7 0.0
assign (resid 30 and name HN) (resid 31 and name HN) 4.8 3.0 0.0
assign (resid 30 and name HN) (resid 46 and name HG#) 5.0 3.2 0.0
assign (resid 31 and name HG2#) (resid 31 and name HN) 3.9 2.1 0.0
assign (resid 31 and name HA) (resid 32 and name HB#) 5.0 3.2 0.0
assign (resid 31 and name HA) (resid 32 and name HN) 2.7 0.9 0.0
assign (resid 31 and name HB) (resid 32 and name HN) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 32 and name HN) 4.1 2.3 0.0
assign (resid 31 and name HG2#) (resid 32 and name HN) 4.2 2.4 0.0
assign (resid 31 and name HN) (resid 32 and name HN) 4.8 3.0 0.0
assign (resid 31 and name HG2#) (resid 33 and name HA) 5.0 3.2 0.0
assign (resid 31 and name HG2#) (resid 33 and name HN) 5.0 3.2 0.0
assign (resid 31 and name HG2#) (resid 41 and name HD1#) 5.0 3.2 0.0
assign (resid 31 and name HB) (resid 43 and name HA) 5.0 3.2 0.0
assign (resid 31 and name HB) (resid 43 and name HB) 5.0 3.2 0.0
assign (resid 31 and name HB) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 45 and name HA) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 45 and name HN) 5.0 3.2 0.0
assign (resid 31 and name HA) (resid 46 and name HB#) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 46 and name HB#) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 46 and name HD#) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 46 and name HG#) 5.0 3.2 0.0
assign (resid 31 and name HG2#) (resid 46 and name HB#) 5.0 3.2 0.0
assign (resid 31 and name HG2#) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 31 and name HB) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 31 and name HG1#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 31 and name HG2#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 32 and name HB#) (resid 32 and name HN) 3.8 2.0 0.0
assign (resid 32 and name HA) (resid 33 and name HN) 2.7 0.9 0.0
assign (resid 32 and name HB#) (resid 33 and name HN) 5.0 3.2 0.0
assign (resid 32 and name HD*) (resid 33 and name HN) 5.2 3.4 0.0
assign (resid 32 and name HG) (resid 33 and name HN) 5.5 3.7 0.0
assign (resid 32 and name HB#) (resid 34 and name HD2) 5.0 3.2 0.0
assign (resid 32 and name HB#) (resid 34 and name HE1) 5.0 3.0 0.0
assign (resid 32 and name HD*) (resid 34 and name HD2) 5.0 3.2 0.0
assign (resid 32 and name HD1#) (resid 34 and name HE1) 5.0 3.0 0.0
assign (resid 32 and name HD2#) (resid 34 and name HE1) 5.0 3.0 0.0
assign (resid 32 and name HG) (resid 34 and name HE1) 5.0 3.0 0.0
assign (resid 32 and name HN) (resid 34 and name HD2) 5.0 3.2 0.0
assign (resid 32 and name HB#) (resid 44 and name HA#) 5.0 3.2 0.0
assign (resid 32 and name HB#) (resid 44 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HB#) (resid 33 and name HN) 3.6 1.8 0.0
assign (resid 33 and name HA) (resid 34 and name HB#) 3.9 2.1 0.0
assign (resid 33 and name HA) (resid 34 and name HD2) 5.0 3.2 0.0
assign (resid 33 and name HA) (resid 34 and name HN) 2.7 0.9 0.0
assign (resid 33 and name HB#) (resid 34 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 34 and name HN) 4.6 2.8 0.0
assign (resid 33 and name HG) (resid 34 and name HN) 3.8 2.0 0.0
assign (resid 33 and name HA) (resid 35 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 35 and name HA) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 35 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HG) (resid 35 and name HA) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 36 and name HA) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 36 and name HB) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 36 and name HG*) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 36 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HG) (resid 36 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 41 and name HB) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 41 and name HD1#) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 41 and name HG1#) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 42 and name HN) 5.0 3.2 0.0
assign (resid 33 and name HA) (resid 43 and name HA) 3.3 1.5 0.0
assign (resid 33 and name HA) (resid 43 and name HB) 5.0 3.2 0.0
assign (resid 33 and name HA) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 43 and name HA) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 43 and name HB) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 33 and name HA) (resid 44 and name HN) 3.7 1.9 0.0
assign (resid 33 and name HD*) (resid 61 and name HB1) 5.0 3.2 0.0
assign (resid 33 and name HD*) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 33 and name HG) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 34 and name HA) (resid 35 and name HN) 4.5 2.7 0.0
assign (resid 34 and name HB#) (resid 35 and name HN) 3.8 2.0 0.0
assign (resid 34 and name HD2) (resid 35 and name HN) 5.4 3.6 0.0
assign (resid 34 and name HN) (resid 35 and name HN) 3.7 1.9 0.0
assign (resid 34 and name HB#) (resid 42 and name HB#) 5.0 3.2 0.0
assign (resid 34 and name HB#) (resid 42 and name HD*) 5.0 3.2 0.0
assign (resid 34 and name HB#) (resid 42 and name HG) 5.0 3.2 0.0
assign (resid 34 and name HN) (resid 42 and name HD*) 5.0 3.2 0.0
assign (resid 34 and name HD2) (resid 43 and name HA) 5.0 3.2 0.0
assign (resid 34 and name HD2) (resid 43 and name HB) 5.0 3.2 0.0
assign (resid 34 and name HD2) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 34 and name HN) (resid 43 and name HA) 4.2 2.4 0.0
assign (resid 34 and name HN) (resid 43 and name HB) 5.0 3.2 0.0
assign (resid 34 and name HN) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 34 and name HD2) (resid 44 and name HA#) 5.0 3.2 0.0
assign (resid 34 and name HD2) (resid 44 and name HN) 5.0 3.2 0.0
assign (resid 34 and name HN) (resid 44 and name HN) 5.0 3.2 0.0
assign (resid 34 and name HB#) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 34 and name HD2) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 34 and name HE1) (resid 82 and name HD1#) 5.2 3.0 0.0
assign (resid 34 and name HE1) (resid 82 and name HD2#) 5.2 3.0 0.0
assign (resid 35 and name HB1) (resid 35 and name HN) 3.2 0.5 0.2
assign (resid 35 and name HB2) (resid 35 and name HN) 4.5 0.2 2.2
assign (resid 35 and name HA) (resid 36 and name HG*) 6.0 4.2 0.0
assign (resid 35 and name HA) (resid 36 and name HN) 2.7 0.9 0.0
assign (resid 35 and name HB#) (resid 36 and name HB) 5.3 3.5 0.0
assign (resid 35 and name HB1) (resid 36 and name HN) 1.8 0.0 2.2
assign (resid 35 and name HB2) (resid 36 and name HN) 1.8 0.0 2.2
assign (resid 35 and name HN) (resid 36 and name HG*) 6.0 4.2 0.0
assign (resid 35 and name HN) (resid 36 and name HN) 4.8 3.0 0.0
assign (resid 35 and name HN) (resid 42 and name HB#) 5.0 3.2 0.0
assign (resid 35 and name HN) (resid 42 and name HN) 4.3 2.5 0.0
assign (resid 35 and name HN) (resid 43 and name HA) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 37 and name HN) 3.7 1.9 0.0
assign (resid 36 and name HB) (resid 37 and name HN) 4.5 2.7 0.0
assign (resid 36 and name HG*) (resid 37 and name HB#) 6.0 4.2 0.0
assign (resid 36 and name HG*) (resid 37 and name HN) 4.9 3.1 0.0
assign (resid 36 and name HN) (resid 37 and name HN) 5.2 3.4 0.0
assign (resid 36 and name HA) (resid 40 and name HN) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 41 and name HA) 2.8 1.0 0.0
assign (resid 36 and name HA) (resid 41 and name HB) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 41 and name HD1#) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 41 and name HG2#) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 41 and name HN) 5.0 3.2 0.0
assign (resid 36 and name HB) (resid 41 and name HA) 5.0 3.2 0.0
assign (resid 36 and name HB) (resid 41 and name HG1#) 5.0 3.2 0.0
assign (resid 36 and name HB) (resid 41 and name HG2#) 5.0 3.2 0.0
assign (resid 36 and name HG*) (resid 41 and name HA) 5.0 3.2 0.0
assign (resid 36 and name HG*) (resid 41 and name HD1#) 5.0 3.2 0.0
assign (resid 36 and name HG*) (resid 41 and name HG1#) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 42 and name HN) 3.7 1.9 0.0
assign (resid 36 and name HB) (resid 42 and name HN) 5.0 3.2 0.0
assign (resid 36 and name HG*) (resid 42 and name HN) 5.0 3.2 0.0
assign (resid 36 and name HA) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 36 and name HG*) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 37 and name HB#) (resid 37 and name HA) 1.8 0.0 3.0
assign (resid 37 and name HB1) (resid 37 and name HN) 1.8 0.0 3.0
assign (resid 37 and name HB2) (resid 37 and name HN) 1.8 0.0 3.0
assign (resid 37 and name HB#) (resid 38 and name HA) 1.8 0.0 3.0
assign (resid 37 and name HB#) (resid 38 and name HN) 1.8 0.0 3.0
assign (resid 37 and name HB#) (resid 39 and name HN) 5.0 3.2 0.0
assign (resid 37 and name HN) (resid 39 and name HN) 5.0 3.0 0.0
assign (resid 37 and name HB#) (resid 40 and name HA#) 1.8 0.0 3.2
assign (resid 37 and name HB#) (resid 40 and name HN) 4.0 2.0 1.0
assign (resid 37 and name HN) (resid 40 and name HN) 3.8 2.0 0.0
assign (resid 37 and name HN) (resid 41 and name HA) 3.7 1.9 0.0
assign (resid 37 and name HN) (resid 41 and name HG2#) 5.0 3.2 0.0
assign (resid 37 and name HN) (resid 41 and name HN) 5.0 3.2 0.0
assign (resid 38 and name HA) (resid 39 and name HN) 4.7 2.9 0.0
assign (resid 38 and name HD*) (resid 39 and name HN) 4.5 2.7 0.0
assign (resid 38 and name HG) (resid 39 and name HN) 5.0 3.2 0.0
assign (resid 38 and name HN) (resid 39 and name HN) 4.2 2.4 0.0
assign (resid 38 and name HA) (resid 40 and name HN) 5.0 3.2 0.0
assign (resid 38 and name HN) (resid 40 and name HN) 5.0 3.2 0.0
assign (resid 38 and name HA) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 38 and name HG) (resid 102 and name HG*) 5.0 3.2 0.0
assign (resid 39 and name HA) (resid 40 and name HN) 5.1 3.3 0.0
assign (resid 39 and name HD2) (resid 40 and name HA#) 5.0 3.0 0.0
assign (resid 39 and name HN) (resid 40 and name HA#) 4.7 2.9 0.0
assign (resid 39 and name HN) (resid 40 and name HN) 3.6 1.8 0.0
assign (resid 39 and name HA) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 39 and name HN) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 40 and name HA#) (resid 41 and name HN) 2.7 0.9 0.0
assign (resid 40 and name HN) (resid 41 and name HG2#) 4.7 2.9 0.0
assign (resid 40 and name HN) (resid 41 and name HN) 4.8 3.0 0.0
assign (resid 40 and name HN) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 40 and name HA#) (resid 86 and name HA) 2.8 1.0 0.0
assign (resid 40 and name HA#) (resid 87 and name HN) 3.7 1.9 0.0
assign (resid 40 and name HN) (resid 87 and name HB#) 5.0 3.2 0.0
assign (resid 40 and name HN) (resid 98 and name HD*) 5.0 3.2 0.0
assign (resid 41 and name HG1#) (resid 41 and name HN) 4.5 2.7 0.0
assign (resid 41 and name HA) (resid 42 and name HN) 2.7 0.9 0.0
assign (resid 41 and name HB) (resid 42 and name HN) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 42 and name HN) 5.7 3.9 0.0
assign (resid 41 and name HG1#) (resid 42 and name HN) 4.5 2.8 0.0
assign (resid 41 and name HG2#) (resid 42 and name HN) 5.4 3.6 0.0
assign (resid 41 and name HN) (resid 42 and name HN) 4.8 3.0 0.0
assign (resid 41 and name HD1#) (resid 43 and name HG*) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 59 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HG1#) (resid 59 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 71 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 71 and name HG#) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 71 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 41 and name HG1#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 73 and name HB) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 41 and name HD1#) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 41 and name HG1#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 41 and name HG1#) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 41 and name HG2#) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 85 and name HN) 3.8 2.0 0.0
assign (resid 41 and name HN) (resid 86 and name HA) 3.7 1.9 0.0
assign (resid 41 and name HN) (resid 87 and name HB#) 5.0 3.2 0.0
assign (resid 41 and name HN) (resid 87 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HB#) (resid 42 and name HN) 4.6 2.8 0.0
assign (resid 42 and name HA) (resid 43 and name HG*) 4.2 2.4 0.0
assign (resid 42 and name HA) (resid 43 and name HN) 2.7 0.9 0.0
assign (resid 42 and name HB#) (resid 43 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 43 and name HA) 6.0 4.2 0.0
assign (resid 42 and name HD*) (resid 43 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HG) (resid 43 and name HN) 4.4 2.6 0.0
assign (resid 42 and name HN) (resid 43 and name HG*) 5.6 3.8 0.0
assign (resid 42 and name HN) (resid 43 and name HN) 4.8 3.0 0.0
assign (resid 42 and name HD*) (resid 77 and name HE1) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 77 and name HH2) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 77 and name HZ2) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 82 and name HB#) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 42 and name HG) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 42 and name HB#) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 83 and name HA) 5.0 3.2 0.0
assign (resid 42 and name HD*) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HG) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HA) (resid 84 and name HA#) 2.8 1.0 0.0
assign (resid 42 and name HA) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HG) (resid 84 and name HA#) 5.0 3.2 0.0
assign (resid 42 and name HG) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 42 and name HA) (resid 85 and name HN) 3.7 1.9 0.0
assign (resid 42 and name HG) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 43 and name HN) 4.4 2.6 0.0
assign (resid 43 and name HA) (resid 44 and name HA#) 4.1 2.3 0.0
assign (resid 43 and name HA) (resid 44 and name HN) 2.7 0.9 0.0
assign (resid 43 and name HB) (resid 44 and name HA#) 4.1 2.3 0.0
assign (resid 43 and name HB) (resid 44 and name HN) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 44 and name HA#) 6.0 4.2 0.0
assign (resid 43 and name HG*) (resid 44 and name HN) 3.9 2.1 0.0
assign (resid 43 and name HG*) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 75 and name HD*) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 83 and name HA) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 83 and name HB#) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 43 and name HN) (resid 83 and name HB#) 5.0 3.2 0.0
assign (resid 43 and name HN) (resid 83 and name HN) 3.8 2.0 0.0
assign (resid 43 and name HN) (resid 84 and name HA#) 3.7 1.9 0.0
assign (resid 43 and name HG*) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 43 and name HG*) (resid 85 and name HZ) 5.0 3.2 0.0
assign (resid 43 and name HG1#) (resid 85 and name HD#) 5.0 3.0 0.0
assign (resid 43 and name HN) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 44 and name HA#) (resid 44 and name HN) 3.6 1.8 0.0
assign (resid 44 and name HA#) (resid 45 and name HN) 3.6 1.8 0.0
assign (resid 44 and name HA#) (resid 82 and name HA) 2.8 1.0 0.0
assign (resid 44 and name HA#) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 44 and name HA#) (resid 83 and name HN) 3.7 1.9 0.0
assign (resid 45 and name HB#) (resid 45 and name HN) 4.0 2.2 0.0
assign (resid 45 and name HG#) (resid 45 and name HN) 5.0 3.2 0.0
assign (resid 45 and name HA) (resid 46 and name HD1) 3.5 1.8 0.0
assign (resid 45 and name HA) (resid 46 and name HD2) 3.5 1.8 0.0
assign (resid 45 and name HB#) (resid 46 and name HD#) 5.3 3.5 0.0
assign (resid 45 and name HN) (resid 46 and name HD1) 5.5 1.8 0.0
assign (resid 45 and name HN) (resid 46 and name HD2) 5.5 1.8 0.0
assign (resid 45 and name HE2#) (resid 49 and name HB#) 5.0 3.2 0.0
assign (resid 45 and name HE2#) (resid 49 and name HN) 5.0 3.2 0.0
assign (resid 45 and name HN) (resid 82 and name HA) 3.7 1.9 0.0
assign (resid 45 and name HN) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 45 and name HN) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 45 and name HA) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 45 and name HA) (resid 83 and name HG) 5.0 3.2 0.0
assign (resid 45 and name HB#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 45 and name HB#) (resid 83 and name HG) 5.0 3.2 0.0
assign (resid 45 and name HE2#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 45 and name HG#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 45 and name HG#) (resid 83 and name HG) 5.0 3.2 0.0
assign (resid 45 and name HN) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 45 and name HN) (resid 83 and name HG) 5.0 3.2 0.0
assign (resid 45 and name HN) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 46 and name HA) (resid 47 and name HB#) 5.5 3.7 0.0
assign (resid 46 and name HA) (resid 47 and name HE2#) 6.0 4.2 0.0
assign (resid 46 and name HA) (resid 47 and name HG#) 6.0 4.2 0.0
assign (resid 46 and name HA) (resid 47 and name HN) 3.1 1.3 0.0
assign (resid 46 and name HD#) (resid 49 and name HE3) 5.0 3.0 0.0
assign (resid 46 and name HG#) (resid 49 and name HA) 5.0 3.0 0.0
assign (resid 46 and name HG#) (resid 49 and name HE3) 5.0 3.0 0.0
assign (resid 46 and name HG#) (resid 49 and name HN) 5.0 3.2 0.0
assign (resid 46 and name HD#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 47 and name HB#) (resid 47 and name HE2#) 6.0 4.2 0.0
assign (resid 47 and name HB#) (resid 47 and name HN) 3.1 1.4 0.0
assign (resid 47 and name HE2#) (resid 47 and name HG#) 6.0 4.2 0.0
assign (resid 47 and name HA) (resid 48 and name HA) 5.4 3.6 0.0
assign (resid 47 and name HA) (resid 48 and name HN) 3.8 2.0 0.0
assign (resid 47 and name HB#) (resid 48 and name HA) 6.0 4.2 0.0
assign (resid 47 and name HB#) (resid 48 and name HB#) 6.0 4.2 0.0
assign (resid 47 and name HB#) (resid 48 and name HN) 4.6 2.8 0.0
assign (resid 47 and name HG#) (resid 48 and name HN) 5.5 3.8 0.0
assign (resid 47 and name HA) (resid 49 and name HN) 5.0 3.2 0.0
assign (resid 48 and name HA) (resid 48 and name HN) 4.1 2.3 0.0
assign (resid 48 and name HA) (resid 49 and name HB#) 5.0 3.0 0.0
assign (resid 48 and name HA) (resid 49 and name HB#) 5.0 3.0 0.0
assign (resid 48 and name HA) (resid 49 and name HN) 4.5 2.8 0.0
assign (resid 48 and name HB#) (resid 49 and name HN) 5.8 4.0 0.0
assign (resid 48 and name HN) (resid 49 and name HN) 4.3 2.5 0.0
assign (resid 49 and name HB#) (resid 49 and name HA) 5.0 3.0 0.0
assign (resid 49 and name HB#) (resid 49 and name HA) 5.0 3.0 0.0
assign (resid 49 and name HB#) (resid 49 and name HD1) 5.0 3.0 0.0
assign (resid 49 and name HB#) (resid 49 and name HE3) 5.0 3.0 0.0
assign (resid 49 and name HB1) (resid 49 and name HN) 5.0 3.0 0.0
assign (resid 49 and name HB2) (resid 49 and name HN) 5.0 3.0 0.0
assign (resid 49 and name HD1) (resid 49 and name HB#) 5.0 3.0 0.0
assign (resid 49 and name HE3) (resid 49 and name HA) 5.0 3.0 0.0
assign (resid 49 and name HE3) (resid 50 and name HN) 5.3 3.0 0.0
assign (resid 49 and name HN) (resid 50 and name HN) 5.2 3.4 0.0
assign (resid 49 and name HZ2) (resid 51 and name HA#) 5.0 3.0 0.0
assign (resid 49 and name HE1) (resid 57 and name HD#) 5.8 3.0 0.0
assign (resid 49 and name HH2) (resid 57 and name HD#) 5.8 3.0 0.0
assign (resid 49 and name HZ2) (resid 57 and name HD#) 5.8 3.0 0.0
assign (resid 49 and name HE1) (resid 75 and name HD*) 5.0 3.0 0.0
assign (resid 49 and name HH2) (resid 75 and name HD*) 5.0 3.0 0.0
assign (resid 49 and name HZ2) (resid 75 and name HD*) 5.0 3.0 0.0
assign (resid 49 and name HZ2) (resid 75 and name HD*) 5.0 3.0 0.0
assign (resid 49 and name HD1) (resid 83 and name HD1#) 1.8 0.0 3.2
assign (resid 49 and name HE1) (resid 83 and name HD1#) 5.0 3.0 0.0
assign (resid 49 and name HE1) (resid 83 and name HD2#) 5.0 3.0 0.0
assign (resid 49 and name HZ2) (resid 83 and name HD1#) 5.0 3.0 0.0
assign (resid 49 and name HZ2) (resid 83 and name HD2#) 5.0 3.0 0.0
assign (resid 49 and name HH2) (resid 85 and name HZ) 5.0 3.0 0.0
assign (resid 49 and name HZ2) (resid 85 and name HZ) 5.0 3.0 0.0
assign (resid 49 and name HZ3) (resid 85 and name HZ) 5.0 3.0 0.0
assign (resid 50 and name HA) (resid 50 and name HD21) 5.0 3.0 0.0
assign (resid 50 and name HD2#) (resid 52 and name HN) 5.0 3.0 0.0
assign (resid 51 and name HA#) (resid 52 and name HB#) 3.9 2.0 0.0
assign (resid 51 and name HA#) (resid 52 and name HN) 3.3 1.5 0.0
assign (resid 51 and name HA1) (resid 57 and name HZ) 5.0 3.0 0.0
assign (resid 51 and name HA2) (resid 57 and name HZ) 5.0 3.0 0.0
assign (resid 52 and name HA) (resid 53 and name HB#) 5.0 3.2 0.0
assign (resid 52 and name HA) (resid 53 and name HD#) 3.1 1.3 0.0
assign (resid 52 and name HA) (resid 53 and name HG#) 4.5 2.7 0.0
assign (resid 52 and name HB#) (resid 53 and name HD#) 4.3 2.5 0.0
assign (resid 52 and name HN) (resid 53 and name HD#) 4.7 2.9 0.0
assign (resid 52 and name HA) (resid 54 and name HN) 5.0 3.2 0.0
assign (resid 52 and name HB#) (resid 54 and name HN) 5.0 3.2 0.0
assign (resid 52 and name HB#) (resid 55 and name HB#) 5.0 3.2 0.0
assign (resid 52 and name HB#) (resid 55 and name HG#) 5.0 3.2 0.0
assign (resid 52 and name HB#) (resid 55 and name HN) 5.0 3.2 0.0
assign (resid 52 and name HN) (resid 55 and name HD#) 5.0 3.2 0.0
assign (resid 52 and name HN) (resid 55 and name HN) 5.0 3.2 0.0
assign (resid 53 and name HA) (resid 54 and name HA) 4.5 2.8 0.0
assign (resid 53 and name HA) (resid 54 and name HN) 4.9 3.1 0.0
assign (resid 53 and name HB#) (resid 54 and name HG#) 4.4 2.6 0.0
assign (resid 53 and name HB#) (resid 54 and name HN) 4.9 3.1 0.0
assign (resid 53 and name HD#) (resid 54 and name HN) 4.5 2.7 0.0
assign (resid 53 and name HG#) (resid 54 and name HN) 5.0 3.1 0.0
assign (resid 53 and name HA) (resid 55 and name HN) 5.0 3.2 0.0
assign (resid 53 and name HA) (resid 75 and name HB#) 5.0 3.2 0.0
assign (resid 53 and name HA) (resid 75 and name HD*) 5.0 3.2 0.0
assign (resid 53 and name HA) (resid 75 and name HG) 5.0 3.2 0.0
assign (resid 53 and name HA) (resid 75 and name HN) 5.0 3.2 0.0
assign (resid 53 and name HB#) (resid 75 and name HB#) 5.0 3.2 0.0
assign (resid 53 and name HB#) (resid 75 and name HD*) 5.0 3.2 0.0
assign (resid 53 and name HB#) (resid 75 and name HG) 5.0 3.2 0.0
assign (resid 53 and name HD#) (resid 75 and name HD*) 5.0 3.2 0.0
assign (resid 53 and name HG#) (resid 75 and name HD*) 5.0 3.2 0.0
assign (resid 54 and name HA) (resid 54 and name HN) 4.3 2.5 0.0
assign (resid 54 and name HB2) (resid 54 and name HN) 4.0 2.2 0.0
assign (resid 54 and name HE2#) (resid 54 and name HN) 6.0 4.2 0.0
assign (resid 54 and name HG#) (resid 54 and name HN) 4.3 2.5 0.0
assign (resid 54 and name HA) (resid 55 and name HN) 4.7 2.9 0.0
assign (resid 54 and name HB1) (resid 55 and name HG#) 5.3 3.5 0.0
assign (resid 54 and name HB1) (resid 55 and name HN) 5.1 3.3 0.0
assign (resid 54 and name HB2) (resid 55 and name HG#) 5.2 3.5 0.0
assign (resid 54 and name HB2) (resid 55 and name HN) 5.0 3.2 0.0
assign (resid 54 and name HG#) (resid 55 and name HG#) 6.0 4.2 0.0
assign (resid 54 and name HG#) (resid 55 and name HN) 5.4 3.6 0.0
assign (resid 54 and name HN) (resid 55 and name HA) 5.9 4.1 0.0
assign (resid 54 and name HN) (resid 55 and name HB#) 5.8 4.0 0.0
assign (resid 54 and name HN) (resid 55 and name HG#) 5.5 3.7 0.0
assign (resid 54 and name HN) (resid 55 and name HN) 3.9 2.1 0.0
assign (resid 55 and name HA) (resid 55 and name HN) 4.8 3.0 0.0
assign (resid 55 and name HB#) (resid 55 and name HN) 4.4 2.6 0.0
assign (resid 55 and name HG#) (resid 55 and name HN) 5.0 3.2 0.0
assign (resid 55 and name HA) (resid 56 and name HD#) 3.5 1.7 0.0
assign (resid 55 and name HA) (resid 56 and name HG#) 4.7 2.9 0.0
assign (resid 55 and name HB#) (resid 56 and name HD#) 4.1 2.3 0.0
assign (resid 55 and name HG#) (resid 56 and name HD#) 5.1 3.3 0.0
assign (resid 55 and name HN) (resid 56 and name HD#) 5.7 3.9 0.0
assign (resid 56 and name HA) (resid 57 and name HA) 4.4 2.6 0.0
assign (resid 56 and name HA) (resid 57 and name HN) 2.7 0.9 0.0
assign (resid 56 and name HB#) (resid 57 and name HN) 5.0 3.2 0.0
assign (resid 56 and name HG#) (resid 57 and name HN) 6.0 4.2 0.0
assign (resid 56 and name HB#) (resid 72 and name HG#) 5.0 3.2 0.0
assign (resid 57 and name HA) (resid 58 and name HG#) 4.2 2.5 0.0
assign (resid 57 and name HA) (resid 58 and name HN) 2.7 0.9 0.0
assign (resid 57 and name HB1) (resid 58 and name HN) 5.0 3.2 0.0
assign (resid 57 and name HB2) (resid 58 and name HN) 5.0 3.1 0.0
assign (resid 57 and name HD#) (resid 58 and name HN) 5.8 3.0 0.0
assign (resid 57 and name HN) (resid 58 and name HN) 4.8 3.0 0.0
assign (resid 57 and name HN) (resid 72 and name HG#) 5.0 3.2 0.0
assign (resid 57 and name HA) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 57 and name HB1) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 57 and name HB1) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 57 and name HB2) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 57 and name HB2) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 57 and name HB2) (resid 73 and name HN) 5.0 3.2 0.0
assign (resid 57 and name HN) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 57 and name HN) (resid 73 and name HN) 3.8 2.0 0.0
assign (resid 57 and name HD#) (resid 75 and name HB#) 5.8 3.0 0.0
assign (resid 57 and name HD#) (resid 85 and name HD#) 5.8 3.0 0.0
assign (resid 57 and name HD#) (resid 85 and name HE#) 5.8 3.0 0.0
assign (resid 57 and name HD#) (resid 85 and name HE1) 5.8 3.0 0.0
assign (resid 57 and name HD#) (resid 85 and name HZ) 5.8 3.0 0.0
assign (resid 58 and name HA) (resid 58 and name HN) 3.8 2.0 0.0
assign (resid 58 and name HG#) (resid 58 and name HN) 4.8 3.0 0.0
assign (resid 58 and name HA) (resid 59 and name HB#) 3.9 2.1 0.0
assign (resid 58 and name HA) (resid 59 and name HN) 2.7 0.9 0.0
assign (resid 58 and name HB#) (resid 59 and name HN) 5.0 3.2 0.0
assign (resid 58 and name HG#) (resid 59 and name HN) 4.5 2.7 0.0
assign (resid 58 and name HA) (resid 71 and name HN) 5.0 3.2 0.0
assign (resid 58 and name HA) (resid 72 and name HA) 2.8 1.0 0.0
assign (resid 58 and name HA) (resid 72 and name HB#) 5.0 3.2 0.0
assign (resid 58 and name HG#) (resid 72 and name HA) 5.0 3.2 0.0
assign (resid 58 and name HA) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 58 and name HA) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 58 and name HA) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 58 and name HA) (resid 73 and name HN) 3.7 1.9 0.0
assign (resid 58 and name HN) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 58 and name HN) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 59 and name HA) (resid 59 and name HN) 4.3 2.5 0.0
assign (resid 59 and name HB#) (resid 59 and name HN) 4.0 2.2 0.0
assign (resid 59 and name HA) (resid 60 and name HA) 4.4 2.6 0.0
assign (resid 59 and name HA) (resid 60 and name HN) 2.7 0.9 0.0
assign (resid 59 and name HB#) (resid 60 and name HN) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 60 and name HN) 4.8 3.0 0.0
assign (resid 59 and name HB#) (resid 61 and name HD*) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 61 and name HN) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 70 and name HA) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 70 and name HA) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 71 and name HB#) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 71 and name HE#) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 71 and name HG#) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 71 and name HN) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 71 and name HB#) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 71 and name HG#) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 71 and name HN) 3.8 2.0 0.0
assign (resid 59 and name HN) (resid 72 and name HA) 3.7 1.9 0.0
assign (resid 59 and name HA) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 59 and name HB#) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 73 and name HG1#) 5.0 3.2 0.0
assign (resid 59 and name HN) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 60 and name HA) (resid 61 and name HN) 2.7 0.9 0.0
assign (resid 60 and name HB1) (resid 61 and name HN) 5.0 3.2 0.0
assign (resid 60 and name HB2) (resid 61 and name HN) 5.6 3.8 0.0
assign (resid 60 and name HD#) (resid 61 and name HN) 4.8 3.0 0.0
assign (resid 60 and name HN) (resid 61 and name HD*) 4.8 3.0 0.0
assign (resid 60 and name HB1) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 60 and name HB2) (resid 62 and name HE#) 5.0 3.2 0.0
assign (resid 60 and name HA) (resid 68 and name HD*) 5.0 3.2 0.0
assign (resid 60 and name HA) (resid 70 and name HA) 2.8 1.0 0.0
assign (resid 60 and name HB1) (resid 70 and name HA) 5.0 3.2 0.0
assign (resid 60 and name HD#) (resid 70 and name HA) 5.0 3.2 0.0
assign (resid 61 and name HB2) (resid 61 and name HN) 4.2 2.4 0.0
assign (resid 61 and name HB1) (resid 62 and name HD#) 6.0 4.2 0.0
assign (resid 61 and name HB1) (resid 62 and name HN) 5.0 3.2 0.0
assign (resid 61 and name HB2) (resid 62 and name HN) 4.2 2.4 0.0
assign (resid 61 and name HD*) (resid 62 and name HD#) 5.3 3.5 0.0
assign (resid 61 and name HD*) (resid 62 and name HE#) 5.3 3.5 0.0
assign (resid 61 and name HD*) (resid 62 and name HN) 5.1 3.3 0.0
assign (resid 61 and name HN) (resid 62 and name HN) 4.8 3.0 0.0
assign (resid 61 and name HN) (resid 68 and name HD*) 5.0 3.2 0.0
assign (resid 61 and name HB1) (resid 69 and name HB) 5.0 3.2 0.0
assign (resid 61 and name HB1) (resid 69 and name HG2#) 5.0 3.2 0.0
assign (resid 61 and name HB2) (resid 69 and name HB) 5.0 3.2 0.0
assign (resid 61 and name HN) (resid 69 and name HB) 5.0 3.2 0.0
assign (resid 61 and name HN) (resid 69 and name HD1#) 5.0 3.2 0.0
assign (resid 61 and name HN) (resid 69 and name HG2#) 5.0 3.2 0.0
assign (resid 61 and name HN) (resid 69 and name HN) 3.8 2.0 0.0
assign (resid 61 and name HN) (resid 70 and name HA) 3.7 1.9 0.0
assign (resid 62 and name HA) (resid 63 and name HB#) 4.2 2.4 0.0
assign (resid 62 and name HB#) (resid 63 and name HN) 4.5 2.7 0.0
assign (resid 62 and name HD#) (resid 63 and name HN) 5.0 3.2 0.0
assign (resid 62 and name HA) (resid 64 and name HN) 5.0 3.2 0.0
assign (resid 62 and name HA) (resid 68 and name HB#) 5.0 3.2 0.0
assign (resid 62 and name HE#) (resid 68 and name HD*) 5.0 3.2 0.0
assign (resid 62 and name HA) (resid 69 and name HN) 3.7 1.9 0.0
assign (resid 63 and name HB#) (resid 63 and name HN) 4.1 2.4 0.0
assign (resid 63 and name HA) (resid 64 and name HN) 4.5 2.7 0.0
assign (resid 63 and name HD*) (resid 64 and name HN) 5.0 3.2 0.0
assign (resid 63 and name HA) (resid 67 and name HB) 5.0 3.2 0.0
assign (resid 63 and name HA) (resid 67 and name HG1#) 5.0 3.2 0.0
assign (resid 63 and name HB#) (resid 67 and name HB) 5.0 3.2 0.0
assign (resid 63 and name HB#) (resid 67 and name HG1#) 5.0 3.2 0.0
assign (resid 63 and name HB#) (resid 67 and name HG2#) 5.0 3.2 0.0
assign (resid 63 and name HD*) (resid 67 and name HG1#) 5.0 3.2 0.0
assign (resid 63 and name HG) (resid 67 and name HG1#) 5.0 3.2 0.0
assign (resid 63 and name HN) (resid 67 and name HB) 5.0 3.2 0.0
assign (resid 63 and name HN) (resid 67 and name HG1#) 5.0 3.2 0.0
assign (resid 63 and name HN) (resid 67 and name HG2#) 5.0 3.2 0.0
assign (resid 64 and name HA#) (resid 65 and name HB#) 5.2 3.5 0.0
assign (resid 64 and name HA#) (resid 65 and name HD*) 5.5 3.7 0.0
assign (resid 64 and name HA#) (resid 65 and name HN) 4.1 2.3 0.0
assign (resid 64 and name HN) (resid 65 and name HN) 4.7 2.9 0.0
assign (resid 64 and name HA#) (resid 67 and name HB) 5.0 3.2 0.0
assign (resid 64 and name HN) (resid 67 and name HB) 5.0 3.2 0.0
assign (resid 65 and name HB#) (resid 65 and name HN) 4.0 2.1 0.0
assign (resid 65 and name HG) (resid 65 and name HN) 4.7 2.9 0.0
assign (resid 65 and name HA) (resid 66 and name HA) 5.2 3.4 0.0
assign (resid 65 and name HA) (resid 66 and name HB#) 5.5 3.7 0.0
assign (resid 65 and name HA) (resid 66 and name HN) 4.0 2.2 0.0
assign (resid 65 and name HB#) (resid 66 and name HA) 5.9 4.1 0.0
assign (resid 65 and name HB#) (resid 66 and name HB#) 5.2 3.5 0.0
assign (resid 65 and name HD*) (resid 66 and name HA) 5.7 3.9 0.0
assign (resid 65 and name HD*) (resid 66 and name HN) 4.8 3.0 0.0
assign (resid 65 and name HA) (resid 67 and name HN) 5.0 3.2 0.0
assign (resid 65 and name HB#) (resid 67 and name HN) 5.0 3.2 0.0
assign (resid 66 and name HA) (resid 66 and name HN) 3.9 2.1 0.0
assign (resid 66 and name HA) (resid 67 and name HN) 4.5 2.6 0.0
assign (resid 66 and name HB#) (resid 67 and name HG2#) 6.0 4.2 0.0
assign (resid 66 and name HB#) (resid 67 and name HN) 5.3 3.5 0.0
assign (resid 66 and name HN) (resid 67 and name HN) 4.2 2.4 0.0
assign (resid 67 and name HB) (resid 67 and name HN) 4.1 2.3 0.0
assign (resid 67 and name HA) (resid 68 and name HB#) 4.8 3.0 0.0
assign (resid 67 and name HA) (resid 68 and name HD*) 5.6 3.8 0.0
assign (resid 67 and name HA) (resid 68 and name HG) 6.0 4.2 0.0
assign (resid 67 and name HA) (resid 68 and name HN) 3.5 1.7 0.0
assign (resid 67 and name HB) (resid 68 and name HN) 5.2 3.4 0.0
assign (resid 67 and name HG1#) (resid 68 and name HN) 4.4 2.6 0.0
assign (resid 67 and name HG2#) (resid 68 and name HN) 5.4 3.6 0.0
assign (resid 67 and name HB) (resid 69 and name HD1#) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 69 and name HD1#) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 69 and name HG1#) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 69 and name HG2#) 5.0 3.2 0.0
assign (resid 67 and name HG2#) (resid 69 and name HG1#) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 97 and name HA) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 97 and name HB1) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 97 and name HB2) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 67 and name HG1#) (resid 97 and name HE1) 5.0 3.0 0.0
assign (resid 67 and name HG2#) (resid 97 and name HA) 5.0 3.2 0.0
assign (resid 67 and name HG2#) (resid 97 and name HB1) 5.0 3.2 0.0
assign (resid 67 and name HG2#) (resid 97 and name HB2) 5.0 3.2 0.0
assign (resid 67 and name HG2#) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 67 and name HG2#) (resid 97 and name HE1) 5.0 3.0 0.0
assign (resid 67 and name HG1#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 68 and name HB#) (resid 69 and name HN) 5.0 3.2 0.0
assign (resid 68 and name HD*) (resid 69 and name HN) 4.5 2.8 0.0
assign (resid 68 and name HG) (resid 69 and name HA) 6.0 4.2 0.0
assign (resid 68 and name HG) (resid 69 and name HN) 5.4 3.6 0.0
assign (resid 68 and name HN) (resid 69 and name HG1#) 4.1 2.3 0.0
assign (resid 68 and name HD*) (resid 70 and name HA) 5.0 3.2 0.0
assign (resid 68 and name HD*) (resid 70 and name HG#) 5.0 3.2 0.0
assign (resid 68 and name HG) (resid 70 and name HB#) 5.0 3.2 0.0
assign (resid 68 and name HG) (resid 70 and name HD#) 5.0 3.2 0.0
assign (resid 69 and name HA) (resid 70 and name HA) 4.5 2.6 0.0
assign (resid 69 and name HA) (resid 70 and name HG#) 6.0 4.2 0.0
assign (resid 69 and name HA) (resid 70 and name HN) 2.7 0.9 0.0
assign (resid 69 and name HG2#) (resid 70 and name HA) 6.0 4.2 0.0
assign (resid 69 and name HG2#) (resid 70 and name HB#) 4.2 2.4 0.0
assign (resid 69 and name HG2#) (resid 70 and name HN) 4.5 2.7 0.0
assign (resid 69 and name HD1#) (resid 71 and name HG#) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 71 and name HB#) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 71 and name HG#) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 91 and name HB#) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 94 and name HA) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 94 and name HA) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 94 and name HB#) 5.0 3.2 0.0
assign (resid 69 and name HD#) (resid 97 and name HE1) 5.0 3.0 0.0
assign (resid 69 and name HD1#) (resid 97 and name HA) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 97 and name HB1) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 97 and name HB2) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 97 and name HN) 5.0 3.2 0.0
assign (resid 69 and name HG1#) (resid 97 and name HB1) 5.0 3.2 0.0
assign (resid 69 and name HG1#) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 97 and name HB1) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 97 and name HN) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 98 and name HA) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 98 and name HN) 5.0 3.2 0.0
assign (resid 69 and name HG1#) (resid 98 and name HN) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 98 and name HA) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 98 and name HN) 5.0 3.2 0.0
assign (resid 69 and name HD1#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 69 and name HG2#) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 70 and name HD#) (resid 70 and name HE) 3.3 1.5 0.0
assign (resid 70 and name HE) (resid 70 and name HG#) 5.0 3.2 0.0
assign (resid 70 and name HA) (resid 71 and name HB#) 4.6 2.8 0.0
assign (resid 70 and name HA) (resid 71 and name HG#) 4.5 2.7 0.0
assign (resid 70 and name HA) (resid 71 and name HN) 2.7 0.9 0.0
assign (resid 70 and name HB#) (resid 71 and name HN) 5.0 3.2 0.0
assign (resid 70 and name HD#) (resid 71 and name HN) 5.9 4.1 0.0
assign (resid 70 and name HG#) (resid 71 and name HG#) 4.9 3.1 0.0
assign (resid 70 and name HG#) (resid 71 and name HN) 4.8 3.0 0.0
assign (resid 70 and name HN) (resid 71 and name HN) 4.8 3.0 0.0
assign (resid 70 and name HB#) (resid 91 and name HB#) 5.0 3.2 0.0
assign (resid 70 and name HB#) (resid 91 and name HN) 5.0 3.2 0.0
assign (resid 70 and name HN) (resid 94 and name HB#) 5.0 3.2 0.0
assign (resid 70 and name HN) (resid 94 and name HN) 5.0 3.2 0.0
assign (resid 71 and name HG#) (resid 71 and name HN) 4.2 2.4 0.0
assign (resid 71 and name HA) (resid 72 and name HB#) 5.8 4.0 0.0
assign (resid 71 and name HA) (resid 72 and name HN) 2.7 0.9 0.0
assign (resid 71 and name HB#) (resid 72 and name HA) 5.0 3.1 0.0
assign (resid 71 and name HB#) (resid 72 and name HN) 5.0 3.2 0.0
assign (resid 71 and name HE#) (resid 72 and name HN) 6.0 4.2 0.0
assign (resid 71 and name HG#) (resid 72 and name HN) 5.0 3.2 0.0
assign (resid 71 and name HN) (resid 72 and name HN) 4.8 3.0 0.0
assign (resid 71 and name HB#) (resid 73 and name HD1#) 5.0 3.2 0.0
assign (resid 71 and name HB#) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 71 and name HE#) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 71 and name HG#) (resid 73 and name HG2#) 5.0 3.2 0.0
assign (resid 71 and name HE#) (resid 87 and name HB#) 5.0 3.2 0.0
assign (resid 71 and name HA) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 71 and name HA) (resid 90 and name HA) 2.8 1.0 0.0
assign (resid 71 and name HA) (resid 90 and name HB) 5.0 3.2 0.0
assign (resid 71 and name HA) (resid 90 and name HD1#) 5.0 3.2 0.0
assign (resid 71 and name HA) (resid 90 and name HG2#) 5.0 3.2 0.0
assign (resid 71 and name HB#) (resid 90 and name HA) 5.0 3.2 0.0
assign (resid 71 and name HB#) (resid 90 and name HB) 5.0 3.2 0.0
assign (resid 71 and name HB#) (resid 90 and name HD1#) 5.0 3.2 0.0
assign (resid 71 and name HB#) (resid 90 and name HG2#) 5.0 3.2 0.0
assign (resid 71 and name HE#) (resid 90 and name HD1#) 5.0 3.2 0.0
assign (resid 71 and name HG#) (resid 90 and name HA) 5.0 3.2 0.0
assign (resid 71 and name HG#) (resid 90 and name HB) 5.0 3.2 0.0
assign (resid 71 and name HG#) (resid 90 and name HD1#) 5.0 3.2 0.0
assign (resid 71 and name HG#) (resid 90 and name HG2#) 5.0 3.2 0.0
assign (resid 71 and name HA) (resid 91 and name HN) 3.7 1.9 0.0
assign (resid 71 and name HG#) (resid 91 and name HN) 5.0 3.2 0.0
assign (resid 71 and name HE#) (resid 98 and name HD*) 5.0 3.2 0.0
assign (resid 72 and name HA) (resid 73 and name HG1#) 6.0 4.2 0.0
assign (resid 72 and name HA) (resid 73 and name HG2#) 5.2 3.4 0.0
assign (resid 72 and name HA) (resid 73 and name HN) 2.7 0.9 0.0
assign (resid 72 and name HB#) (resid 73 and name HN) 5.0 3.2 0.0
assign (resid 72 and name HG#) (resid 73 and name HN) 4.6 2.8 0.0
assign (resid 72 and name HN) (resid 73 and name HG2#) 5.3 3.5 0.0
assign (resid 72 and name HN) (resid 73 and name HN) 4.8 3.0 0.0
assign (resid 72 and name HN) (resid 87 and name HA) 5.0 3.2 0.0
assign (resid 72 and name HB#) (resid 88 and name HB#) 5.0 3.2 0.0
assign (resid 72 and name HB#) (resid 88 and name HN) 5.0 3.2 0.0
assign (resid 72 and name HG#) (resid 88 and name HB#) 5.0 3.2 0.0
assign (resid 72 and name HN) (resid 88 and name HN) 5.0 3.2 0.0
assign (resid 72 and name HA) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 72 and name HB#) (resid 89 and name HA) 5.0 3.2 0.0
assign (resid 72 and name HB#) (resid 89 and name HB#) 5.0 3.2 0.0
assign (resid 72 and name HB#) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 72 and name HG#) (resid 89 and name HB#) 5.0 3.2 0.0
assign (resid 72 and name HG#) (resid 89 and name HD2) 5.0 3.2 0.0
assign (resid 72 and name HG#) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 72 and name HN) (resid 89 and name HB#) 5.0 3.2 0.0
assign (resid 72 and name HN) (resid 89 and name HN) 4.3 2.5 0.0
assign (resid 72 and name HN) (resid 90 and name HA) 3.7 1.9 0.0
assign (resid 72 and name HN) (resid 90 and name HD1#) 5.0 3.2 0.0
assign (resid 72 and name HN) (resid 90 and name HG1#) 5.0 3.2 0.0
assign (resid 73 and name HG1#) (resid 73 and name HN) 4.4 2.6 0.0
assign (resid 73 and name HA) (resid 74 and name HN) 2.7 0.9 0.0
assign (resid 73 and name HB) (resid 74 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HD1#) (resid 74 and name HN) 5.1 3.3 0.0
assign (resid 73 and name HG1#) (resid 74 and name HN) 4.7 2.9 0.0
assign (resid 73 and name HG2#) (resid 74 and name HN) 4.2 2.4 0.0
assign (resid 73 and name HN) (resid 74 and name HN) 4.8 3.0 0.0
assign (resid 73 and name HB) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 73 and name HB) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 73 and name HD1#) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 73 and name HD1#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 73 and name HD1#) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HD1#) (resid 85 and name HZ) 5.0 3.2 0.0
assign (resid 73 and name HG1#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 73 and name HG2#) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 73 and name HG2#) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 73 and name HA) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HB) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HA) (resid 87 and name HA) 3.3 1.5 0.0
assign (resid 73 and name HG2#) (resid 87 and name HA) 5.0 3.2 0.0
assign (resid 73 and name HG2#) (resid 87 and name HB#) 5.0 3.2 0.0
assign (resid 73 and name HG2#) (resid 87 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HA) (resid 88 and name HB#) 5.0 3.2 0.0
assign (resid 73 and name HA) (resid 88 and name HG#) 5.0 3.2 0.0
assign (resid 73 and name HA) (resid 88 and name HN) 4.2 2.4 0.0
assign (resid 73 and name HB) (resid 88 and name HE2#) 5.0 3.2 0.0
assign (resid 73 and name HG2#) (resid 88 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HA) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 73 and name HG2#) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 74 and name HA) (resid 75 and name HB#) 4.4 2.6 0.0
assign (resid 74 and name HA) (resid 75 and name HN) 2.7 0.9 0.0
assign (resid 74 and name HB#) (resid 75 and name HN) 5.0 3.2 0.0
assign (resid 74 and name HN) (resid 75 and name HN) 4.8 3.0 0.0
assign (resid 74 and name HN) (resid 85 and name HA) 5.0 3.2 0.0
assign (resid 74 and name HN) (resid 85 and name HB#) 5.0 3.2 0.0
assign (resid 74 and name HB#) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 74 and name HN) (resid 86 and name HB#) 5.0 3.2 0.0
assign (resid 74 and name HN) (resid 86 and name HN) 3.8 2.0 0.0
assign (resid 74 and name HN) (resid 87 and name HA) 4.0 1.9 0.0
assign (resid 74 and name HB#) (resid 88 and name HE2#) 5.0 3.2 0.0
assign (resid 74 and name HB#) (resid 88 and name HG#) 5.0 3.2 0.0
assign (resid 74 and name HN) (resid 88 and name HE2#) 5.0 3.2 0.0
assign (resid 75 and name HB#) (resid 75 and name HN) 4.2 2.5 0.0
assign (resid 75 and name HA) (resid 76 and name HA) 4.5 2.7 0.0
assign (resid 75 and name HA) (resid 76 and name HB#) 4.5 2.7 0.0
assign (resid 75 and name HA) (resid 76 and name HN) 2.7 0.9 0.0
assign (resid 75 and name HB#) (resid 76 and name HN) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 76 and name HA) 5.5 3.8 0.0
assign (resid 75 and name HD*) (resid 76 and name HB#) 5.9 4.1 0.0
assign (resid 75 and name HD*) (resid 76 and name HN) 5.0 3.0 0.0
assign (resid 75 and name HG) (resid 76 and name HN) 5.0 3.0 0.0
assign (resid 75 and name HN) (resid 76 and name HN) 4.8 3.0 0.0
assign (resid 75 and name HA) (resid 77 and name HN) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 77 and name HA) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 77 and name HN) 5.0 3.2 0.0
assign (resid 75 and name HG) (resid 77 and name HA) 5.0 3.2 0.0
assign (resid 75 and name HG) (resid 77 and name HN) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 78 and name HA) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 78 and name HB#) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 78 and name HN) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 83 and name HA) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 83 and name HB#) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 83 and name HG) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 75 and name HA) (resid 85 and name HA) 4.0 1.5 0.0
assign (resid 75 and name HA) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 75 and name HA) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 75 and name HD*) (resid 85 and name HZ) 5.0 3.2 0.0
assign (resid 75 and name HG) (resid 85 and name HZ) 5.0 3.0 0.0
assign (resid 75 and name HN) (resid 85 and name HA) 5.0 3.2 0.0
assign (resid 75 and name HA) (resid 86 and name HN) 4.5 1.9 0.0
assign (resid 75 and name HD*) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 76 and name HB#) (resid 76 and name HN) 3.8 2.0 0.0
assign (resid 76 and name HA) (resid 77 and name HD1) 4.5 2.7 0.0
assign (resid 76 and name HA) (resid 77 and name HE1) 6.0 3.2 0.0
assign (resid 76 and name HA) (resid 77 and name HN) 4.6 2.8 0.0
assign (resid 76 and name HB#) (resid 77 and name HA) 5.6 3.8 0.0
assign (resid 76 and name HB#) (resid 77 and name HB#) 5.8 4.0 0.0
assign (resid 76 and name HB#) (resid 77 and name HD1) 4.5 2.0 0.0
assign (resid 76 and name HB#) (resid 77 and name HE1) 4.0 2.2 0.0
assign (resid 76 and name HB#) (resid 77 and name HN) 4.5 2.6 0.0
assign (resid 76 and name HN) (resid 77 and name HD1) 5.1 3.3 0.0
assign (resid 76 and name HN) (resid 77 and name HN) 4.0 1.9 0.0
assign (resid 76 and name HB#) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 76 and name HB#) (resid 85 and name HA) 5.0 3.2 0.0
assign (resid 76 and name HB#) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 76 and name HN) (resid 85 and name HA) 4.5 2.4 0.0
assign (resid 76 and name HA) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 76 and name HB#) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 76 and name HN) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HA) (resid 77 and name HN) 4.7 2.9 0.0
assign (resid 77 and name HD1) (resid 77 and name HN) 4.7 2.9 0.0
assign (resid 77 and name HA) (resid 78 and name HB#) 4.9 3.1 0.0
assign (resid 77 and name HA) (resid 78 and name HN) 2.7 0.9 0.0
assign (resid 77 and name HB#) (resid 78 and name HB#) 6.0 4.2 0.0
assign (resid 77 and name HB#) (resid 78 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HE3) (resid 78 and name HA) 5.2 3.4 0.0
assign (resid 77 and name HE3) (resid 78 and name HB#) 6.0 4.2 0.0
assign (resid 77 and name HE3) (resid 78 and name HN) 4.8 3.0 0.0
assign (resid 77 and name HN) (resid 78 and name HB#) 6.0 4.2 0.0
assign (resid 77 and name HN) (resid 78 and name HN) 4.8 3.0 0.0
assign (resid 77 and name HZ3) (resid 78 and name HA) 4.1 2.3 0.0
assign (resid 77 and name HZ3) (resid 78 and name HB#) 5.6 3.8 0.0
assign (resid 77 and name HE3) (resid 79 and name HB#) 5.0 3.2 0.0
assign (resid 77 and name HE3) (resid 79 and name HD#) 5.0 3.2 0.0
assign (resid 77 and name HE3) (resid 79 and name HG#) 5.0 3.2 0.0
assign (resid 77 and name HE3) (resid 79 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 79 and name HA) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 79 and name HB#) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 79 and name HD#) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 79 and name HG#) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 79 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HH2) (resid 82 and name HB#) 5.0 3.2 0.0
assign (resid 77 and name HH2) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 77 and name HH2) (resid 82 and name HG) 5.0 3.2 0.0
assign (resid 77 and name HH2) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HZ2) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 82 and name HB#) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 82 and name HG) 5.0 3.2 0.0
assign (resid 77 and name HZ3) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HH2) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HN) (resid 83 and name HA) 5.0 3.2 0.0
assign (resid 77 and name HD1) (resid 84 and name HA#) 5.0 3.2 0.0
assign (resid 77 and name HE1) (resid 84 and name HA#) 5.0 3.2 0.0
assign (resid 77 and name HE1) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HH2) (resid 84 and name HA2) 5.0 3.0 0.0
assign (resid 77 and name HH2) (resid 84 and name HA2) 5.0 3.0 0.0
assign (resid 77 and name HN) (resid 84 and name HN) 4.3 2.5 0.0
assign (resid 77 and name HZ2) (resid 84 and name HA#) 5.0 3.2 0.0
assign (resid 77 and name HZ2) (resid 84 and name HA1) 5.0 3.0 0.0
assign (resid 77 and name HZ2) (resid 84 and name HA2) 5.0 3.0 0.0
assign (resid 77 and name HZ2) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HE1) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HN) (resid 85 and name HA) 5.0 3.2 0.0
assign (resid 77 and name HN) (resid 85 and name HN) 5.0 3.2 0.0
assign (resid 77 and name HE1) (resid 86 and name HA) 6.0 3.2 0.5
assign (resid 78 and name HA) (resid 78 and name HN) 5.0 3.2 0.0
assign (resid 78 and name HB#) (resid 78 and name HN) 4.4 2.6 0.0
assign (resid 78 and name HA) (resid 79 and name HN) 2.9 0.9 0.0
assign (resid 78 and name HB#) (resid 79 and name HA) 5.3 3.5 0.0
assign (resid 78 and name HB#) (resid 79 and name HN) 5.0 3.2 0.0
assign (resid 78 and name HA) (resid 83 and name HA) 3.0 1.0 0.0
assign (resid 78 and name HA) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 78 and name HB#) (resid 83 and name HA) 5.0 3.2 0.0
assign (resid 78 and name HB#) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 78 and name HA) (resid 84 and name HN) 4.0 1.9 0.0
assign (resid 78 and name HB#) (resid 84 and name HN) 5.0 3.0 0.0
assign (resid 78 and name HN) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 79 and name HA) (resid 80 and name HA) 4.8 3.0 0.0
assign (resid 79 and name HA) (resid 80 and name HB#) 5.7 3.9 0.0
assign (resid 79 and name HA) (resid 80 and name HN) 4.0 1.9 0.0
assign (resid 79 and name HB#) (resid 80 and name HB#) 6.0 4.2 0.0
assign (resid 79 and name HB#) (resid 80 and name HN) 4.8 3.0 0.0
assign (resid 79 and name HD#) (resid 80 and name HN) 5.0 3.2 0.0
assign (resid 79 and name HG#) (resid 80 and name HB#) 4.9 3.1 0.0
assign (resid 79 and name HG#) (resid 80 and name HN) 5.0 2.2 0.0
assign (resid 79 and name HN) (resid 80 and name HN) 5.7 3.9 0.0
assign (resid 79 and name HA) (resid 81 and name HN) 5.0 3.2 0.0
assign (resid 79 and name HG#) (resid 81 and name HN) 5.0 3.2 0.0
assign (resid 79 and name HA) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 79 and name HN) (resid 82 and name HB#) 5.0 3.2 0.0
assign (resid 79 and name HN) (resid 82 and name HG) 5.0 3.2 0.0
assign (resid 79 and name HN) (resid 82 and name HN) 4.5 2.0 0.0
assign (resid 79 and name HA) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 79 and name HN) (resid 83 and name HA) 4.5 1.9 0.0
assign (resid 79 and name HN) (resid 83 and name HD*) 5.0 3.2 0.0
assign (resid 80 and name HA) (resid 80 and name HN) 3.6 1.8 0.0
assign (resid 80 and name HA) (resid 81 and name HA#) 5.0 3.2 0.0
assign (resid 80 and name HA) (resid 81 and name HN) 4.2 2.4 0.0
assign (resid 80 and name HB#) (resid 81 and name HA#) 6.0 4.2 0.0
assign (resid 80 and name HB#) (resid 81 and name HN) 5.3 3.5 0.0
assign (resid 80 and name HN) (resid 81 and name HN) 4.3 2.5 0.0
assign (resid 80 and name HA) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 80 and name HB#) (resid 82 and name HD*) 5.0 3.2 0.0
assign (resid 80 and name HB#) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 80 and name HN) (resid 82 and name HN) 5.0 3.2 0.0
assign (resid 81 and name HA#) (resid 81 and name HN) 3.6 1.8 0.0
assign (resid 81 and name HA#) (resid 82 and name HN) 4.3 2.5 0.0
assign (resid 81 and name HN) (resid 82 and name HD*) 6.0 4.2 0.0
assign (resid 81 and name HN) (resid 82 and name HG) 5.3 3.5 0.0
assign (resid 81 and name HN) (resid 82 and name HN) 4.1 2.3 0.0
assign (resid 82 and name HG) (resid 82 and name HN) 4.7 2.9 0.0
assign (resid 82 and name HA) (resid 83 and name HN) 2.7 0.9 0.0
assign (resid 82 and name HB#) (resid 83 and name HN) 5.0 3.2 0.0
assign (resid 82 and name HD*) (resid 83 and name HN) 5.1 3.3 0.0
assign (resid 82 and name HG) (resid 83 and name HN) 5.3 3.5 0.0
assign (resid 82 and name HN) (resid 83 and name HN) 4.8 3.0 0.0
assign (resid 83 and name HA) (resid 84 and name HN) 2.7 0.9 0.0
assign (resid 83 and name HB#) (resid 84 and name HN) 5.0 3.2 0.0
assign (resid 83 and name HD*) (resid 84 and name HN) 4.7 2.9 0.0
assign (resid 83 and name HG) (resid 84 and name HN) 5.2 3.4 0.0
assign (resid 83 and name HN) (resid 84 and name HN) 4.8 3.0 0.0
assign (resid 83 and name HB#) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 83 and name HB#) (resid 85 and name HZ) 5.0 3.2 0.0
assign (resid 83 and name HD*) (resid 85 and name HD#) 5.0 3.2 0.0
assign (resid 83 and name HD*) (resid 85 and name HZ) 5.0 3.2 0.0
assign (resid 83 and name HN) (resid 85 and name HE#) 5.0 3.2 0.0
assign (resid 84 and name HA#) (resid 84 and name HN) 3.6 1.8 0.0
assign (resid 84 and name HA#) (resid 85 and name HN) 2.7 0.9 0.0
assign (resid 84 and name HN) (resid 85 and name HN) 4.8 3.0 0.0
assign (resid 85 and name HB#) (resid 85 and name HN) 4.4 2.6 0.0
assign (resid 85 and name HA) (resid 86 and name HN) 2.7 0.9 0.0
assign (resid 85 and name HB#) (resid 86 and name HN) 5.0 3.2 0.0
assign (resid 85 and name HN) (resid 86 and name HN) 4.8 3.0 0.0
assign (resid 86 and name HA) (resid 87 and name HN) 2.7 0.9 0.0
assign (resid 86 and name HN) (resid 87 and name HN) 4.8 3.0 0.0
assign (resid 86 and name HB#) (resid 88 and name HE2#) 5.0 3.2 0.0
assign (resid 86 and name HN) (resid 88 and name HE2#) 5.0 3.2 0.0
assign (resid 87 and name HA) (resid 88 and name HN) 2.7 0.9 0.0
assign (resid 87 and name HB#) (resid 88 and name HN) 5.0 3.2 0.0
assign (resid 87 and name HN) (resid 88 and name HN) 4.8 3.0 0.0
assign (resid 87 and name HA) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 87 and name HB#) (resid 89 and name HN) 5.0 3.2 0.0
assign (resid 87 and name HB#) (resid 90 and name HD1#) 5.0 3.2 0.0
assign (resid 87 and name HB#) (resid 90 and name HG2#) 5.0 3.2 0.0
assign (resid 88 and name HE2#) (resid 88 and name HG#) 4.7 2.9 0.0
assign (resid 88 and name HA) (resid 89 and name HN) 4.8 3.0 0.0
assign (resid 88 and name HB#) (resid 89 and name HD2) 6.0 4.2 0.0
assign (resid 88 and name HB#) (resid 89 and name HN) 4.9 3.1 0.0
assign (resid 88 and name HG#) (resid 89 and name HB#) 5.1 3.3 0.0
assign (resid 88 and name HG#) (resid 89 and name HD2) 5.9 4.1 0.0
assign (resid 88 and name HG#) (resid 89 and name HN) 5.4 3.6 0.0
assign (resid 88 and name HN) (resid 89 and name HN) 3.6 1.8 0.0
assign (resid 89 and name HA) (resid 90 and name HB) 4.9 3.1 0.0
assign (resid 89 and name HA) (resid 90 and name HG2#) 5.0 3.2 0.0
assign (resid 89 and name HA) (resid 90 and name HN) 2.7 0.9 0.0
assign (resid 89 and name HB#) (resid 90 and name HA) 5.3 3.5 0.0
assign (resid 89 and name HB#) (resid 90 and name HN) 5.0 3.2 0.0
assign (resid 89 and name HD2) (resid 90 and name HN) 6.0 4.2 0.0
assign (resid 89 and name HN) (resid 90 and name HG2#) 5.8 4.0 0.0
assign (resid 89 and name HE1) (resid 91 and name HA) 5.0 3.0 0.0
assign (resid 89 and name HE1) (resid 91 and name HB1) 5.0 3.0 0.0
assign (resid 90 and name HA) (resid 91 and name HB#) 5.8 4.0 0.0
assign (resid 90 and name HA) (resid 91 and name HN) 3.7 1.9 0.0
assign (resid 90 and name HB) (resid 91 and name HN) 4.1 2.3 0.0
assign (resid 90 and name HD1#) (resid 91 and name HN) 5.1 3.3 0.0
assign (resid 90 and name HG1#) (resid 91 and name HN) 5.1 3.3 0.0
assign (resid 90 and name HG2#) (resid 91 and name HN) 5.1 3.3 0.0
assign (resid 90 and name HN) (resid 91 and name HN) 5.2 3.5 0.0
assign (resid 90 and name HD1#) (resid 94 and name HB#) 5.0 3.2 0.0
assign (resid 90 and name HG1#) (resid 94 and name HN) 5.0 3.2 0.0
assign (resid 90 and name HG2#) (resid 94 and name HB#) 5.0 3.2 0.0
assign (resid 90 and name HD1#) (resid 95 and name HA) 5.0 3.2 0.0
assign (resid 90 and name HD1#) (resid 95 and name HG1#) 5.0 3.2 0.0
assign (resid 90 and name HG1#) (resid 95 and name HN) 5.0 3.2 0.0
assign (resid 90 and name HG2#) (resid 95 and name HA) 5.0 3.2 0.0
assign (resid 90 and name HG2#) (resid 95 and name HB) 5.0 3.2 0.0
assign (resid 90 and name HG2#) (resid 95 and name HG1#) 5.0 3.2 0.0
assign (resid 91 and name HB#) (resid 91 and name HN) 4.2 2.4 0.0
assign (resid 91 and name HA) (resid 92 and name HA) 5.4 3.6 0.0
assign (resid 91 and name HA) (resid 92 and name HB#) 5.2 3.4 0.0
assign (resid 91 and name HA) (resid 92 and name HN) 3.7 1.9 0.0
assign (resid 91 and name HB#) (resid 92 and name HB#) 5.8 4.0 0.0
assign (resid 91 and name HB#) (resid 92 and name HN) 4.2 2.4 0.0
assign (resid 91 and name HN) (resid 92 and name HN) 4.8 3.0 0.0
assign (resid 91 and name HA) (resid 93 and name HN) 5.0 3.2 0.0
assign (resid 91 and name HB#) (resid 93 and name HN) 5.0 3.2 0.0
assign (resid 91 and name HB#) (resid 94 and name HN) 5.0 3.2 0.0
assign (resid 91 and name HN) (resid 94 and name HB#) 5.0 3.2 0.0
assign (resid 92 and name HA) (resid 92 and name HN) 4.3 2.5 0.0
assign (resid 92 and name HB#) (resid 92 and name HN) 4.0 2.2 0.0
assign (resid 92 and name HA) (resid 93 and name HN) 4.0 2.2 0.0
assign (resid 92 and name HB#) (resid 93 and name HA) 5.2 3.4 0.0
assign (resid 92 and name HB#) (resid 93 and name HB#) 5.3 3.5 0.0
assign (resid 92 and name HB#) (resid 93 and name HN) 4.6 2.8 0.0
assign (resid 92 and name HD*) (resid 93 and name HA) 5.1 3.3 0.0
assign (resid 92 and name HD*) (resid 93 and name HN) 5.1 3.3 0.0
assign (resid 92 and name HA) (resid 94 and name HN) 4.9 3.1 0.0
assign (resid 92 and name HB#) (resid 94 and name HN) 5.0 3.2 0.0
assign (resid 92 and name HA) (resid 95 and name HB) 5.0 3.2 0.0
assign (resid 92 and name HA) (resid 95 and name HD1#) 5.0 3.2 0.0
assign (resid 92 and name HA) (resid 95 and name HG2#) 5.0 3.2 0.0
assign (resid 92 and name HA) (resid 95 and name HN) 3.9 2.1 0.0
assign (resid 92 and name HG) (resid 95 and name HG2#) 5.0 3.2 0.0
assign (resid 92 and name HA) (resid 96 and name HN) 4.7 2.9 0.0
assign (resid 92 and name HG) (resid 96 and name HN) 5.0 3.2 0.0
assign (resid 93 and name HA) (resid 93 and name HN) 4.5 2.7 0.0
assign (resid 93 and name HB#) (resid 93 and name HN) 4.0 2.2 0.0
assign (resid 93 and name HA) (resid 94 and name HN) 4.0 2.2 0.0
assign (resid 93 and name HB#) (resid 94 and name HN) 4.6 2.8 0.0
assign (resid 93 and name HA) (resid 95 and name HN) 4.9 3.1 0.0
assign (resid 93 and name HA) (resid 96 and name HB#) 5.0 3.2 0.0
assign (resid 93 and name HA) (resid 96 and name HN) 3.9 2.1 0.0
assign (resid 93 and name HN) (resid 96 and name HB#) 5.0 3.2 0.0
assign (resid 93 and name HB#) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 94 and name HA) (resid 94 and name HN) 5.0 3.2 0.0
assign (resid 94 and name HB#) (resid 95 and name HN) 4.6 2.8 0.0
assign (resid 94 and name HN) (resid 95 and name HB) 5.3 3.5 0.0
assign (resid 94 and name HN) (resid 96 and name HN) 4.7 2.9 0.0
assign (resid 94 and name HA) (resid 97 and name HB1) 5.0 3.2 0.0
assign (resid 94 and name HA) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 94 and name HA) (resid 97 and name HN) 3.9 2.1 0.0
assign (resid 94 and name HN) (resid 97 and name HD2) 5.0 3.2 0.0
assign (resid 94 and name HA) (resid 98 and name HN) 4.7 2.9 0.0
assign (resid 95 and name HB) (resid 95 and name HN) 3.7 1.9 0.0
assign (resid 95 and name HG1#) (resid 95 and name HN) 4.3 2.5 0.0
assign (resid 95 and name HA) (resid 96 and name HN) 4.0 2.2 0.0
assign (resid 95 and name HB) (resid 96 and name HN) 4.6 2.8 0.0
assign (resid 95 and name HD1#) (resid 96 and name HN) 6.0 4.2 0.0
assign (resid 95 and name HG2#) (resid 96 and name HA) 4.1 2.3 0.0
assign (resid 95 and name HG2#) (resid 96 and name HB#) 4.3 2.5 0.0
assign (resid 95 and name HG2#) (resid 96 and name HN) 5.0 3.2 0.0
assign (resid 95 and name HN) (resid 96 and name HA) 5.5 3.7 0.0
assign (resid 95 and name HN) (resid 96 and name HB#) 5.0 3.2 0.0
assign (resid 95 and name HN) (resid 96 and name HN) 3.3 1.5 0.0
assign (resid 95 and name HA) (resid 97 and name HN) 4.9 3.1 0.0
assign (resid 95 and name HN) (resid 97 and name HN) 4.7 2.9 0.0
assign (resid 95 and name HA) (resid 98 and name HB#) 5.0 3.2 0.0
assign (resid 95 and name HA) (resid 98 and name HD*) 5.0 3.2 0.0
assign (resid 95 and name HA) (resid 98 and name HN) 3.9 2.1 0.0
assign (resid 95 and name HG2#) (resid 98 and name HN) 5.0 3.2 0.0
assign (resid 95 and name HA) (resid 99 and name HN) 4.7 2.9 0.0
assign (resid 95 and name HG1#) (resid 99 and name HD#) 5.0 3.2 0.0
assign (resid 95 and name HG2#) (resid 99 and name HB#) 5.0 3.2 0.0
assign (resid 95 and name HG2#) (resid 99 and name HN) 5.0 3.2 0.0
assign (resid 96 and name HA) (resid 96 and name HN) 4.0 2.2 0.0
assign (resid 96 and name HB#) (resid 96 and name HN) 3.9 2.1 0.0
assign (resid 96 and name HA) (resid 97 and name HN) 4.0 2.2 0.0
assign (resid 96 and name HB#) (resid 97 and name HA) 5.2 3.4 0.0
assign (resid 96 and name HB#) (resid 97 and name HB1) 5.2 3.4 0.0
assign (resid 96 and name HB#) (resid 97 and name HN) 4.6 2.8 0.0
assign (resid 96 and name HN) (resid 97 and name HN) 3.3 1.5 0.0
assign (resid 96 and name HA) (resid 98 and name HN) 4.9 3.1 0.0
assign (resid 96 and name HB#) (resid 98 and name HN) 5.0 3.2 0.0
assign (resid 96 and name HN) (resid 98 and name HN) 4.7 2.9 0.0
assign (resid 96 and name HA) (resid 99 and name HB#) 5.0 3.2 0.0
assign (resid 96 and name HA) (resid 99 and name HD#) 5.0 3.2 0.0
assign (resid 96 and name HA) (resid 99 and name HN) 3.9 2.1 0.0
assign (resid 96 and name HB#) (resid 99 and name HB#) 5.0 3.2 0.0
assign (resid 96 and name HB#) (resid 99 and name HD#) 5.0 3.2 0.0
assign (resid 96 and name HB#) (resid 99 and name HN) 5.0 3.2 0.0
assign (resid 96 and name HN) (resid 99 and name HD#) 5.0 3.2 0.0
assign (resid 96 and name HA) (resid 100 and name HN) 4.7 2.9 0.0
assign (resid 97 and name HB2) (resid 97 and name HN) 5.1 3.3 0.0
assign (resid 97 and name HA) (resid 98 and name HN) 4.0 2.2 0.0
assign (resid 97 and name HB1) (resid 98 and name HA) 5.2 3.4 0.0
assign (resid 97 and name HB1) (resid 98 and name HN) 4.6 2.8 0.0
assign (resid 97 and name HB2) (resid 98 and name HN) 5.3 3.5 0.0
assign (resid 97 and name HN) (resid 98 and name HN) 3.3 1.5 0.0
assign (resid 97 and name HA) (resid 99 and name HN) 4.9 3.1 0.0
assign (resid 97 and name HN) (resid 99 and name HN) 4.7 2.9 0.0
assign (resid 97 and name HA) (resid 100 and name HD#) 5.0 3.2 0.0
assign (resid 97 and name HA) (resid 100 and name HG#) 5.0 3.2 0.0
assign (resid 97 and name HA) (resid 100 and name HN) 3.9 2.1 0.0
assign (resid 97 and name HN) (resid 100 and name HG#) 5.0 3.2 0.0
assign (resid 98 and name HB#) (resid 98 and name HN) 4.4 2.6 0.0
assign (resid 98 and name HA) (resid 99 and name HN) 4.0 2.2 0.0
assign (resid 98 and name HB#) (resid 99 and name HN) 4.6 2.8 0.0
assign (resid 98 and name HD*) (resid 99 and name HN) 4.1 2.3 0.0
assign (resid 98 and name HN) (resid 99 and name HN) 3.3 1.5 0.0
assign (resid 98 and name HA) (resid 101 and name HN) 3.9 2.1 0.0
assign (resid 98 and name HD*) (resid 101 and name HD*) 5.0 3.2 0.0
assign (resid 98 and name HD*) (resid 101 and name HN) 5.0 3.2 0.0
assign (resid 98 and name HA) (resid 102 and name HN) 4.7 2.9 0.0
assign (resid 98 and name HD*) (resid 102 and name HG*) 5.0 3.2 0.0
assign (resid 99 and name HB#) (resid 99 and name HN) 4.2 2.5 0.0
assign (resid 99 and name HA) (resid 100 and name HN) 4.0 2.2 0.0
assign (resid 99 and name HB#) (resid 100 and name HN) 4.6 2.8 0.0
assign (resid 99 and name HD#) (resid 100 and name HN) 5.1 3.3 0.0
assign (resid 99 and name HN) (resid 100 and name HN) 3.3 1.5 0.0
assign (resid 99 and name HA) (resid 101 and name HN) 4.9 3.1 0.0
assign (resid 99 and name HA) (resid 102 and name HB) 5.0 3.2 0.0
assign (resid 99 and name HA) (resid 102 and name HG*) 5.0 3.2 0.0
assign (resid 99 and name HA) (resid 102 and name HN) 3.9 2.1 0.0
assign (resid 99 and name HA) (resid 103 and name HN) 4.7 2.9 0.0
assign (resid 100 and name HA) (resid 101 and name HN) 4.0 2.2 0.0
assign (resid 100 and name HB#) (resid 101 and name HN) 4.6 2.8 0.0
assign (resid 100 and name HD#) (resid 101 and name HN) 6.0 4.2 0.0
assign (resid 100 and name HG#) (resid 101 and name HN) 5.1 3.3 0.0
assign (resid 100 and name HN) (resid 101 and name HA) 5.7 3.9 0.0
assign (resid 100 and name HN) (resid 101 and name HN) 3.3 1.5 0.0
assign (resid 100 and name HA) (resid 102 and name HN) 4.9 3.1 0.0
assign (resid 100 and name HN) (resid 102 and name HN) 4.7 2.9 0.0
assign (resid 100 and name HA) (resid 103 and name HB#) 5.0 3.2 0.0
assign (resid 100 and name HA) (resid 103 and name HG#) 5.0 3.2 0.0
assign (resid 100 and name HA) (resid 103 and name HN) 3.9 2.1 0.0
assign (resid 100 and name HA) (resid 104 and name HD*) 5.0 3.2 0.0
assign (resid 100 and name HA) (resid 104 and name HN) 4.7 2.9 0.0
assign (resid 100 and name HB#) (resid 104 and name HD*) 5.0 3.2 0.0
assign (resid 100 and name HD#) (resid 104 and name HD*) 5.0 3.2 0.0
assign (resid 101 and name HA) (resid 101 and name HN) 4.2 2.4 0.0
assign (resid 101 and name HB#) (resid 101 and name HN) 3.9 2.1 0.0
assign (resid 101 and name HG) (resid 101 and name HN) 4.2 2.4 0.0
assign (resid 101 and name HA) (resid 102 and name HN) 4.0 2.2 0.0
assign (resid 101 and name HB#) (resid 102 and name HN) 4.6 2.8 0.0
assign (resid 101 and name HN) (resid 102 and name HA) 6.0 4.2 0.0
assign (resid 101 and name HN) (resid 102 and name HB) 4.7 2.9 0.0
assign (resid 101 and name HN) (resid 102 and name HG*) 5.0 3.2 0.0
assign (resid 101 and name HN) (resid 102 and name HN) 3.3 1.5 0.0
assign (resid 101 and name HN) (resid 103 and name HN) 4.7 2.9 0.0
assign (resid 101 and name HA) (resid 104 and name HN) 3.9 2.1 0.0
assign (resid 101 and name HD*) (resid 104 and name HB2) 5.0 3.2 0.0
assign (resid 101 and name HD*) (resid 104 and name HD*) 5.0 3.2 0.0
assign (resid 101 and name HD*) (resid 104 and name HN) 5.0 3.2 0.0
assign (resid 101 and name HA) (resid 105 and name HD2#) 5.0 3.2 0.0
assign (resid 101 and name HB#) (resid 105 and name HD2#) 5.0 3.2 0.0
assign (resid 101 and name HD*) (resid 105 and name HD2#) 5.0 3.2 0.0
assign (resid 101 and name HD*) (resid 105 and name HN) 5.0 3.2 0.0
assign (resid 102 and name HB) (resid 102 and name HN) 3.6 1.8 0.0
assign (resid 102 and name HB) (resid 103 and name HN) 4.6 2.8 0.0
assign (resid 102 and name HG*) (resid 103 and name HA) 5.3 3.5 0.0
assign (resid 102 and name HN) (resid 103 and name HN) 3.3 1.5 0.0
assign (resid 102 and name HA) (resid 104 and name HN) 4.9 3.1 0.0
assign (resid 102 and name HN) (resid 104 and name HN) 4.7 2.9 0.0
assign (resid 102 and name HA) (resid 105 and name HB#) 5.0 3.2 0.0
assign (resid 102 and name HA) (resid 105 and name HN) 3.9 2.1 0.0
assign (resid 102 and name HA) (resid 106 and name HD*) 5.0 3.2 0.0
assign (resid 102 and name HG*) (resid 106 and name HD*) 5.0 3.2 0.0
assign (resid 103 and name HA) (resid 104 and name HN) 4.0 2.2 0.0
assign (resid 103 and name HB#) (resid 104 and name HB2) 4.9 3.1 0.0
assign (resid 103 and name HB#) (resid 104 and name HG) 5.8 4.0 0.0
assign (resid 103 and name HB#) (resid 104 and name HN) 4.6 2.8 0.0
assign (resid 103 and name HG#) (resid 104 and name HA) 5.7 3.9 0.0
assign (resid 103 and name HG#) (resid 104 and name HD*) 5.3 3.5 0.0
assign (resid 103 and name HG#) (resid 104 and name HN) 5.7 3.9 0.0
assign (resid 103 and name HN) (resid 104 and name HA) 6.0 4.2 0.0
assign (resid 103 and name HN) (resid 104 and name HB2) 5.3 3.5 0.0
assign (resid 103 and name HN) (resid 104 and name HN) 3.3 1.5 0.0
assign (resid 103 and name HN) (resid 105 and name HN) 4.7 2.9 0.0
assign (resid 103 and name HA) (resid 106 and name HD*) 5.0 3.2 0.0
assign (resid 103 and name HB#) (resid 106 and name HD*) 5.0 3.2 0.0
assign (resid 104 and name HA) (resid 104 and name HN) 4.1 2.3 0.0
assign (resid 104 and name HB2) (resid 104 and name HN) 3.7 1.9 0.0
assign (resid 104 and name HA) (resid 105 and name HA) 5.7 3.9 0.0
assign (resid 104 and name HA) (resid 105 and name HN) 4.0 2.2 0.0
assign (resid 104 and name HB1) (resid 105 and name HA) 5.2 3.4 0.0
assign (resid 104 and name HB1) (resid 105 and name HB#) 5.5 3.7 0.0
assign (resid 104 and name HB1) (resid 105 and name HD2#) 5.6 3.8 0.0
assign (resid 104 and name HB1) (resid 105 and name HN) 4.6 2.8 0.0
assign (resid 104 and name HB2) (resid 105 and name HD2#) 5.0 3.2 0.0
assign (resid 104 and name HB2) (resid 105 and name HN) 4.4 2.6 0.0
assign (resid 104 and name HG) (resid 105 and name HN) 5.9 4.1 0.0
assign (resid 104 and name HN) (resid 105 and name HN) 3.3 1.5 0.0
assign (resid 104 and name HA) (resid 107 and name HA#) 5.0 3.2 0.0
assign (resid 105 and name HB#) (resid 105 and name HN) 4.3 2.5 0.0
assign (resid 105 and name HA) (resid 107 and name HA#) 5.0 3.0 0.0
assign (resid 105 and name HA) (resid 107 and name HA#) 5.0 3.2 0.0
assign (resid 105 and name HA) (resid 107 and name HN) 5.0 3.2 0.0
assign (resid 105 and name HN) (resid 107 and name HN) 5.0 3.2 0.0
assign (resid 106 and name HA) (resid 107 and name HN) 4.8 3.0 0.0
assign (resid 106 and name HD*) (resid 107 and name HN) 6.0 4.2 0.0
assign (resid 107 and name HA#) (resid 108 and name HA) 5.0 3.0 0.0
assign (resid 107 and name HN) (resid 108 and name HA) 5.0 3.0 0.0
assign (resid 115 and name HG#) (resid 116 and name HN) 5.0 3.0 0.0
assign (resid 116 and name HA) (resid 117 and name HN) 4.0 2.2 0.0
assign (resid 116 and name HB#) (resid 117 and name HA) 5.7 3.9 0.0
assign (resid 116 and name HB#) (resid 117 and name HB#) 6.0 4.2 0.0
assign (resid 116 and name HB#) (resid 117 and name HN) 5.5 3.0 0.0
assign (resid 116 and name HD*) (resid 117 and name HA) 5.3 3.5 0.0
assign (resid 116 and name HD*) (resid 117 and name HN) 6.0 4.2 0.0
assign (resid 116 and name HN) (resid 117 and name HN) 3.3 1.5 0.0
assign (resid 116 and name HA) (resid 118 and name HN) 4.9 3.1 0.0
assign (resid 116 and name HA) (resid 118 and name HN) 5.0 2.5 0.0
assign (resid 116 and name HA) (resid 119 and name HB#) 5.0 3.2 0.0
assign (resid 116 and name HA) (resid 119 and name HD*) 5.0 3.2 0.0
assign (resid 116 and name HA) (resid 119 and name HN) 5.0 3.2 0.0
assign (resid 117 and name HA) (resid 117 and name HN) 4.2 2.4 0.0
assign (resid 117 and name HB#) (resid 117 and name HN) 3.9 2.1 0.0
assign (resid 117 and name HA) (resid 118 and name HN) 5.0 3.2 0.0
assign (resid 117 and name HB#) (resid 118 and name HA) 6.0 4.2 0.0
assign (resid 117 and name HB#) (resid 118 and name HD*) 5.9 4.1 0.0
assign (resid 117 and name HB#) (resid 118 and name HG) 5.5 3.6 0.0
assign (resid 117 and name HB#) (resid 118 and name HN) 4.6 2.8 0.0
assign (resid 117 and name HN) (resid 118 and name HN) 3.3 1.5 0.0
assign (resid 117 and name HN) (resid 119 and name HN) 5.0 2.5 0.0
assign (resid 117 and name HA) (resid 120 and name HB) 5.0 3.2 0.0
assign (resid 117 and name HB#) (resid 120 and name HN) 5.0 2.5 0.0
assign (resid 118 and name HB1) (resid 118 and name HN) 4.0 2.0 1.0
assign (resid 118 and name HB2) (resid 118 and name HA) 5.0 3.2 0.0
assign (resid 118 and name HB2) (resid 118 and name HN) 4.0 2.0 0.0
assign (resid 118 and name HB2) (resid 119 and name HN) 4.5 2.1 0.0
assign (resid 118 and name HD*) (resid 119 and name HN) 5.0 2.6 0.0
assign (resid 118 and name HG) (resid 119 and name HN) 4.6 2.8 0.0
assign (resid 118 and name HN) (resid 119 and name HN) 4.2 2.4 0.0
assign (resid 118 and name HA) (resid 120 and name HN) 5.0 3.2 0.0
assign (resid 118 and name HN) (resid 120 and name HN) 5.0 3.2 0.0
assign (resid 118 and name HA) (resid 121 and name HB#) 5.0 3.2 0.0
assign (resid 118 and name HA) (resid 121 and name HN) 5.0 2.5 0.0
assign (resid 119 and name HA) (resid 119 and name HN) 4.2 2.4 0.0
assign (resid 119 and name HG) (resid 119 and name HN) 4.1 2.3 0.0
assign (resid 119 and name HB#) (resid 120 and name HA) 6.0 4.2 0.0
assign (resid 119 and name HB#) (resid 120 and name HN) 5.2 3.4 0.0
assign (resid 119 and name HN) (resid 120 and name HB) 5.8 4.0 0.0
assign (resid 119 and name HN) (resid 120 and name HG*) 5.0 2.2 0.0
assign (resid 119 and name HN) (resid 121 and name HN) 5.0 2.5 0.0
assign (resid 119 and name HD*) (resid 123 and name HB#) 5.0 3.0 0.0
assign (resid 119 and name HD*) (resid 123 and name HB#) 5.0 3.2 0.0
assign (resid 120 and name HA) (resid 120 and name HN) 4.4 2.6 0.0
assign (resid 120 and name HB) (resid 120 and name HN) 4.3 2.5 0.0
assign (resid 120 and name HG*) (resid 120 and name HN) 5.1 3.3 0.0
assign (resid 120 and name HA) (resid 121 and name HA) 6.0 4.2 0.0
assign (resid 120 and name HA) (resid 121 and name HB#) 5.8 4.0 0.0
assign (resid 120 and name HA) (resid 121 and name HN) 4.5 2.7 0.0
assign (resid 120 and name HB) (resid 121 and name HA) 6.0 4.2 0.0
assign (resid 120 and name HB) (resid 121 and name HB#) 5.0 3.0 0.0
assign (resid 120 and name HB) (resid 121 and name HB#) 6.0 4.2 0.0
assign (resid 120 and name HB) (resid 121 and name HN) 5.1 3.3 0.0
assign (resid 120 and name HG*) (resid 121 and name HA) 5.5 3.0 0.0
assign (resid 120 and name HG*) (resid 121 and name HB#) 5.0 3.0 0.0
assign (resid 120 and name HG*) (resid 121 and name HN) 6.0 4.2 0.0
assign (resid 120 and name HN) (resid 121 and name HB#) 6.0 4.2 0.0
assign (resid 120 and name HN) (resid 121 and name HN) 3.5 0.7 0.0
assign (resid 120 and name HN) (resid 122 and name HN) 5.0 2.5 0.0
assign (resid 121 and name HA) (resid 121 and name HN) 5.0 3.2 0.0
assign (resid 121 and name HB#) (resid 121 and name HN) 4.9 3.1 0.0
assign (resid 121 and name HA) (resid 122 and name HB#) 6.0 4.2 0.0
assign (resid 121 and name HA) (resid 122 and name HN) 4.4 2.6 0.0
assign (resid 121 and name HB#) (resid 122 and name HA) 5.2 3.0 0.0
assign (resid 121 and name HB#) (resid 122 and name HB#) 5.0 3.0 0.0
assign (resid 121 and name HB#) (resid 122 and name HN) 5.1 3.3 0.0
assign (resid 122 and name HA) (resid 123 and name HA) 5.0 3.0 0.0
assign (resid 122 and name HA) (resid 123 and name HB#) 6.0 4.2 0.0
assign (resid 122 and name HA) (resid 123 and name HD2) 6.0 4.2 0.0
assign (resid 122 and name HA) (resid 123 and name HN) 4.2 2.4 0.0
assign (resid 122 and name HB#) (resid 123 and name HA) 5.0 3.0 0.0
assign (resid 122 and name HB#) (resid 123 and name HA) 6.0 4.2 0.0
assign (resid 122 and name HB#) (resid 123 and name HB#) 5.0 3.0 0.0
assign (resid 122 and name HB#) (resid 123 and name HD2) 6.0 4.2 0.0
assign (resid 122 and name HB#) (resid 123 and name HN) 4.8 3.0 0.0
assign (resid 123 and name HB#) (resid 123 and name HN) 4.6 2.8 0.0
assign (resid 123 and name HA) (resid 124 and name HN) 6.0 4.2 0.0
assign (resid 123 and name HB#) (resid 124 and name HN) 5.8 4.0 0.0
assign (resid 123 and name HD2) (resid 124 and name HN) 6.0 4.2 0.0
assign (resid 123 and name HE1) (resid 124 and name HA) 5.0 3.0 0.0
assign (resid 123 and name HB#) (resid 125 and name HN) 5.0 3.2 0.0
assign (resid 123 and name HD2) (resid 125 and name HN) 5.0 3.2 0.0
assign (resid 124 and name HB#) (resid 124 and name HN) 5.4 3.6 0.0
assign (resid 124 and name HA) (resid 125 and name HN) 5.7 3.9 0.0
assign (resid 124 and name HB#) (resid 125 and name HN) 6.0 4.2 0.0
assign (resid 124 and name HN) (resid 125 and name HN) 6.0 4.2 0.0
assign (resid 125 and name HA) (resid 125 and name HN) 5.8 4.0 0.0
assign (resid 125 and name HB#) (resid 125 and name HN) 6.0 4.2 0.0

REMARK hydrogen bonds

assign (resid 501 and name N7) (resid 77 and name HE1) 1.8 0.0 0.5
assign (resid 501 and name N7) (resid 77 and name NE1) 2.8 0.0 0.5
assign (resid 501 and name O1P) (resid 503 and name H1) 2.5 0.7 0.5
assign (resid 501 and name O1P) (resid 503 and name H21) 2.5 0.7 0.5
assign (resid 501 and name O1P) (resid 503 and name N1) 3.5 0.7 0.5
assign (resid 501 and name O1P) (resid 503 and name N2) 3.5 0.7 0.5
assign (resid 502 and name N7) (resid 9 and name HE) 1.8 0.0 0.5
assign (resid 502 and name N7) (resid 9 and name NE) 2.8 0.0 0.5
assign (resid 504 and name O1P) (resid 502 and name H1) 2.5 0.7 0.5
assign (resid 504 and name O1P) (resid 502 and name H21) 2.5 0.7 0.5
assign (resid 504 and name O1P) (resid 502 and name N1) 3.5 0.7 0.5
assign (resid 504 and name O1P) (resid 502 and name N2) 3.5 0.7 0.5
assign (resid 18 and name O) (resid 33 and name HN) 2.0 0.2 0.5
assign (resid 18 and name O) (resid 33 and name N) 3.0 0.2 0.5
assign (resid 19 and name O) (resid 62 and name HN) 2.0 0.2 0.5
assign (resid 19 and name O) (resid 62 and name N) 3.0 0.2 0.5
assign (resid 20 and name O) (resid 31 and name HN) 2.0 0.2 0.5
assign (resid 20 and name O) (resid 31 and name N) 3.0 0.2 0.5
assign (resid 21 and name O) (resid 60 and name HN) 2.0 0.2 0.5
assign (resid 21 and name O) (resid 60 and name N) 3.0 0.2 0.5
assign (resid 22 and name O) (resid 29 and name HN) 2.5 0.2 0.5
assign (resid 22 and name O) (resid 29 and name N) 3.5 0.2 0.5
assign (resid 23 and name O) (resid 58 and name HN) 2.0 0.2 0.5
assign (resid 23 and name O) (resid 58 and name N) 3.0 0.2 0.5
assign (resid 24 and name O) (resid 27 and name HN) 2.0 0.2 0.5
assign (resid 24 and name O) (resid 27 and name N) 3.0 0.2 0.5
assign (resid 27 and name O) (resid 24 and name HN) 2.0 0.2 0.5
assign (resid 27 and name O) (resid 24 and name N) 3.0 0.2 0.5
assign (resid 29 and name O) (resid 22 and name HN) 2.0 0.2 0.5
assign (resid 29 and name O) (resid 22 and name N) 3.0 0.2 0.5
assign (resid 31 and name O) (resid 20 and name HN) 2.0 0.2 0.5
assign (resid 31 and name O) (resid 20 and name N) 3.0 0.2 0.5
assign (resid 32 and name O) (resid 44 and name HN) 2.0 0.2 0.5
assign (resid 32 and name O) (resid 44 and name N) 3.0 0.2 0.5
assign (resid 35 and name O) (resid 42 and name HN) 2.0 0.2 1.0
assign (resid 35 and name O) (resid 42 and name N) 3.0 0.2 1.0
assign (resid 37 and name O) (resid 40 and name HN) 2.0 0.2 0.5
assign (resid 37 and name O) (resid 40 and name N) 3.0 0.2 0.5
assign (resid 39 and name O) (resid 87 and name HN) 2.0 0.2 0.5
assign (resid 39 and name O) (resid 87 and name N) 3.0 0.2 0.5
assign (resid 40 and name O) (resid 37 and name HN) 2.0 0.2 0.5
assign (resid 40 and name O) (resid 37 and name N) 3.0 0.2 0.5
assign (resid 41 and name O) (resid 85 and name HN) 2.0 0.2 0.5
assign (resid 41 and name O) (resid 85 and name N) 3.0 0.2 0.5
assign (resid 42 and name O) (resid 34 and name HN) 2.0 0.2 1.0
assign (resid 42 and name O) (resid 34 and name N) 3.0 0.2 1.0
assign (resid 42 and name O) (resid 35 and name HN) 2.0 0.2 1.0
assign (resid 42 and name O) (resid 35 and name N) 3.0 0.2 1.0
assign (resid 43 and name O) (resid 83 and name HN) 2.0 0.2 0.5
assign (resid 43 and name O) (resid 83 and name N) 3.0 0.2 0.5
assign (resid 57 and name O) (resid 73 and name HN) 2.0 0.2 0.5
assign (resid 57 and name O) (resid 73 and name N) 3.0 0.2 0.5
assign (resid 58 and name O) (resid 23 and name HN) 2.0 0.2 0.5
assign (resid 58 and name O) (resid 23 and name N) 3.0 0.2 0.5
assign (resid 59 and name O) (resid 71 and name HN) 2.0 0.2 0.5
assign (resid 59 and name O) (resid 71 and name N) 3.0 0.2 0.5
assign (resid 60 and name O) (resid 21 and name HN) 2.0 0.2 0.5
assign (resid 60 and name O) (resid 21 and name N) 3.0 0.2 0.5
assign (resid 61 and name O) (resid 69 and name HN) 2.0 0.2 0.5
assign (resid 61 and name O) (resid 69 and name N) 3.0 0.2 0.5
assign (resid 62 and name O) (resid 19 and name HN) 2.5 1.2 0.5
assign (resid 62 and name O) (resid 19 and name N) 3.5 1.2 0.5
assign (resid 67 and name O) (resid 63 and name HN) 2.0 0.2 0.5
assign (resid 67 and name O) (resid 63 and name N) 3.0 0.2 0.5
assign (resid 69 and name O) (resid 61 and name HN) 2.0 0.2 0.5
assign (resid 69 and name O) (resid 61 and name N) 3.0 0.2 0.5
assign (resid 70 and name O) (resid 91 and name HN) 2.0 0.2 0.5
assign (resid 70 and name O) (resid 91 and name N) 3.0 0.2 0.5
assign (resid 71 and name O) (resid 59 and name HN) 2.0 0.2 0.5
assign (resid 71 and name O) (resid 59 and name N) 3.0 0.2 0.5
assign (resid 73 and name O) (resid 57 and name HN) 2.0 0.2 0.5
assign (resid 73 and name O) (resid 57 and name N) 3.0 0.2 0.5
assign (resid 74 and name O) (resid 86 and name HN) 2.0 0.2 0.5
assign (resid 74 and name O) (resid 86 and name N) 3.0 0.2 0.5
assign (resid 77 and name O) (resid 84 and name HN) 2.0 0.2 1.0
assign (resid 77 and name O) (resid 84 and name N) 3.0 0.2 1.0
assign (resid 79 and name O) (resid 82 and name HN) 2.0 0.2 0.5
assign (resid 79 and name O) (resid 82 and name N) 3.0 0.2 0.5
assign (resid 81 and name O) (resid 45 and name HN) 2.0 0.2 0.5
assign (resid 81 and name O) (resid 45 and name N) 3.0 0.2 0.5
assign (resid 82 and name O) (resid 79 and name HN) 2.0 0.2 0.5
assign (resid 82 and name O) (resid 79 and name N) 3.0 0.2 0.5
assign (resid 83 and name O) (resid 43 and name HN) 2.0 0.2 0.5
assign (resid 83 and name O) (resid 43 and name N) 3.0 0.2 0.5
assign (resid 85 and name O) (resid 41 and name HN) 2.0 0.2 0.5
assign (resid 85 and name O) (resid 41 and name N) 3.0 0.2 0.5
assign (resid 86 and name O) (resid 74 and name HN) 2.0 0.2 0.5
assign (resid 86 and name O) (resid 74 and name N) 3.0 0.2 0.5
assign (resid 89 and name O) (resid 72 and name HN) 2.0 0.2 1.0
assign (resid 89 and name O) (resid 72 and name N) 3.0 0.2 1.0
assign (resid 92 and name O) (resid 96 and name HN) 2.0 0.2 0.5
assign (resid 92 and name O) (resid 96 and name N) 3.0 0.2 0.5
assign (resid 93 and name O) (resid 97 and name HN) 2.0 0.2 0.5
assign (resid 93 and name O) (resid 97 and name N) 3.0 0.2 0.5
assign (resid 94 and name O) (resid 98 and name HN) 2.0 0.2 0.5
assign (resid 94 and name O) (resid 98 and name N) 3.0 0.2 0.5
assign (resid 95 and name O) (resid 99 and name HN) 2.0 0.2 0.5
assign (resid 95 and name O) (resid 99 and name N) 3.0 0.2 0.5
assign (resid 96 and name O) (resid 100 and name HN) 2.0 0.2 0.5
assign (resid 96 and name O) (resid 100 and name N) 3.0 0.2 0.5
assign (resid 97 and name O) (resid 101 and name HN) 2.0 0.2 0.5
assign (resid 97 and name O) (resid 101 and name N) 3.0 0.2 0.5
assign (resid 98 and name O) (resid 102 and name HN) 2.0 0.2 0.5
assign (resid 98 and name O) (resid 102 and name N) 3.0 0.2 0.5
assign (resid 99 and name O) (resid 103 and name HN) 2.0 0.2 0.5
assign (resid 99 and name O) (resid 103 and name N) 3.0 0.2 0.5
assign (resid 100 and name O) (resid 104 and name HN) 2.0 0.2 0.5
assign (resid 100 and name O) (resid 104 and name N) 3.0 0.2 0.5
assign (resid 101 and name O) (resid 105 and name HN) 2.0 0.2 0.5
assign (resid 101 and name O) (resid 105 and name N) 3.0 0.2 0.5

!! TALOS+ restraints
restraints dihedral
assign (resid 2 and name c) (resid 3 and name n)
       (resid 3 and name ca) (resid 3 and name c) 1.0 -78.0 20.0 2

assign (resid 3 and name c) (resid 4 and name n)
       (resid 4 and name ca) (resid 4 and name c) 1.0 -92.0 20.0 2
assign (resid 4 and name n) (resid 4 and name ca)
       (resid 4 and name c) (resid 5 and name n) 1.0 -10.0 24.0 2

assign (resid 6 and name c) (resid 7 and name n)
       (resid 7 and name ca) (resid 7 and name c) 1.0 -89.0 15.0 2
assign (resid 7 and name n) (resid 7 and name ca)
       (resid 7 and name c) (resid 8 and name n) 1.0 117.0 16.0 2

assign (resid 10 and name c) (resid 11 and name n)
       (resid 11 and name ca) (resid 11 and name c) 1.0 -131.0 19.0 2
assign (resid 11 and name n) (resid 11 and name ca)
       (resid 11 and name c) (resid 12 and name n) 1.0 156.0 15.0 2

assign (resid 14 and name c) (resid 15 and name n)
       (resid 15 and name ca) (resid 15 and name c) 1.0 -85.0 10.0 2
assign (resid 15 and name n) (resid 15 and name ca)
       (resid 15 and name c) (resid 16 and name n) 1.0 131.0 9.0 2

assign (resid 15 and name c) (resid 16 and name n)
       (resid 16 and name ca) (resid 16 and name c) 1.0 -129.6 18.3 2
assign (resid 16 and name n) (resid 16 and name ca)
       (resid 16 and name c) (resid 17 and name n) 1.0 142.5 16.0 2

assign (resid 16 and name c) (resid 17 and name n)
       (resid 17 and name ca) (resid 17 and name c) 1.0 -119.5 23.1 2
assign (resid 17 and name n) (resid 17 and name ca)
       (resid 17 and name c) (resid 18 and name n) 1.0 136.9 20.3 2

assign (resid 18 and name c) (resid 19 and name n)
       (resid 19 and name ca) (resid 19 and name c) 1.0 -81.4 14.2 2
assign (resid 19 and name n) (resid 19 and name ca)
       (resid 19 and name c) (resid 20 and name n) 1.0 134.4 21.2 2

assign (resid 19 and name c) (resid 20 and name n)
       (resid 20 and name ca) (resid 20 and name c) 1.0 -128.2 12.8 2
assign (resid 20 and name n) (resid 20 and name ca)
       (resid 20 and name c) (resid 21 and name n) 1.0 149.7 15.8 2

assign (resid 20 and name c) (resid 21 and name n)
       (resid 21 and name ca) (resid 21 and name c) 1.0 -135.1 13.0 2
assign (resid 21 and name n) (resid 21 and name ca)
       (resid 21 and name c) (resid 22 and name n) 1.0 150.0 17.5 2

assign (resid 21 and name c) (resid 22 and name n)
       (resid 22 and name ca) (resid 22 and name c) 1.0 -131.2 15.1 2
assign (resid 22 and name n) (resid 22 and name ca)
       (resid 22 and name c) (resid 23 and name n) 1.0 150.0 13.1 2

assign (resid 22 and name c) (resid 23 and name n)
       (resid 23 and name ca) (resid 23 and name c) 1.0 -118.2 25.4 2
assign (resid 23 and name n) (resid 23 and name ca)
       (resid 23 and name c) (resid 24 and name n) 1.0 139.5 15.8 2

assign (resid 23 and name c) (resid 24 and name n)
       (resid 24 and name ca) (resid 24 and name c) 1.0 -117.8 24.0 2
assign (resid 24 and name n) (resid 24 and name ca)
       (resid 24 and name c) (resid 25 and name n) 1.0 121.9 18.5 2

assign (resid 25 and name c) (resid 26 and name n)
       (resid 26 and name ca) (resid 26 and name c) 1.0 -95.0 10.0 2
assign (resid 26 and name n) (resid 26 and name ca)
       (resid 26 and name c) (resid 27 and name n) 1.0 -1.0 16.0 2

assign (resid 26 and name c) (resid 27 and name n)
       (resid 27 and name ca) (resid 27 and name c) 1.0 -119.1 45.7 2
assign (resid 27 and name n) (resid 27 and name ca)
       (resid 27 and name c) (resid 28 and name n) 1.0 141.8 27.2 2

assign (resid 27 and name c) (resid 28 and name n)
       (resid 28 and name ca) (resid 28 and name c) 1.0 -106.1 24.1 2
assign (resid 28 and name n) (resid 28 and name ca)
       (resid 28 and name c) (resid 29 and name n) 1.0 138.7 18.2 2

assign (resid 28 and name c) (resid 29 and name n)
       (resid 29 and name ca) (resid 29 and name c) 1.0 -127.2 23.6 2
assign (resid 29 and name n) (resid 29 and name ca)
       (resid 29 and name c) (resid 30 and name n) 1.0 133.0 23.4 2

assign (resid 29 and name c) (resid 30 and name n)
       (resid 30 and name ca) (resid 30 and name c) 1.0 -94.7 16.7 2
assign (resid 30 and name n) (resid 30 and name ca)
       (resid 30 and name c) (resid 31 and name n) 1.0 134.1 11.5 2

assign (resid 30 and name c) (resid 31 and name n)
       (resid 31 and name ca) (resid 31 and name c) 1.0 -138.8 11.5 2
assign (resid 31 and name n) (resid 31 and name ca)
       (resid 31 and name c) (resid 32 and name n) 1.0 162.3 9.3 2

assign (resid 31 and name c) (resid 32 and name n)
       (resid 32 and name ca) (resid 32 and name c) 1.0 -105.7 11.8 2
assign (resid 32 and name n) (resid 32 and name ca)
       (resid 32 and name c) (resid 33 and name n) 1.0 122.7 7.0 2

assign (resid 32 and name c) (resid 33 and name n)
       (resid 33 and name ca) (resid 33 and name c) 1.0 -102.4 37.4 2
assign (resid 33 and name n) (resid 33 and name ca)
       (resid 33 and name c) (resid 34 and name n) 1.0 137.3 12.9 2

assign (resid 35 and name c) (resid 36 and name n)
       (resid 36 and name ca) (resid 36 and name c) 1.0 -147.1 11.8 2
assign (resid 36 and name n) (resid 36 and name ca)
       (resid 36 and name c) (resid 37 and name n) 1.0 158.3 10.1 2

assign (resid 36 and name c) (resid 37 and name n)
       (resid 37 and name ca) (resid 37 and name c) 1.0 -116.0 25.7 2
assign (resid 37 and name n) (resid 37 and name ca)
       (resid 37 and name c) (resid 38 and name n) 1.0 166.2 16.2 2

assign (resid 37 and name c) (resid 38 and name n)
       (resid 38 and name ca) (resid 38 and name c) 1.0 -74.0 20.2 2
assign (resid 38 and name n) (resid 38 and name ca)
       (resid 38 and name c) (resid 39 and name n) 1.0 -14.1 19.2 2

assign (resid 40 and name c) (resid 41 and name n)
       (resid 41 and name ca) (resid 41 and name c) 1.0 -142.2 16.4 2
assign (resid 41 and name n) (resid 41 and name ca)
       (resid 41 and name c) (resid 42 and name n) 1.0 150.4 17.8 2

assign (resid 41 and name c) (resid 42 and name n)
       (resid 42 and name ca) (resid 42 and name c) 1.0 -126.2 18.0 2
assign (resid 42 and name n) (resid 42 and name ca)
       (resid 42 and name c) (resid 43 and name n) 1.0 139.1 18.7 2

assign (resid 42 and name c) (resid 43 and name n)
       (resid 43 and name ca) (resid 43 and name c) 1.0 -136.0 9.2 2
assign (resid 43 and name n) (resid 43 and name ca)
       (resid 43 and name c) (resid 44 and name n) 1.0 161.5 12.4 2

assign (resid 43 and name c) (resid 44 and name n)
       (resid 44 and name ca) (resid 44 and name c) 1.0 -120.4 27.9 2
assign (resid 44 and name n) (resid 44 and name ca)
       (resid 44 and name c) (resid 45 and name n) 1.0 131.1 14.3 2

assign (resid 44 and name c) (resid 45 and name n)
       (resid 45 and name ca) (resid 45 and name c) 1.0 -98.0 24.3 2
assign (resid 45 and name n) (resid 45 and name ca)
       (resid 45 and name c) (resid 46 and name n) 1.0 136.1 29.9 2

assign (resid 45 and name c) (resid 46 and name n)
       (resid 46 and name ca) (resid 46 and name c) 1.0 -59.8 6.3 2
assign (resid 46 and name n) (resid 46 and name ca)
       (resid 46 and name c) (resid 47 and name n) 1.0 148.5 7.9 2

assign (resid 46 and name c) (resid 47 and name n)
       (resid 47 and name ca) (resid 47 and name c) 1.0 -57.0 8.0 2
assign (resid 47 and name n) (resid 47 and name ca)
       (resid 47 and name c) (resid 48 and name n) 1.0 -27.0 13.0 2

assign (resid 47 and name c) (resid 48 and name n)
       (resid 48 and name ca) (resid 48 and name c) 1.0 -82.0 16.0 2
assign (resid 48 and name n) (resid 48 and name ca)
       (resid 48 and name c) (resid 49 and name n) 1.0 -12.0 20.0 2

assign (resid 49 and name c) (resid 50 and name n)
       (resid 50 and name ca) (resid 50 and name c) 1.0 -76.0 16.0 2
assign (resid 50 and name n) (resid 50 and name ca)
       (resid 50 and name c) (resid 51 and name n) 1.0 113.0 34.0 2

assign (resid 51 and name c) (resid 52 and name n)
       (resid 52 and name ca) (resid 52 and name c) 1.0 -91.4 23.3 2
assign (resid 52 and name n) (resid 52 and name ca)
       (resid 52 and name c) (resid 53 and name n) 1.0 112.5 8.5 2

assign (resid 52 and name c) (resid 53 and name n)
       (resid 53 and name ca) (resid 53 and name c) 1.0 -56.1 10.5 2
assign (resid 53 and name n) (resid 53 and name ca)
       (resid 53 and name c) (resid 54 and name n) 1.0 -32.7 9.3 2

assign (resid 53 and name c) (resid 54 and name n)
       (resid 54 and name ca) (resid 54 and name c) 1.0 -88.5 13.9 2
assign (resid 54 and name n) (resid 54 and name ca)
       (resid 54 and name c) (resid 55 and name n) 1.0 -4.3 19.4 2

assign (resid 55 and name c) (resid 56 and name n)
       (resid 56 and name ca) (resid 56 and name c) 1.0 -64.3 6.2 2
assign (resid 56 and name n) (resid 56 and name ca)
       (resid 56 and name c) (resid 57 and name n) 1.0 149.6 10.4 2

assign (resid 56 and name c) (resid 57 and name n)
       (resid 57 and name ca) (resid 57 and name c) 1.0 -114.7 18.5 2
assign (resid 57 and name n) (resid 57 and name ca)
       (resid 57 and name c) (resid 58 and name n) 1.0 145.6 18.9 2

assign (resid 57 and name c) (resid 58 and name n)
       (resid 58 and name ca) (resid 58 and name c) 1.0 -125.2 13.7 2
assign (resid 58 and name n) (resid 58 and name ca)
       (resid 58 and name c) (resid 59 and name n) 1.0 139.3 13.4 2

assign (resid 58 and name c) (resid 59 and name n)
       (resid 59 and name ca) (resid 59 and name c) 1.0 -126.0 23.5 2
assign (resid 59 and name n) (resid 59 and name ca)
       (resid 59 and name c) (resid 60 and name n) 1.0 137.2 16.1 2

assign (resid 59 and name c) (resid 60 and name n)
       (resid 60 and name ca) (resid 60 and name c) 1.0 -130.3 20.6 2
assign (resid 60 and name n) (resid 60 and name ca)
       (resid 60 and name c) (resid 61 and name n) 1.0 145.5 15.9 2

assign (resid 60 and name c) (resid 61 and name n)
       (resid 61 and name ca) (resid 61 and name c) 1.0 -107.6 17.6 2
assign (resid 61 and name n) (resid 61 and name ca)
       (resid 61 and name c) (resid 62 and name n) 1.0 134.2 16.7 2

assign (resid 64 and name c) (resid 65 and name n)
       (resid 65 and name ca) (resid 65 and name c) 1.0 -61.0 17.5 2
assign (resid 65 and name n) (resid 65 and name ca)
       (resid 65 and name c) (resid 66 and name n) 1.0 -25.5 13.1 2

assign (resid 65 and name c) (resid 66 and name n)
       (resid 66 and name ca) (resid 66 and name c) 1.0 -90.7 16.4 2
assign (resid 66 and name n) (resid 66 and name ca)
       (resid 66 and name c) (resid 67 and name n) 1.0 -10.0 18.7 2

assign (resid 67 and name c) (resid 68 and name n)
       (resid 68 and name ca) (resid 68 and name c) 1.0 -107.9 10.9 2
assign (resid 68 and name n) (resid 68 and name ca)
       (resid 68 and name c) (resid 69 and name n) 1.0 130.7 12.6 2

assign (resid 68 and name c) (resid 69 and name n)
       (resid 69 and name ca) (resid 69 and name c) 1.0 -124.3 19.5 2
assign (resid 69 and name n) (resid 69 and name ca)
       (resid 69 and name c) (resid 70 and name n) 1.0 137.2 19.3 2

assign (resid 69 and name c) (resid 70 and name n)
       (resid 70 and name ca) (resid 70 and name c) 1.0 -113.3 13.2 2
assign (resid 70 and name n) (resid 70 and name ca)
       (resid 70 and name c) (resid 71 and name n) 1.0 144.3 13.3 2

assign (resid 70 and name c) (resid 71 and name n)
       (resid 71 and name ca) (resid 71 and name c) 1.0 -136.1 9.8 2
assign (resid 71 and name n) (resid 71 and name ca)
       (resid 71 and name c) (resid 72 and name n) 1.0 139.0 15.5 2

assign (resid 71 and name c) (resid 72 and name n)
       (resid 72 and name ca) (resid 72 and name c) 1.0 -107.4 20.6 2
assign (resid 72 and name n) (resid 72 and name ca)
       (resid 72 and name c) (resid 73 and name n) 1.0 126.7 14.7 2

assign (resid 72 and name c) (resid 73 and name n)
       (resid 73 and name ca) (resid 73 and name c) 1.0 -135.6 8.4 2
assign (resid 73 and name n) (resid 73 and name ca)
       (resid 73 and name c) (resid 74 and name n) 1.0 166.0 8.2 2

assign (resid 73 and name c) (resid 74 and name n)
       (resid 74 and name ca) (resid 74 and name c) 1.0 -124.8 17.6 2
assign (resid 74 and name n) (resid 74 and name ca)
       (resid 74 and name c) (resid 75 and name n) 1.0 143.2 12.7 2

assign (resid 74 and name c) (resid 75 and name n)
       (resid 75 and name ca) (resid 75 and name c) 1.0 -77.6 10.9 2
assign (resid 75 and name n) (resid 75 and name ca)
       (resid 75 and name c) (resid 76 and name n) 1.0 124.3 9.3 2

assign (resid 75 and name c) (resid 76 and name n)
       (resid 76 and name ca) (resid 76 and name c) 1.0 -84.1 9.8 2
assign (resid 76 and name n) (resid 76 and name ca)
       (resid 76 and name c) (resid 77 and name n) 1.0 -44.1 6.5 2

assign (resid 76 and name c) (resid 77 and name n)
       (resid 77 and name ca) (resid 77 and name c) 1.0 -146.0 25.0 2
assign (resid 77 and name n) (resid 77 and name ca)
       (resid 77 and name c) (resid 78 and name n) 1.0 163.0 10.0 2

assign (resid 77 and name c) (resid 78 and name n)
       (resid 78 and name ca) (resid 78 and name c) 1.0 -135.2 16.0 2
assign (resid 78 and name n) (resid 78 and name ca)
       (resid 78 and name c) (resid 79 and name n) 1.0 142.1 14.8 2

assign (resid 78 and name c) (resid 79 and name n)
       (resid 79 and name ca) (resid 79 and name c) 1.0 -112.9 35.3 2
assign (resid 79 and name n) (resid 79 and name ca)
       (resid 79 and name c) (resid 80 and name n) 1.0 139.3 20.0 2

assign (resid 79 and name c) (resid 80 and name n)
       (resid 80 and name ca) (resid 80 and name c) 1.0 51.0 5.0 2
assign (resid 80 and name n) (resid 80 and name ca)
       (resid 80 and name c) (resid 81 and name n) 1.0 41.0 4.0 2

assign (resid 81 and name c) (resid 82 and name n)
       (resid 82 and name ca) (resid 82 and name c) 1.0 -107.1 16.5 2
assign (resid 82 and name n) (resid 82 and name ca)
       (resid 82 and name c) (resid 83 and name n) 1.0 123.3 38.0 2

assign (resid 82 and name c) (resid 83 and name n)
       (resid 83 and name ca) (resid 83 and name c) 1.0 -137.2 14.3 2
assign (resid 83 and name n) (resid 83 and name ca)
       (resid 83 and name c) (resid 84 and name n) 1.0 153.2 14.7 2

assign (resid 84 and name c) (resid 85 and name n)
       (resid 85 and name ca) (resid 85 and name c) 1.0 -127.8 17.3 2
assign (resid 85 and name n) (resid 85 and name ca)
       (resid 85 and name c) (resid 86 and name n) 1.0 140.7 17.0 2

assign (resid 85 and name c) (resid 86 and name n)
       (resid 86 and name ca) (resid 86 and name c) 1.0 -124.9 19.9 2
assign (resid 86 and name n) (resid 86 and name ca)
       (resid 86 and name c) (resid 87 and name n) 1.0 129.8 16.6 2

assign (resid 86 and name c) (resid 87 and name n)
       (resid 87 and name ca) (resid 87 and name c) 1.0 -90.3 27.3 2
assign (resid 87 and name n) (resid 87 and name ca)
       (resid 87 and name c) (resid 88 and name n) 1.0 121.8 19.1 2

assign (resid 87 and name c) (resid 88 and name n)
       (resid 88 and name ca) (resid 88 and name c) 1.0 -102.2 12.3 2
assign (resid 88 and name n) (resid 88 and name ca)
       (resid 88 and name c) (resid 89 and name n) 1.0 -31.2 9.8 2

assign (resid 88 and name c) (resid 89 and name n)
       (resid 89 and name ca) (resid 89 and name c) 1.0 -156.9 9.6 2
assign (resid 89 and name n) (resid 89 and name ca)
       (resid 89 and name c) (resid 90 and name n) 1.0 147.1 5.0 2

assign (resid 89 and name c) (resid 90 and name n)
       (resid 90 and name ca) (resid 90 and name c) 1.0 -130.1 15.0 2
assign (resid 90 and name n) (resid 90 and name ca)
       (resid 90 and name c) (resid 91 and name n) 1.0 134.7 5.8 2

assign (resid 91 and name c) (resid 92 and name n)
       (resid 92 and name ca) (resid 92 and name c) 1.0 -59.5 4.7 2
assign (resid 92 and name n) (resid 92 and name ca)
       (resid 92 and name c) (resid 93 and name n) 1.0 -37.3 3.7 2

assign (resid 92 and name c) (resid 93 and name n)
       (resid 93 and name ca) (resid 93 and name c) 1.0 -68.5 6.4 2
assign (resid 93 and name n) (resid 93 and name ca)
       (resid 93 and name c) (resid 94 and name n) 1.0 -32.2 10.7 2

assign (resid 93 and name c) (resid 94 and name n)
       (resid 94 and name ca) (resid 94 and name c) 1.0 -67.8 8.5 2
assign (resid 94 and name n) (resid 94 and name ca)
       (resid 94 and name c) (resid 95 and name n) 1.0 -41.3 6.1 2

assign (resid 94 and name c) (resid 95 and name n)
       (resid 95 and name ca) (resid 95 and name c) 1.0 -62.2 3.2 2
assign (resid 95 and name n) (resid 95 and name ca)
       (resid 95 and name c) (resid 96 and name n) 1.0 -45.2 6.5 2

assign (resid 95 and name c) (resid 96 and name n)
       (resid 96 and name ca) (resid 96 and name c) 1.0 -64.0 6.2 2
assign (resid 96 and name n) (resid 96 and name ca)
       (resid 96 and name c) (resid 97 and name n) 1.0 -43.5 5.8 2

assign (resid 96 and name c) (resid 97 and name n)
       (resid 97 and name ca) (resid 97 and name c) 1.0 -65.3 3.3 2
assign (resid 97 and name n) (resid 97 and name ca)
       (resid 97 and name c) (resid 98 and name n) 1.0 -41.5 6.7 2

assign (resid 97 and name c) (resid 98 and name n)
       (resid 98 and name ca) (resid 98 and name c) 1.0 -63.6 3.6 2
assign (resid 98 and name n) (resid 98 and name ca)
       (resid 98 and name c) (resid 99 and name n) 1.0 -40.6 6.2 2

assign (resid 98 and name c) (resid 99 and name n)
       (resid 99 and name ca) (resid 99 and name c) 1.0 -61.3 4.7 2
assign (resid 99 and name n) (resid 99 and name ca)
       (resid 99 and name c) (resid 100 and name n) 1.0 -41.3 5.7 2

assign (resid 99 and name c) (resid 100 and name n)
       (resid 100 and name ca) (resid 100 and name c) 1.0 -61.1 5.1 2
assign (resid 100 and name n) (resid 100 and name ca)
       (resid 100 and name c) (resid 101 and name n) 1.0 -44.6 6.6 2

assign (resid 100 and name c) (resid 101 and name n)
       (resid 101 and name ca) (resid 101 and name c) 1.0 -64.4 5.3 2
assign (resid 101 and name n) (resid 101 and name ca)
       (resid 101 and name c) (resid 102 and name n) 1.0 -42.0 7.8 2

assign (resid 101 and name c) (resid 102 and name n)
       (resid 102 and name ca) (resid 102 and name c) 1.0 -63.1 5.2 2
assign (resid 102 and name n) (resid 102 and name ca)
       (resid 102 and name c) (resid 103 and name n) 1.0 -42.2 5.1 2

assign (resid 102 and name c) (resid 103 and name n)
       (resid 103 and name ca) (resid 103 and name c) 1.0 -62.2 3.0 2
assign (resid 103 and name n) (resid 103 and name ca)
       (resid 103 and name c) (resid 104 and name n) 1.0 -41.7 6.8 2

assign (resid 103 and name c) (resid 104 and name n)
       (resid 104 and name ca) (resid 104 and name c) 1.0 -67.4 10.4 2
assign (resid 104 and name n) (resid 104 and name ca)
       (resid 104 and name c) (resid 105 and name n) 1.0 -32.5 9.8 2

assign (resid 104 and name c) (resid 105 and name n)
       (resid 105 and name ca) (resid 105 and name c) 1.0 -65.9 8.2 2
assign (resid 105 and name n) (resid 105 and name ca)
       (resid 105 and name c) (resid 106 and name n) 1.0 -38.2 12.3 2

assign (resid 105 and name c) (resid 106 and name n)
       (resid 106 and name ca) (resid 106 and name c) 1.0 -70.1 14.1 2
assign (resid 106 and name n) (resid 106 and name ca)
       (resid 106 and name c) (resid 107 and name n) 1.0 -34.2 15.3 2

assign (resid 115 and name c) (resid 116 and name n)
       (resid 116 and name ca) (resid 116 and name c) 1.0 -60.5 6.4 2
assign (resid 116 and name n) (resid 116 and name ca)
       (resid 116 and name c) (resid 117 and name n) 1.0 -41.9 5.7 2

assign (resid 116 and name c) (resid 117 and name n)
       (resid 117 and name ca) (resid 117 and name c) 1.0 -63.0 4.5 2
assign (resid 117 and name n) (resid 117 and name ca)
       (resid 117 and name c) (resid 118 and name n) 1.0 -38.6 11.6 2

assign (resid 117 and name c) (resid 118 and name n)
       (resid 118 and name ca) (resid 118 and name c) 1.0 -63.2 5.5 2
assign (resid 118 and name n) (resid 118 and name ca)
       (resid 118 and name c) (resid 119 and name n) 1.0 -41.0 7.1 2

assign (resid 118 and name c) (resid 119 and name n)
       (resid 119 and name ca) (resid 119 and name c) 1.0 -65.6 6.6 2
assign (resid 119 and name n) (resid 119 and name ca)
       (resid 119 and name c) (resid 120 and name n) 1.0 -29.6 18.2 2

assign (resid 119 and name c) (resid 120 and name n)
       (resid 120 and name ca) (resid 120 and name c) 1.0 -79.0 19.0 2
assign (resid 120 and name n) (resid 120 and name ca)
       (resid 120 and name c) (resid 121 and name n) 1.0 -23.0 23.0 2

assign (resid 120 and name c) (resid 121 and name n)
       (resid 121 and name ca) (resid 121 and name c) 1.0 -88.5 22.4 2
assign (resid 121 and name n) (resid 121 and name ca)
       (resid 121 and name c) (resid 122 and name n) 1.0 -9.7 29.8 2
end

REMARK Dihedral angle restraints from scalar couplings, ROEs, and the like.
restraints dihedral
! due to hydrogen bond there is no rotation about N2 and H21 and H22 could be assigned
assign (resid 502 and name C2) (resid 502 and name N1)
       (resid 502 and name N2) (resid 502 and name H21) 1.0 180.0 5.0 2
assign (resid 503 and name C2) (resid 503 and name N1)
       (resid 503 and name N2) (resid 503 and name H21) 1.0 180.0 5.0 2

! set measured hydrogen bond in plane
assign (resid 77 and name NE1) (resid 77 and name CE2)
       (resid 77 and name CD1) (resid 501 and name N7) 1.0 0.0 5.0 2

! chi1 from hahb, roe15n, hncg_aro, hncocg_aro, brctCCON 2 and 4
assign (resid 6 and name n) (resid 6 and name ca)
       (resid 6 and name cb) (resid 6 and name cg) 1.0 -60 20.0 2
assign (resid 26 and name n) (resid 26 and name ca)
       (resid 26 and name cb) (resid 26 and name cg) 1.0 60 20.0 2
assign (resid 27 and name n) (resid 27 and name ca)
       (resid 27 and name cb) (resid 27 and name cg) 1.0 -60 20.0 2
assign (resid 29 and name n) (resid 29 and name ca)
       (resid 29 and name cb) (resid 29 and name cg) 1.0 -60 20.0 2
assign (resid 31 and name n) (resid 31 and name ca)
       (resid 31 and name cb) (resid 31 and name cg1) 1.0 -60 20.0 2
assign (resid 36 and name n) (resid 36 and name ca)
       (resid 36 and name cb) (resid 36 and name cg1) 1.0 60 20.0 2
assign (resid 54 and name n) (resid 54 and name ca)
       (resid 54 and name cb) (resid 54 and name cg) 1.0 -60 20.0 2
assign (resid 57 and name n) (resid 57 and name ca)
       (resid 57 and name cb) (resid 57 and name cg) 1.0 -60 20.0 2
assign (resid 60 and name n) (resid 60 and name ca)
       (resid 60 and name cb) (resid 60 and name cg) 1.0 -60 20.0 2
assign (resid 67 and name n) (resid 67 and name ca)
       (resid 67 and name cb) (resid 67 and name cg1) 1.0 180 20.0 2
assign (resid 69 and name n) (resid 69 and name ca)
       (resid 69 and name cb) (resid 69 and name cg1) 1.0 -60 20.0 2
assign (resid 73 and name n) (resid 73 and name ca)
       (resid 73 and name cb) (resid 73 and name cg1) 1.0 60 20.0 2
assign (resid 95 and name n) (resid 95 and name ca)
       (resid 95 and name cb) (resid 95 and name cg1) 1.0 -60 20.0 2
assign (resid 97 and name n) (resid 97 and name ca)
       (resid 97 and name cb) (resid 97 and name cg) 1.0 -60 20.0 2
assign (resid 104 and name n) (resid 104 and name ca)
       (resid 104 and name cb) (resid 104 and name cg) 1.0 -60 20.0 2
assign (resid 118 and name n) (resid 118 and name ca)
       (resid 118 and name cb) (resid 118 and name cg) 1.0 -60 20.0 2

! chi2 for aromatics
assign (resid 11 and name ca) (resid 11 and name cb)
       (resid 11 and name cg) (resid 11 and name cd1) 1.0 90 40 2
assign (resid 16 and name ca) (resid 16 and name cb)
       (resid 16 and name cg) (resid 16 and name cd1) 1.0 90 40 2
assign (resid 57 and name ca) (resid 57 and name cb)
       (resid 57 and name cg) (resid 57 and name cd1) 1.0 90 40 2
assign (resid 62 and name ca) (resid 62 and name cb)
       (resid 62 and name cg) (resid 62 and name cd1) 1.0 90 40 2
assign (resid 85 and name ca) (resid 85 and name cb)
       (resid 85 and name cg) (resid 85 and name cd1) 1.0 90 40 2
end


REMARK N-HN RDCs.
assign (resid 2 and name N) (resid 2 and name HN) 2.0200 1.0
assign (resid 3 and name N) (resid 3 and name HN) 1.5820 1.0
assign (resid 4 and name N) (resid 4 and name HN) -0.0280 1.0
assign (resid 8 and name N) (resid 8 and name HN) 3.9820 1.0
assign (resid 9 and name N) (resid 9 and name HN) -5.0580 1.0
assign (resid 15 and name N) (resid 15 and name HN) 6.0130 1.0
assign (resid 16 and name N) (resid 16 and name HN) 1.7290 1.0
assign (resid 17 and name N) (resid 17 and name HN) 0.6770 1.0
assign (resid 18 and name N) (resid 18 and name HN) -3.4250 1.0
assign (resid 19 and name N) (resid 19 and name HN) -7.4460 1.0
assign (resid 20 and name N) (resid 20 and name HN) 2.6710 1.0
assign (resid 21 and name N) (resid 21 and name HN) 13.5280 1.0
assign (resid 24 and name N) (resid 24 and name HN) 15.9030 1.0
assign (resid 25 and name N) (resid 25 and name HN) 18.4570 1.0
assign (resid 26 and name N) (resid 26 and name HN) -5.8770 1.0
assign (resid 27 and name N) (resid 27 and name HN) 6.8420 1.0
assign (resid 28 and name N) (resid 28 and name HN) 19.2440 1.0
assign (resid 29 and name N) (resid 29 and name HN) 20.3420 1.0
assign (resid 30 and name N) (resid 30 and name HN) 18.5460 1.0
assign (resid 31 and name N) (resid 31 and name HN) -2.7320 1.0
assign (resid 32 and name N) (resid 32 and name HN) -5.3640 1.0
assign (resid 33 and name N) (resid 33 and name HN) -13.8070 1.0
assign (resid 34 and name N) (resid 34 and name HN) -2.8630 1.0
assign (resid 35 and name N) (resid 35 and name HN) 4.7440 1.0
assign (resid 36 and name N) (resid 36 and name HN) 5.9710 1.0
assign (resid 37 and name N) (resid 37 and name HN) 2.9970 1.0
assign (resid 39 and name N) (resid 39 and name HN) -10.5330 1.0
assign (resid 41 and name N) (resid 41 and name HN) -3.3780 1.0
assign (resid 42 and name N) (resid 42 and name HN) -3.8060 1.0
assign (resid 44 and name N) (resid 44 and name HN) -16.9580 1.0
assign (resid 45 and name N) (resid 45 and name HN) -17.4580 3.0
assign (resid 49 and name N) (resid 49 and name HN) -10.1980 1.0
assign (resid 50 and name N) (resid 50 and name HN) -14.1960 1.0
assign (resid 52 and name N) (resid 52 and name HN) -16.4670 1.0
assign (resid 54 and name N) (resid 54 and name HN) 21.8530 1.0
assign (resid 57 and name N) (resid 57 and name HN) 17.8490 1.0
assign (resid 58 and name N) (resid 58 and name HN) 20.9320 1.0
assign (resid 59 and name N) (resid 59 and name HN) 16.7400 1.0
assign (resid 60 and name N) (resid 60 and name HN) 10.2110 1.0
assign (resid 61 and name N) (resid 61 and name HN) 6.9670 1.0
assign (resid 63 and name N) (resid 63 and name HN) -6.7010 1.0
assign (resid 65 and name N) (resid 65 and name HN) 4.6110 1.0
assign (resid 66 and name N) (resid 66 and name HN) 7.6490 1.0
assign (resid 67 and name N) (resid 67 and name HN) 1.4820 1.0
assign (resid 68 and name N) (resid 68 and name HN) -4.7500 1.0
assign (resid 70 and name N) (resid 70 and name HN) 16.5290 1.0
assign (resid 72 and name N) (resid 72 and name HN) 20.8540 1.0
assign (resid 73 and name N) (resid 73 and name HN) 16.7430 1.0
assign (resid 74 and name N) (resid 74 and name HN) 15.9880 1.0
assign (resid 75 and name N) (resid 75 and name HN) 4.2470 1.0
assign (resid 76 and name N) (resid 76 and name HN) -3.5270 1.0
assign (resid 77 and name N) (resid 77 and name HN) -13.2330 1.0
assign (resid 77 and name NE1) (resid 77 and name HE1) 3.4700 1.0
assign (resid 80 and name N) (resid 80 and name HN) -3.7010 1.0
assign (resid 81 and name N) (resid 81 and name HN) -2.2920 1.0
assign (resid 82 and name N) (resid 82 and name HN) -15.0090 1.0
assign (resid 84 and name N) (resid 84 and name HN) -6.8920 1.0
assign (resid 86 and name N) (resid 86 and name HN) 8.2450 1.0
assign (resid 87 and name N) (resid 87 and name HN) 2.5460 1.0
assign (resid 88 and name N) (resid 88 and name HN) 13.7080 1.0
assign (resid 89 and name N) (resid 89 and name HN) 9.5900 1.0
assign (resid 90 and name N) (resid 90 and name HN) 16.3850 1.0
assign (resid 91 and name N) (resid 91 and name HN) 16.7160 1.0
assign (resid 92 and name N) (resid 92 and name HN) -5.5510 1.0
assign (resid 93 and name N) (resid 93 and name HN) 2.9820 1.0
assign (resid 96 and name N) (resid 96 and name HN) -7.5320 1.0
assign (resid 100 and name N) (resid 100 and name HN) -1.6560 1.0
assign (resid 101 and name N) (resid 101 and name HN) -2.2910 1.0
assign (resid 104 and name N) (resid 104 and name HN) 1.3710 1.0
assign (resid 105 and name N) (resid 105 and name HN) -5.1330 1.0
assign (resid 117 and name N) (resid 117 and name HN) -9.0570 1.0
assign (resid 118 and name N) (resid 118 and name HN) -3.4610 1.0
assign (resid 119 and name N) (resid 119 and name HN) -0.7700 1.0
assign (resid 120 and name N) (resid 120 and name HN) -4.4180 1.0
assign (resid 121 and name N) (resid 121 and name HN) -3.7700 1.0
assign (resid 122 and name N) (resid 122 and name HN) -0.0440 1.0
assign (resid 123 and name N) (resid 123 and name HN) -1.2460 1.0
assign (resid 124 and name N) (resid 124 and name HN) -2.1230 1.0
assign (resid 125 and name N) (resid 125 and name HN) -0.4180 1.0

REMARK C-H RDCs.
REMARK corrfac = -0.506587569936
assign (resid 1 and name CA) (resid 1 and name HA) 2.1885 1.0
assign (resid 3 and name CA) (resid 3 and name HA) 2.8572 1.0
assign (resid 4 and name CA) (resid 4 and name HA) 4.2351 1.0
assign (resid 6 and name CA) (resid 6 and name HA) 8.3688 1.0
assign (resid 8 and name CA) (resid 8 and name HA) 5.6940 1.0
assign (resid 15 and name CA) (resid 15 and name HA) 5.2837 1.0
assign (resid 17 and name CA) (resid 17 and name HA) -4.5340 1.0
assign (resid 18 and name CA) (resid 18 and name HA) -5.3394 1.0
assign (resid 19 and name CA) (resid 19 and name HA) -6.5097 1.0
assign (resid 20 and name CA) (resid 20 and name HA) -7.4063 1.0
assign (resid 22 and name CA) (resid 22 and name HA) 14.1845 1.0
assign (resid 23 and name CA) (resid 23 and name HA) 20.0507 1.0
assign (resid 26 and name CA) (resid 26 and name HA) -5.8815 1.0
assign (resid 27 and name CA) (resid 27 and name HA) 11.6464 1.0
assign (resid 28 and name CA) (resid 28 and name HA) 14.0629 1.0
assign (resid 29 and name CA) (resid 29 and name HA) 15.9372 1.0
assign (resid 30 and name CA) (resid 30 and name HA) 6.7376 1.0
assign (resid 31 and name CA) (resid 31 and name HA) 4.7619 1.0
assign (resid 34 and name CA) (resid 34 and name HA) -4.3212 1.0
assign (resid 35 and name CA) (resid 35 and name HA) -6.5400 1.0
assign (resid 36 and name CA) (resid 36 and name HA) 1.2563 1.0
assign (resid 38 and name CA) (resid 38 and name HA) -9.5340 1.0
assign (resid 41 and name CA) (resid 41 and name HA) 2.9483 1.0
assign (resid 42 and name CA) (resid 42 and name HA) -3.3030 1.0
assign (resid 43 and name CA) (resid 43 and name HA) -3.6474 1.0
assign (resid 45 and name CA) (resid 45 and name HA) -6.8085 1.0
assign (resid 46 and name CA) (resid 46 and name HA) -6.2158 1.0
assign (resid 47 and name CA) (resid 47 and name HA) -15.6485 1.0
assign (resid 50 and name CA) (resid 50 and name HA) -16.3678 1.0
assign (resid 52 and name CA) (resid 52 and name HA) -4.9646 1.0
assign (resid 53 and name CA) (resid 53 and name HA) -3.6677 1.0
assign (resid 55 and name CA) (resid 55 and name HA) 3.2270 1.0
assign (resid 56 and name CA) (resid 56 and name HA) -4.2553 1.0
assign (resid 57 and name CA) (resid 57 and name HA) 13.6120 1.0
assign (resid 58 and name CA) (resid 58 and name HA) 17.6698 1.0
assign (resid 59 and name CA) (resid 59 and name HA) 18.2827 1.0
assign (resid 60 and name CA) (resid 60 and name HA) 14.4327 1.0
assign (resid 62 and name CA) (resid 62 and name HA) -5.7903 1.0
assign (resid 63 and name CA) (resid 63 and name HA) -9.9241 1.0
assign (resid 65 and name CA) (resid 65 and name HA) 8.5259 1.0
assign (resid 66 and name CA) (resid 66 and name HA) 5.4559 1.0
assign (resid 69 and name CA) (resid 69 and name HA) -0.0101 1.0
assign (resid 70 and name CA) (resid 70 and name HA) 9.3161 1.0
assign (resid 71 and name CA) (resid 71 and name HA) 7.6647 1.0
assign (resid 72 and name CA) (resid 72 and name HA) 19.0832 1.0
assign (resid 73 and name CA) (resid 73 and name HA) 18.4955 1.0
assign (resid 74 and name CA) (resid 74 and name HA) 13.9261 1.0
assign (resid 75 and name CA) (resid 75 and name HA) -3.8197 1.0
assign (resid 76 and name CA) (resid 76 and name HA) -2.1479 1.0
assign (resid 78 and name CA) (resid 78 and name HA) -7.8318 1.0
assign (resid 79 and name CA) (resid 79 and name HA) 7.5532 1.0
assign (resid 83 and name CA) (resid 83 and name HA) -11.2614 1.0
assign (resid 86 and name CA) (resid 86 and name HA) 4.9240 1.0
assign (resid 90 and name CA) (resid 90 and name HA) 19.5644 1.0
assign (resid 92 and name CA) (resid 92 and name HA) -8.0497 1.0
assign (resid 96 and name CA) (resid 96 and name HA) 8.1105 1.0
assign (resid 97 and name CA) (resid 97 and name HA) -0.2432 1.0
assign (resid 98 and name CA) (resid 98 and name HA) 3.5765 1.0
assign (resid 100 and name CA) (resid 100 and name HA) 17.4519 1.0
assign (resid 101 and name CA) (resid 101 and name HA) -4.0426 1.0
assign (resid 104 and name CA) (resid 104 and name HA) 9.2959 1.0
assign (resid 116 and name CA) (resid 116 and name HA) -1.1246 1.0
assign (resid 117 and name CA) (resid 117 and name HA) -4.4326 1.0
assign (resid 120 and name CA) (resid 120 and name HA) -4.2401 1.0
assign (resid 122 and name CA) (resid 122 and name HA) -2.0618 1.0
assign (resid 123 and name CA) (resid 123 and name HA) -1.9453 1.0
assign (resid 124 and name CA) (resid 124 and name HA) -2.9179 1.0
assign (resid 125 and name CA) (resid 125 and name HA) -0.3343 1.0

REMARK c-di-GMP ribose RDCs
REMARK corrfac = -0.506587569936
assign (resid 501 and name H3') (resid 501 and name C3') -6.2 1.0
assign (resid 502 and name H2') (resid 502 and name C2') 17.6 1.0
assign (resid 502 and name H4') (resid 502 and name C4') -2.9 1.0
assign (resid 502 and name H3') (resid 502 and name C3') -5.1 1.0
assign (resid 503 and name H1') (resid 503 and name C1') 9.8 1.0
assign (resid 503 and name H2') (resid 503 and name C2') 8.7 1.0
assign (resid 503 and name H4') (resid 503 and name C4') 13.0 1.0
assign (resid 503 and name H3') (resid 503 and name C3') 16.9 1.0
assign (resid 504 and name H1') (resid 504 and name C1') 10.1 1.0
assign (resid 504 and name H4') (resid 504 and name C4') -4.0 1.0
assign (resid 504 and name H3') (resid 504 and name C3') -4.5 1.0

REMARK aromatic C-H RDCs.
REMARK corrfac = -0.495842995903
assign (resid 501 and name C8) (resid 501 and name H8) -5.7511 1.3
assign (resid 502 and name C8) (resid 502 and name H8) 2.2608 1.3
assign (resid 503 and name C8) (resid 503 and name H8) -5.5516 1.3
assign (resid 504 and name C8) (resid 504 and name H8) 3.3401 1.3
assign (resid 29 and name CD1) (resid 29 and name HD1) 2.0173 1.0
assign (resid 49 and name CD1) (resid 49 and name HD1) 7.5984 1.0
assign (resid 49 and name CZ2) (resid 49 and name HZ2) 6.0242 1.0
assign (resid 77 and name CD1) (resid 77 and name HD1) 4.5807 1.0
assign (resid 77 and name CZ2) (resid 77 and name HZ2) 3.7508 1.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1 111.242  22.239   7.408
    2    HA   MET   1           HA       MET   1 108.424  22.237   7.158
    3    HB2  MET   1           HB2      MET   1 109.743  24.641   8.410
    4    HB3  MET   1           HB1      MET   1 108.341  24.833   7.355
    5    HG2  MET   1           HG2      MET   1 107.727  24.635   9.775
    6    HG3  MET   1           HG1      MET   1 107.011  23.373   8.773
    7    HE1  MET   1           HE1      MET   1 106.901  20.964  10.189
    8    HE2  MET   1           HE2      MET   1 106.460  22.501  10.927
    9    HE3  MET   1           HE3      MET   1 107.436  21.346  11.831
   10    H    SER   2           HN       SER   2 111.578  22.551   6.232
   11    HA   SER   2           HA       SER   2 110.967  24.050   3.769
   12    HB2  SER   2           HB2      SER   2 112.936  24.823   4.972
   13    HB3  SER   2           HB1      SER   2 113.603  23.193   4.990
   14    HG   SER   2           HG       SER   2 114.478  23.823   3.178
   15    H    ASP   3           HN       ASP   3 113.654  22.214   3.242
   16    HA   ASP   3           HA       ASP   3 112.214  20.323   1.522
   17    HB2  ASP   3           HB2      ASP   3 115.119  21.085   1.817
   18    HB3  ASP   3           HB1      ASP   3 114.517  19.863   0.697
   19    H    GLN   4           HN       GLN   4 112.335  20.045   4.543
   20    HA   GLN   4           HA       GLN   4 113.761  17.452   4.637
   21    HB2  GLN   4           HB2      GLN   4 113.060  18.327   7.270
   22    HB3  GLN   4           HB1      GLN   4 114.660  18.074   6.584
   23    HG2  GLN   4           HG2      GLN   4 114.687  20.340   7.227
   24    HG3  GLN   4           HG1      GLN   4 114.337  20.415   5.502
   25   HE21  GLN   4          HE21      GLN   4 111.524  19.225   6.447
   26   HE22  GLN   4          HE22      GLN   4 110.680  20.630   6.890
   27    H    HIS   5           HN       HIS   5 110.726  19.014   4.784
   28    HA   HIS   5           HA       HIS   5 108.645  18.311   5.594
   29    HB2  HIS   5           HB2      HIS   5 108.268  15.934   4.366
   30    HB3  HIS   5           HB1      HIS   5 108.246  17.472   3.507
   31    HD2  HIS   5           HD2      HIS   5 111.122  14.843   4.405
   32    HE1  HIS   5           HE1      HIS   5 111.868  16.510   0.600
   33    HE2  HIS   5           HE2      HIS   5 112.692  14.834   2.320
   34    H    ASP   6           HN       ASP   6 110.891  17.545   7.369
   35    HA   ASP   6           HA       ASP   6 111.370  16.092   9.104
   36    HB2  ASP   6           HB2      ASP   6 108.364  16.319   9.111
   37    HB3  ASP   6           HB1      ASP   6 109.249  15.471  10.379
   38    H    GLU   7           HN       GLU   7 112.164  14.501   7.456
   39    HA   GLU   7           HA       GLU   7 110.415  12.294   6.801
   40    HB2  GLU   7           HB2      GLU   7 111.952  12.796   5.103
   41    HB3  GLU   7           HB1      GLU   7 113.289  12.960   6.239
   42    HG2  GLU   7           HG2      GLU   7 112.264  10.289   6.486
   43    HG3  GLU   7           HG1      GLU   7 112.482  10.628   4.775
   44    H    ARG   8           HN       ARG   8 110.124  10.485   7.929
   45    HA   ARG   8           HA       ARG   8 112.033   9.862  10.109
   46    HB2  ARG   8           HB2      ARG   8 109.028   9.792  10.094
   47    HB3  ARG   8           HB1      ARG   8 109.981   8.849  11.232
   48    HG2  ARG   8           HG2      ARG   8 109.571  10.836  12.412
   49    HG3  ARG   8           HG1      ARG   8 111.195  11.067  11.777
   50    HD2  ARG   8           HD2      ARG   8 109.450  12.991  11.538
   51    HD3  ARG   8           HD1      ARG   8 110.493  12.615  10.181
   52    HE   ARG   8           HE       ARG   8 108.489  11.200   9.395
   53   HH11  ARG   8          HH21      ARG   8 108.239  14.071  11.328
   54   HH12  ARG   8          HH22      ARG   8 106.707  14.536  10.673
   55   HH21  ARG   8          HH11      ARG   8 106.490  11.829   8.528
   56   HH22  ARG   8          HH12      ARG   8 105.720  13.273   9.094
   57    H    ARG   9           HN       ARG   9 110.690   8.740   7.226
   58    HA   ARG   9           HA       ARG   9 111.025   5.912   8.048
   59    HB2  ARG   9           HB2      ARG   9 109.887   5.660   5.614
   60    HB3  ARG   9           HB1      ARG   9 108.957   5.788   7.100
   61    HG2  ARG   9           HG2      ARG   9 108.923   8.297   6.738
   62    HG3  ARG   9           HG1      ARG   9 109.593   7.985   5.138
   63    HD2  ARG   9           HD2      ARG   9 107.667   6.823   4.430
   64    HD3  ARG   9           HD1      ARG   9 107.100   6.583   6.077
   65    HE   ARG   9           HE       ARG   9 106.404   8.873   6.135
   66   HH11  ARG   9          HH21      ARG   9 107.685   7.836   3.079
   67   HH12  ARG   9          HH22      ARG   9 106.986   9.150   2.195
   68   HH21  ARG   9          HH11      ARG   9 105.491  10.584   4.971
   69   HH22  ARG   9          HH12      ARG   9 105.746  10.700   3.262
   70    H    ARG  10           HN       ARG  10 113.229   5.884   7.911
   71    HA   ARG  10           HA       ARG  10 115.297   6.403   6.750
   72    HB2  ARG  10           HB2      ARG  10 115.053   4.019   5.202
   73    HB3  ARG  10           HB1      ARG  10 115.880   4.241   6.739
   74    HG2  ARG  10           HG2      ARG  10 114.335   2.558   7.235
   75    HG3  ARG  10           HG1      ARG  10 113.488   3.999   7.780
   76    HD2  ARG  10           HD2      ARG  10 112.344   4.100   5.549
   77    HD3  ARG  10           HD1      ARG  10 113.120   2.578   5.129
   78    HE   ARG  10           HE       ARG  10 110.870   2.930   6.909
   79   HH11  ARG  10          HH21      ARG  10 113.591   0.989   6.018
   80   HH12  ARG  10          HH22      ARG  10 112.942  -0.473   6.682
   81   HH21  ARG  10          HH11      ARG  10 110.012   1.018   7.784
   82   HH22  ARG  10          HH12      ARG  10 110.914  -0.457   7.682
   83    H    PHE  11           HN       PHE  11 113.242   4.859   4.266
   84    HA   PHE  11           HA       PHE  11 114.075   7.011   2.413
   85    HB2  PHE  11           HB2      PHE  11 114.383   4.103   2.198
   86    HB3  PHE  11           HB1      PHE  11 113.606   4.827   0.788
   87    HD1  PHE  11           HD1      PHE  11 116.402   5.614   3.166
   88    HD2  PHE  11           HD2      PHE  11 115.010   5.604  -0.897
   89    HE1  PHE  11           HE1      PHE  11 118.584   6.517   2.417
   90    HE2  PHE  11           HE2      PHE  11 117.191   6.506  -1.647
   91    HZ   PHE  11           HZ       PHE  11 118.977   6.961   0.011
   92    H    HIS  12           HN       HIS  12 112.644   7.414   0.642
   93    HA   HIS  12           HA       HIS  12 109.990   7.807   1.372
   94    HB2  HIS  12           HB2      HIS  12 110.743   7.421  -1.510
   95    HB3  HIS  12           HB1      HIS  12 109.656   8.610  -0.791
   96    HD2  HIS  12           HD2      HIS  12 113.554   8.050  -1.194
   97    HE1  HIS  12           HE1      HIS  12 112.879  12.038   0.013
   98    HE2  HIS  12           HE2      HIS  12 114.642  10.383  -0.759
   99    H    ARG  13           HN       ARG  13 108.280   6.901  -0.472
  100    HA   ARG  13           HA       ARG  13 108.499   3.959  -0.488
  101    HB2  ARG  13           HB2      ARG  13 105.894   5.306   0.195
  102    HB3  ARG  13           HB1      ARG  13 106.380   3.635   0.463
  103    HG2  ARG  13           HG2      ARG  13 107.840   4.237   2.253
  104    HG3  ARG  13           HG1      ARG  13 107.755   5.950   1.845
  105    HD2  ARG  13           HD2      ARG  13 105.241   4.473   2.543
  106    HD3  ARG  13           HD1      ARG  13 106.308   5.029   3.828
  107    HE   ARG  13           HE       ARG  13 105.815   7.145   1.997
  108   HH11  ARG  13          HH21      ARG  13 104.332   5.234   4.468
  109   HH12  ARG  13          HH22      ARG  13 103.225   6.473   4.956
  110   HH21  ARG  13          HH11      ARG  13 104.364   8.777   2.629
  111   HH22  ARG  13          HH12      ARG  13 103.243   8.478   3.916
  112    H    ILE  14           HN       ILE  14 108.052   3.145  -2.438
  113    HA   ILE  14           HA       ILE  14 107.580   4.602  -4.714
  114    HB   ILE  14           HB       ILE  14 106.851   1.765  -4.026
  115   HG12  ILE  14          HG12      ILE  14 108.744   1.312  -5.600
  116   HG13  ILE  14          HG11      ILE  14 108.990   3.052  -5.753
  117   HG21  ILE  14          HG21      ILE  14 106.407   3.299  -6.584
  118   HG22  ILE  14          HG22      ILE  14 105.285   2.239  -5.730
  119   HG23  ILE  14          HG23      ILE  14 106.658   1.553  -6.598
  120   HD11  ILE  14          HD11      ILE  14 108.952   1.775  -3.027
  121   HD12  ILE  14          HD12      ILE  14 109.725   3.275  -3.540
  122   HD13  ILE  14          HD13      ILE  14 110.416   1.722  -4.008
  123    H    ALA  15           HN       ALA  15 106.045   6.157  -4.698
  124    HA   ALA  15           HA       ALA  15 103.314   5.481  -3.859
  125    HB1  ALA  15           HB1      ALA  15 104.701   8.069  -4.532
  126    HB2  ALA  15           HB2      ALA  15 104.031   7.559  -2.982
  127    HB3  ALA  15           HB3      ALA  15 102.952   7.963  -4.320
  128    H    PHE  16           HN       PHE  16 101.906   4.799  -5.251
  129    HA   PHE  16           HA       PHE  16 101.664   6.021  -7.862
  130    HB2  PHE  16           HB2      PHE  16 101.810   4.039  -9.161
  131    HB3  PHE  16           HB1      PHE  16 103.243   4.039  -8.138
  132    HD1  PHE  16           HD2      PHE  16 102.834   2.896  -5.731
  133    HD2  PHE  16           HD1      PHE  16 100.612   2.055  -9.309
  134    HE1  PHE  16           HE2      PHE  16 102.188   0.684  -4.815
  135    HE2  PHE  16           HE1      PHE  16  99.973  -0.153  -8.392
  136    HZ   PHE  16           HZ       PHE  16 100.767  -0.845  -6.150
  137    H    ASP  17           HN       ASP  17  99.537   5.463  -8.838
  138    HA   ASP  17           HA       ASP  17  97.603   5.006  -6.685
  139    HB2  ASP  17           HB2      ASP  17  96.746   5.701  -9.459
  140    HB3  ASP  17           HB1      ASP  17  96.107   6.253  -7.912
  141    H    ALA  18           HN       ALA  18  95.995   3.446  -6.767
  142    HA   ALA  18           HA       ALA  18  95.406   1.777  -8.915
  143    HB1  ALA  18           HB1      ALA  18  97.582   0.775  -8.765
  144    HB2  ALA  18           HB2      ALA  18  96.461  -0.362  -8.013
  145    HB3  ALA  18           HB3      ALA  18  97.480   0.670  -7.007
  146    H    ASP  19           HN       ASP  19  94.357  -0.364  -8.020
  147    HA   ASP  19           HA       ASP  19  92.555   0.543  -5.864
  148    HB2  ASP  19           HB2      ASP  19  91.294  -0.158  -7.715
  149    HB3  ASP  19           HB1      ASP  19  92.352  -1.527  -8.044
  150    H    SER  20           HN       SER  20  92.463  -0.392  -3.905
  151    HA   SER  20           HA       SER  20  93.844  -2.966  -3.517
  152    HB2  SER  20           HB2      SER  20  94.546  -1.991  -1.230
  153    HB3  SER  20           HB1      SER  20  95.458  -1.487  -2.651
  154    HG   SER  20           HG       SER  20  94.171   0.038  -0.942
  155    H    GLU  21           HN       GLU  21  93.053  -4.238  -1.873
  156    HA   GLU  21           HA       GLU  21  90.481  -3.410  -0.647
  157    HB2  GLU  21           HB2      GLU  21  91.033  -6.179  -1.756
  158    HB3  GLU  21           HB1      GLU  21  89.510  -5.565  -1.117
  159    HG2  GLU  21           HG2      GLU  21  90.806  -4.200  -3.468
  160    HG3  GLU  21           HG1      GLU  21  89.862  -5.665  -3.713
  161    H    ILE  22           HN       ILE  22  90.238  -4.017   1.453
  162    HA   ILE  22           HA       ILE  22  92.444  -5.637   2.599
  163    HB   ILE  22           HB       ILE  22  90.982  -3.266   3.777
  164   HG12  ILE  22          HG12      ILE  22  93.218  -3.354   2.092
  165   HG13  ILE  22          HG11      ILE  22  92.731  -1.997   3.100
  166   HG21  ILE  22          HG21      ILE  22  93.032  -5.138   4.996
  167   HG22  ILE  22          HG22      ILE  22  91.372  -4.883   5.531
  168   HG23  ILE  22          HG23      ILE  22  92.561  -3.595   5.710
  169   HD11  ILE  22          HD11      ILE  22  94.535  -4.242   4.048
  170   HD12  ILE  22          HD12      ILE  22  94.154  -2.752   4.912
  171   HD13  ILE  22          HD13      ILE  22  95.116  -2.693   3.436
  172    H    LEU  23           HN       LEU  23  91.981  -7.258   3.888
  173    HA   LEU  23           HA       LEU  23  89.138  -7.720   4.618
  174    HB2  LEU  23           HB2      LEU  23  90.878 -10.072   4.158
  175    HB3  LEU  23           HB1      LEU  23  89.178  -9.820   3.759
  176    HG   LEU  23           HG       LEU  23  90.108  -8.101   2.026
  177   HD11  LEU  23          HD11      LEU  23  92.461  -9.861   1.733
  178   HD12  LEU  23          HD12      LEU  23  92.513  -8.813   3.148
  179   HD13  LEU  23          HD13      LEU  23  92.329  -8.113   1.542
  180   HD21  LEU  23          HD21      LEU  23  88.947 -10.215   1.462
  181   HD22  LEU  23          HD22      LEU  23  90.469 -11.090   1.633
  182   HD23  LEU  23          HD23      LEU  23  90.275  -9.902   0.344
  183    H    GLN  24           HN       GLN  24  88.836  -7.881   6.661
  184    HA   GLN  24           HA       GLN  24  90.981  -9.004   8.389
  185    HB2  GLN  24           HB2      GLN  24  91.036  -6.672   8.865
  186    HB3  GLN  24           HB1      GLN  24  89.276  -6.559   8.890
  187    HG2  GLN  24           HG2      GLN  24  89.110  -7.705  10.946
  188    HG3  GLN  24           HG1      GLN  24  90.734  -8.374  10.807
  189   HE21  GLN  24          HE21      GLN  24  88.904  -5.773  12.120
  190   HE22  GLN  24          HE22      GLN  24  90.213  -4.815  12.620
  191    H    GLY  25           HN       GLY  25  90.096 -11.008   8.758
  192    HA2  GLY  25           HA2      GLY  25  88.749 -12.477   9.945
  193    HA3  GLY  25           HA1      GLY  25  87.710 -11.125  10.396
  194    H    GLU  26           HN       GLU  26  85.714 -11.487   9.668
  195    HA   GLU  26           HA       GLU  26  85.322 -12.835   7.076
  196    HB2  GLU  26           HB2      GLU  26  82.987 -13.088   7.833
  197    HB3  GLU  26           HB1      GLU  26  84.124 -13.777   8.991
  198    HG2  GLU  26           HG2      GLU  26  83.763 -11.014   9.662
  199    HG3  GLU  26           HG1      GLU  26  82.169 -11.729   9.442
  200    H    ARG  27           HN       ARG  27  85.929  -9.836   7.918
  201    HA   ARG  27           HA       ARG  27  83.736  -8.594   6.369
  202    HB2  ARG  27           HB2      ARG  27  85.518  -7.602   8.557
  203    HB3  ARG  27           HB1      ARG  27  84.646  -6.499   7.495
  204    HG2  ARG  27           HG2      ARG  27  82.572  -7.122   8.298
  205    HG3  ARG  27           HG1      ARG  27  83.101  -8.757   8.696
  206    HD2  ARG  27           HD2      ARG  27  84.159  -8.059  10.677
  207    HD3  ARG  27           HD1      ARG  27  84.170  -6.369  10.179
  208    HE   ARG  27           HE       ARG  27  81.550  -6.781  10.326
  209   HH11  ARG  27          HH21      ARG  27  84.095  -7.840  12.428
  210   HH12  ARG  27          HH22      ARG  27  83.100  -7.852  13.846
  211   HH21  ARG  27          HH11      ARG  27  80.249  -6.794  12.182
  212   HH22  ARG  27          HH12      ARG  27  80.925  -7.259  13.707
  213    H    ARG  28           HN       ARG  28  84.179  -7.572   4.512
  214    HA   ARG  28           HA       ARG  28  86.999  -6.949   3.835
  215    HB2  ARG  28           HB2      ARG  28  86.066  -9.010   2.663
  216    HB3  ARG  28           HB1      ARG  28  84.925  -7.932   1.863
  217    HG2  ARG  28           HG2      ARG  28  87.125  -6.565   1.275
  218    HG3  ARG  28           HG1      ARG  28  87.899  -8.125   1.533
  219    HD2  ARG  28           HD2      ARG  28  86.163  -9.105  -0.053
  220    HD3  ARG  28           HD1      ARG  28  85.722  -7.449  -0.452
  221    HE   ARG  28           HE       ARG  28  88.426  -7.488  -0.835
  222   HH11  ARG  28          HH21      ARG  28  85.778  -9.462  -1.874
  223   HH12  ARG  28          HH22      ARG  28  86.515  -9.897  -3.380
  224   HH21  ARG  28          HH11      ARG  28  89.397  -8.058  -2.808
  225   HH22  ARG  28          HH12      ARG  28  88.562  -9.103  -3.909
  226    H    TRP  29           HN       TRP  29  87.349  -5.164   2.567
  227    HA   TRP  29           HA       TRP  29  85.093  -3.443   1.872
  228    HB2  TRP  29           HB2      TRP  29  87.405  -2.581   3.608
  229    HB3  TRP  29           HB1      TRP  29  86.102  -1.540   3.036
  230    HD1  TRP  29           HD1      TRP  29  83.556  -2.431   3.850
  231    HE1  TRP  29           HE1      TRP  29  82.884  -3.274   6.202
  232    HE3  TRP  29           HE3      TRP  29  88.144  -3.714   5.646
  233    HZ2  TRP  29           HZ2      TRP  29  84.157  -4.356   8.537
  234    HZ3  TRP  29           HZ3      TRP  29  88.401  -4.642   7.924
  235    HH2  TRP  29           HH2      TRP  29  86.413  -4.972   9.374
  236    H    GLU  30           HN       GLU  30  85.669  -1.762   0.418
  237    HA   GLU  30           HA       GLU  30  88.046  -2.403  -1.178
  238    HB2  GLU  30           HB2      GLU  30  85.910  -0.470  -2.034
  239    HB3  GLU  30           HB1      GLU  30  86.936  -1.505  -3.025
  240    HG2  GLU  30           HG2      GLU  30  84.986  -2.733  -3.133
  241    HG3  GLU  30           HG1      GLU  30  85.664  -3.430  -1.662
  242    H    VAL  31           HN       VAL  31  89.718  -0.914  -1.391
  243    HA   VAL  31           HA       VAL  31  89.269   1.850  -0.509
  244    HB   VAL  31           HB       VAL  31  91.395   1.717   0.849
  245   HG11  VAL  31          HG11      VAL  31  89.134   1.741   1.869
  246   HG12  VAL  31          HG12      VAL  31  90.267   0.768   2.809
  247   HG13  VAL  31          HG13      VAL  31  89.083  -0.019   1.765
  248   HG21  VAL  31          HG21      VAL  31  92.077  -0.490  -0.238
  249   HG22  VAL  31          HG22      VAL  31  90.860  -1.263   0.778
  250   HG23  VAL  31          HG23      VAL  31  92.226  -0.428   1.518
  251    H    LEU  32           HN       LEU  32  90.936   3.284  -1.135
  252    HA   LEU  32           HA       LEU  32  92.318   2.421  -3.585
  253    HB2  LEU  32           HB2      LEU  32  92.566   4.813  -4.065
  254    HB3  LEU  32           HB1      LEU  32  90.878   4.430  -3.750
  255    HG   LEU  32           HG       LEU  32  92.795   5.604  -1.710
  256   HD11  LEU  32          HD11      LEU  32  90.697   6.831  -3.503
  257   HD12  LEU  32          HD12      LEU  32  92.395   7.282  -3.352
  258   HD13  LEU  32          HD13      LEU  32  91.270   7.630  -2.039
  259   HD21  LEU  32          HD21      LEU  32  89.979   4.618  -1.620
  260   HD22  LEU  32          HD22      LEU  32  90.302   6.138  -0.788
  261   HD23  LEU  32          HD23      LEU  32  91.189   4.684  -0.336
  262    H    LEU  33           HN       LEU  33  94.486   2.215  -3.635
  263    HA   LEU  33           HA       LEU  33  95.923   2.716  -1.132
  264    HB2  LEU  33           HB2      LEU  33  96.320   0.537  -2.027
  265    HB3  LEU  33           HB1      LEU  33  96.602   1.168  -3.644
  266    HG   LEU  33           HG       LEU  33  98.484   2.477  -1.955
  267   HD11  LEU  33          HD11      LEU  33  98.357  -0.511  -1.462
  268   HD12  LEU  33          HD12      LEU  33  98.081   0.751  -0.261
  269   HD13  LEU  33          HD13      LEU  33  99.681   0.547  -0.975
  270   HD21  LEU  33          HD21      LEU  33 100.107   1.314  -3.344
  271   HD22  LEU  33          HD22      LEU  33  98.731   1.758  -4.354
  272   HD23  LEU  33          HD23      LEU  33  98.910   0.096  -3.789
  273    H    HIS  34           HN       HIS  34  97.132   4.409  -0.841
  274    HA   HIS  34           HA       HIS  34  97.658   6.203  -3.085
  275    HB2  HIS  34           HB2      HIS  34  97.799   6.450  -0.081
  276    HB3  HIS  34           HB1      HIS  34  98.442   7.712  -1.141
  277    HD2  HIS  34           HD2      HIS  34  94.949   6.133  -0.189
  278    HE1  HIS  34           HE1      HIS  34  94.251   9.662  -2.392
  279    HE2  HIS  34           HE2      HIS  34  93.148   7.816  -1.048
  280    H    ASP  35           HN       ASP  35  99.471   4.056  -0.973
  281    HA   ASP  35           HA       ASP  35 101.610   4.118  -2.780
  282    HB2  ASP  35           HB2      ASP  35 103.341   5.344  -1.639
  283    HB3  ASP  35           HB1      ASP  35 101.921   6.394  -1.645
  284    H    VAL  36           HN       VAL  36 103.494   2.846  -2.085
  285    HA   VAL  36           HA       VAL  36 103.026   1.148   0.256
  286    HB   VAL  36           HB       VAL  36 101.889   0.169  -1.833
  287   HG11  VAL  36          HG11      VAL  36 104.733  -0.567  -2.552
  288   HG12  VAL  36          HG12      VAL  36 103.898   0.799  -3.291
  289   HG13  VAL  36          HG13      VAL  36 103.270  -0.838  -3.498
  290   HG21  VAL  36          HG21      VAL  36 102.425  -2.052  -1.176
  291   HG22  VAL  36          HG22      VAL  36 102.650  -1.086   0.277
  292   HG23  VAL  36          HG23      VAL  36 104.049  -1.596  -0.664
  293    H    SER  37           HN       SER  37 104.854  -0.454   0.528
  294    HA   SER  37           HA       SER  37 107.406   0.431  -0.584
  295    HB2  SER  37           HB2      SER  37 107.103   1.673   1.568
  296    HB3  SER  37           HB1      SER  37 106.912   0.128   2.393
  297    HG   SER  37           HG       SER  37 109.038   0.566   2.555
  298    H    LEU  38           HN       LEU  38 109.131  -1.256   0.139
  299    HA   LEU  38           HA       LEU  38 108.114  -3.811  -0.543
  300    HB2  LEU  38           HB2      LEU  38 110.793  -2.967   0.586
  301    HB3  LEU  38           HB1      LEU  38 110.432  -4.615   0.078
  302    HG   LEU  38           HG       LEU  38 109.704  -2.581  -1.932
  303   HD11  LEU  38          HD11      LEU  38 112.585  -2.949  -1.069
  304   HD12  LEU  38          HD12      LEU  38 111.677  -1.439  -1.148
  305   HD13  LEU  38          HD13      LEU  38 112.113  -2.284  -2.633
  306   HD21  LEU  38          HD21      LEU  38 111.456  -5.061  -2.012
  307   HD22  LEU  38          HD22      LEU  38 110.830  -4.194  -3.413
  308   HD23  LEU  38          HD23      LEU  38 109.721  -5.033  -2.329
  309    H    HIS  39           HN       HIS  39 107.739  -2.191   2.293
  310    HA   HIS  39           HA       HIS  39 107.014  -4.613   3.695
  311    HB2  HIS  39           HB2      HIS  39 109.497  -4.327   4.106
  312    HB3  HIS  39           HB1      HIS  39 109.099  -2.845   4.975
  313    HD2  HIS  39           HD2      HIS  39 107.914  -3.238   7.515
  314    HE1  HIS  39           HE1      HIS  39 108.007  -7.459   7.429
  315    HE2  HIS  39           HE2      HIS  39 107.555  -5.430   8.889
  316    H    GLY  40           HN       GLY  40 105.507  -2.371   2.812
  317    HA2  GLY  40           HA2      GLY  40 104.024  -1.772   5.132
  318    HA3  GLY  40           HA1      GLY  40 105.077  -0.409   4.780
  319    H    ILE  41           HN       ILE  41 102.210  -0.336   4.701
  320    HA   ILE  41           HA       ILE  41 101.819   0.560   1.929
  321    HB   ILE  41           HB       ILE  41 100.726  -1.326   1.377
  322   HG12  ILE  41          HG12      ILE  41  98.691  -0.530   3.482
  323   HG13  ILE  41          HG11      ILE  41  98.827   0.261   1.910
  324   HG21  ILE  41          HG21      ILE  41 100.030  -3.018   3.081
  325   HG22  ILE  41          HG22      ILE  41 100.599  -1.923   4.341
  326   HG23  ILE  41          HG23      ILE  41 101.737  -2.589   3.171
  327   HD11  ILE  41          HD11      ILE  41  98.297  -2.687   2.362
  328   HD12  ILE  41          HD12      ILE  41  98.460  -1.905   0.789
  329   HD13  ILE  41          HD13      ILE  41  97.108  -1.491   1.844
  330    H    LEU  42           HN       LEU  42 100.252   2.057   1.630
  331    HA   LEU  42           HA       LEU  42  98.979   3.181   4.059
  332    HB2  LEU  42           HB2      LEU  42 100.920   4.438   2.599
  333    HB3  LEU  42           HB1      LEU  42  99.474   4.995   1.764
  334    HG   LEU  42           HG       LEU  42  99.752   5.135   4.772
  335   HD11  LEU  42          HD11      LEU  42 101.527   6.451   3.383
  336   HD12  LEU  42          HD12      LEU  42 100.622   7.315   4.624
  337   HD13  LEU  42          HD13      LEU  42 100.169   7.479   2.928
  338   HD21  LEU  42          HD21      LEU  42  97.934   6.421   2.724
  339   HD22  LEU  42          HD22      LEU  42  98.040   6.960   4.400
  340   HD23  LEU  42          HD23      LEU  42  97.478   5.331   4.034
  341    H    VAL  43           HN       VAL  43  96.791   3.593   3.872
  342    HA   VAL  43           HA       VAL  43  95.579   3.462   1.191
  343    HB   VAL  43           HB       VAL  43  93.865   1.880   1.973
  344   HG11  VAL  43          HG11      VAL  43  95.217  -0.082   1.835
  345   HG12  VAL  43          HG12      VAL  43  96.608   0.740   2.541
  346   HG13  VAL  43          HG13      VAL  43  96.074   1.151   0.911
  347   HG21  VAL  43          HG21      VAL  43  94.425   0.642   4.141
  348   HG22  VAL  43          HG22      VAL  43  93.807   2.283   4.328
  349   HG23  VAL  43          HG23      VAL  43  95.533   1.966   4.496
  350    H    GLY  44           HN       GLY  44  93.136   3.822   1.410
  351    HA2  GLY  44           HA2      GLY  44  92.738   6.242   3.073
  352    HA3  GLY  44           HA1      GLY  44  91.763   5.779   1.677
  353    H    GLN  45           HN       GLN  45  90.967   6.379   4.598
  354    HA   GLN  45           HA       GLN  45  90.120   3.818   5.591
  355    HB2  GLN  45           HB2      GLN  45  90.870   5.672   7.055
  356    HB3  GLN  45           HB1      GLN  45  89.449   6.592   6.573
  357    HG2  GLN  45           HG2      GLN  45  88.907   3.829   7.528
  358    HG3  GLN  45           HG1      GLN  45  89.511   4.948   8.748
  359   HE21  GLN  45          HE21      GLN  45  87.301   4.808   9.737
  360   HE22  GLN  45          HE22      GLN  45  86.042   5.737   9.079
  361    HA   PRO  46           HA       PRO  46  86.194   4.588   3.474
  362    HB2  PRO  46           HB2      PRO  46  85.243   2.042   3.373
  363    HB3  PRO  46           HB1      PRO  46  86.588   2.566   2.337
  364    HG2  PRO  46           HG2      PRO  46  86.654   0.984   4.864
  365    HG3  PRO  46           HG1      PRO  46  87.633   0.809   3.399
  366    HD2  PRO  46           HD2      PRO  46  88.461   2.134   5.735
  367    HD3  PRO  46           HD1      PRO  46  89.200   2.325   4.132
  368    H    GLN  47           HN       GLN  47  83.885   4.412   4.081
  369    HA   GLN  47           HA       GLN  47  83.449   4.941   6.823
  370    HB2  GLN  47           HB2      GLN  47  81.599   4.445   4.498
  371    HB3  GLN  47           HB1      GLN  47  80.994   4.785   6.120
  372    HG2  GLN  47           HG2      GLN  47  81.203   6.839   4.707
  373    HG3  GLN  47           HG1      GLN  47  82.179   6.907   6.172
  374   HE21  GLN  47          HE21      GLN  47  82.662   5.525   2.860
  375   HE22  GLN  47          HE22      GLN  47  84.200   6.212   2.652
  376    H    ASP  48           HN       ASP  48  82.801   2.042   4.872
  377    HA   ASP  48           HA       ASP  48  81.412   0.662   6.958
  378    HB2  ASP  48           HB2      ASP  48  81.080   0.139   4.582
  379    HB3  ASP  48           HB1      ASP  48  82.746  -0.425   4.475
  380    H    TRP  49           HN       TRP  49  84.466   1.612   7.070
  381    HA   TRP  49           HA       TRP  49  86.044  -0.658   7.548
  382    HB2  TRP  49           HB2      TRP  49  86.867   1.689   7.320
  383    HB3  TRP  49           HB1      TRP  49  86.269   2.007   8.947
  384    HD1  TRP  49           HD1      TRP  49  87.554   0.978  10.946
  385    HE1  TRP  49           HE1      TRP  49  89.938  -0.079  11.173
  386    HE3  TRP  49           HE3      TRP  49  88.483   0.061   6.067
  387    HZ2  TRP  49           HZ2      TRP  49  91.989  -1.194   9.353
  388    HZ3  TRP  49           HZ3      TRP  49  90.589  -0.996   5.323
  389    HH2  TRP  49           HH2      TRP  49  92.314  -1.631   6.972
  390    H    ASN  50           HN       ASN  50  84.220  -1.906   8.692
  391    HA   ASN  50           HA       ASN  50  84.062  -1.247  11.547
  392    HB2  ASN  50           HB2      ASN  50  81.962  -1.880  10.427
  393    HB3  ASN  50           HB1      ASN  50  82.666  -3.427   9.967
  394   HD21  ASN  50          HD21      ASN  50  83.631  -4.669  12.014
  395   HD22  ASN  50          HD22      ASN  50  82.637  -4.658  13.390
  396    H    GLY  51           HN       GLY  51  86.342  -1.677  11.897
  397    HA2  GLY  51           HA2      GLY  51  86.824  -4.533  12.436
  398    HA3  GLY  51           HA1      GLY  51  88.003  -3.646  11.481
  399    H    ASP  52           HN       ASP  52  88.625  -4.894  13.907
  400    HA   ASP  52           HA       ASP  52  88.809  -2.762  15.915
  401    HB2  ASP  52           HB2      ASP  52  88.154  -5.166  16.469
  402    HB3  ASP  52           HB1      ASP  52  89.841  -5.582  16.171
  403    HA   PRO  53           HA       PRO  53  92.774  -1.620  14.039
  404    HB2  PRO  53           HB2      PRO  53  92.945  -0.301  16.731
  405    HB3  PRO  53           HB1      PRO  53  93.327   0.363  15.134
  406    HG2  PRO  53           HG2      PRO  53  91.068   0.996  16.360
  407    HG3  PRO  53           HG1      PRO  53  91.115   0.735  14.607
  408    HD2  PRO  53           HD2      PRO  53  89.985  -1.018  16.740
  409    HD3  PRO  53           HD1      PRO  53  89.487  -0.834  15.043
  410    H    GLN  54           HN       GLN  54  92.215  -3.185  17.095
  411    HA   GLN  54           HA       GLN  54  94.998  -3.675  17.617
  412    HB2  GLN  54           HB2      GLN  54  92.724  -5.173  18.896
  413    HB3  GLN  54           HB1      GLN  54  94.298  -4.762  19.578
  414    HG2  GLN  54           HG2      GLN  54  92.052  -2.833  18.927
  415    HG3  GLN  54           HG1      GLN  54  92.623  -3.280  20.533
  416   HE21  GLN  54          HE21      GLN  54  94.217  -1.943  21.414
  417   HE22  GLN  54          HE22      GLN  54  95.161  -0.851  20.521
  418    H    ARG  55           HN       ARG  55  92.479  -5.305  15.854
  419    HA   ARG  55           HA       ARG  55  94.000  -7.806  15.796
  420    HB2  ARG  55           HB2      ARG  55  91.273  -6.989  14.797
  421    HB3  ARG  55           HB1      ARG  55  92.012  -8.508  14.292
  422    HG2  ARG  55           HG2      ARG  55  92.200  -9.246  16.602
  423    HG3  ARG  55           HG1      ARG  55  91.623  -7.684  17.185
  424    HD2  ARG  55           HD2      ARG  55  89.513  -8.155  15.764
  425    HD3  ARG  55           HD1      ARG  55  90.084  -9.820  15.711
  426    HE   ARG  55           HE       ARG  55  90.146  -9.200  18.373
  427   HH11  ARG  55          HH21      ARG  55  87.790  -8.993  15.847
  428   HH12  ARG  55          HH22      ARG  55  86.436  -9.230  16.900
  429   HH21  ARG  55          HH11      ARG  55  88.372  -9.513  19.763
  430   HH22  ARG  55          HH12      ARG  55  86.765  -9.525  19.116
  431    HA   PRO  56           HA       PRO  56  96.137  -6.959  12.085
  432    HB2  PRO  56           HB2      PRO  56  96.190  -9.473  10.930
  433    HB3  PRO  56           HB1      PRO  56  97.245  -8.957  12.260
  434    HG2  PRO  56           HG2      PRO  56  94.741 -10.566  12.345
  435    HG3  PRO  56           HG1      PRO  56  96.236 -10.752  13.278
  436    HD2  PRO  56           HD2      PRO  56  94.009  -9.614  14.338
  437    HD3  PRO  56           HD1      PRO  56  95.646  -9.108  14.812
  438    H    PHE  57           HN       PHE  57  96.035  -6.923   9.775
  439    HA   PHE  57           HA       PHE  57  93.334  -7.306   8.617
  440    HB2  PHE  57           HB2      PHE  57  95.187  -4.945   8.176
  441    HB3  PHE  57           HB1      PHE  57  93.636  -5.206   7.381
  442    HD1  PHE  57           HD2      PHE  57  95.221  -4.745  10.735
  443    HD2  PHE  57           HD1      PHE  57  91.616  -4.519   8.413
  444    HE1  PHE  57           HE2      PHE  57  94.061  -3.643  12.633
  445    HE2  PHE  57           HE1      PHE  57  90.459  -3.424  10.308
  446    HZ   PHE  57           HZ       PHE  57  91.678  -2.987  12.419
  447    H    GLU  58           HN       GLU  58  93.444  -7.644   6.223
  448    HA   GLU  58           HA       GLU  58  96.153  -8.398   5.305
  449    HB2  GLU  58           HB2      GLU  58  93.544  -9.866   5.031
  450    HB3  GLU  58           HB1      GLU  58  94.754 -10.036   3.760
  451    HG2  GLU  58           HG2      GLU  58  96.420 -10.752   5.421
  452    HG3  GLU  58           HG1      GLU  58  95.232 -10.558   6.709
  453    H    ALA  59           HN       ALA  59  96.743  -7.619   3.247
  454    HA   ALA  59           HA       ALA  59  94.714  -5.919   1.901
  455    HB1  ALA  59           HB1      ALA  59  96.776  -4.682   1.095
  456    HB2  ALA  59           HB2      ALA  59  97.675  -5.597   2.304
  457    HB3  ALA  59           HB3      ALA  59  96.376  -4.514   2.802
  458    H    ARG  60           HN       ARG  60  94.381  -6.161  -0.209
  459    HA   ARG  60           HA       ARG  60  96.190  -7.941  -1.741
  460    HB2  ARG  60           HB2      ARG  60  93.195  -7.648  -2.095
  461    HB3  ARG  60           HB1      ARG  60  94.263  -8.706  -3.017
  462    HG2  ARG  60           HG2      ARG  60  94.823  -9.389  -0.374
  463    HG3  ARG  60           HG1      ARG  60  93.082  -9.116  -0.364
  464    HD2  ARG  60           HD2      ARG  60  94.605 -10.981  -2.201
  465    HD3  ARG  60           HD1      ARG  60  93.502 -11.444  -0.909
  466    HE   ARG  60           HE       ARG  60  92.164  -9.758  -2.761
  467   HH11  ARG  60          HH21      ARG  60  93.484 -12.932  -2.377
  468   HH12  ARG  60          HH22      ARG  60  92.379 -13.676  -3.484
  469   HH21  ARG  60          HH11      ARG  60  90.711 -10.723  -4.212
  470   HH22  ARG  60          HH12      ARG  60  90.806 -12.424  -4.524
  471    H    LEU  61           HN       LEU  61  97.082  -6.907  -3.482
  472    HA   LEU  61           HA       LEU  61  95.856  -4.343  -4.297
  473    HB2  LEU  61           HB2      LEU  61  98.620  -5.000  -5.152
  474    HB3  LEU  61           HB1      LEU  61  97.947  -3.474  -4.585
  475    HG   LEU  61           HG       LEU  61  98.613  -5.867  -2.842
  476   HD11  LEU  61          HD11      LEU  61 100.447  -4.522  -2.020
  477   HD12  LEU  61          HD12      LEU  61  99.924  -3.140  -2.982
  478   HD13  LEU  61          HD13      LEU  61 100.559  -4.578  -3.779
  479   HD21  LEU  61          HD21      LEU  61  98.285  -3.553  -1.280
  480   HD22  LEU  61          HD22      LEU  61  97.168  -4.911  -1.383
  481   HD23  LEU  61          HD23      LEU  61  96.944  -3.506  -2.424
  482    H    TYR  62           HN       TYR  62  95.479  -3.894  -6.435
  483    HA   TYR  62           HA       TYR  62  95.888  -6.125  -8.332
  484    HB2  TYR  62           HB2      TYR  62  93.507  -4.258  -8.355
  485    HB3  TYR  62           HB1      TYR  62  93.735  -5.727  -9.304
  486    HD1  TYR  62           HD1      TYR  62  93.335  -4.449  -5.822
  487    HD2  TYR  62           HD2      TYR  62  93.143  -7.852  -8.439
  488    HE1  TYR  62           HE1      TYR  62  92.300  -5.798  -4.004
  489    HE2  TYR  62           HE2      TYR  62  92.112  -9.192  -6.625
  490    HH   TYR  62           HH       TYR  62  92.040  -8.144  -3.377
  491    H    LEU  63           HN       LEU  63  97.405  -5.489  -9.677
  492    HA   LEU  63           HA       LEU  63  97.451  -2.697 -10.644
  493    HB2  LEU  63           HB2      LEU  63  99.496  -4.552  -9.826
  494    HB3  LEU  63           HB1      LEU  63  99.767  -4.080 -11.501
  495    HG   LEU  63           HG       LEU  63  99.187  -2.058  -9.327
  496   HD11  LEU  63          HD11      LEU  63 101.301  -3.513  -8.962
  497   HD12  LEU  63          HD12      LEU  63 101.505  -1.762  -8.958
  498   HD13  LEU  63          HD13      LEU  63 101.937  -2.695 -10.389
  499   HD21  LEU  63          HD21      LEU  63 100.342  -1.931 -12.129
  500   HD22  LEU  63          HD22      LEU  63 100.390  -0.577 -11.002
  501   HD23  LEU  63          HD23      LEU  63  98.841  -1.202 -11.562
  502    H    GLY  64           HN       GLY  64  98.862  -5.536 -12.183
  503    HA2  GLY  64           HA2      GLY  64  97.683  -4.872 -14.729
  504    HA3  GLY  64           HA1      GLY  64  98.689  -6.279 -14.376
  505    H    LEU  65           HN       LEU  65  96.615  -6.884 -15.957
  506    HA   LEU  65           HA       LEU  65  94.234  -7.428 -14.481
  507    HB2  LEU  65           HB2      LEU  65  94.888  -8.919 -17.007
  508    HB3  LEU  65           HB1      LEU  65  93.341  -8.268 -16.466
  509    HG   LEU  65           HG       LEU  65  95.715  -6.671 -17.468
  510   HD11  LEU  65          HD11      LEU  65  92.911  -6.880 -18.584
  511   HD12  LEU  65          HD12      LEU  65  94.244  -7.889 -19.142
  512   HD13  LEU  65          HD13      LEU  65  94.318  -6.139 -19.344
  513   HD21  LEU  65          HD21      LEU  65  94.770  -5.268 -15.840
  514   HD22  LEU  65          HD22      LEU  65  93.142  -5.888 -16.112
  515   HD23  LEU  65          HD23      LEU  65  93.881  -4.803 -17.290
  516    H    ASP  66           HN       ASP  66  97.168  -9.226 -15.257
  517    HA   ASP  66           HA       ASP  66  96.172 -11.692 -13.979
  518    HB2  ASP  66           HB2      ASP  66  97.271 -11.692 -16.239
  519    HB3  ASP  66           HB1      ASP  66  98.749 -11.163 -15.438
  520    H    VAL  67           HN       VAL  67  97.425  -8.887 -12.899
  521    HA   VAL  67           HA       VAL  67  99.459 -10.156 -11.167
  522    HB   VAL  67           HB       VAL  67  99.064  -7.319 -12.101
  523   HG11  VAL  67          HG11      VAL  67 100.411  -8.303  -9.593
  524   HG12  VAL  67          HG12      VAL  67  99.425  -6.861  -9.831
  525   HG13  VAL  67          HG13      VAL  67 101.072  -6.913 -10.454
  526   HG21  VAL  67          HG21      VAL  67 101.239  -7.569 -12.967
  527   HG22  VAL  67          HG22      VAL  67 100.544  -9.170 -13.220
  528   HG23  VAL  67          HG23      VAL  67 101.632  -8.884 -11.859
  529    H    LEU  68           HN       LEU  68  98.311 -11.023  -9.565
  530    HA   LEU  68           HA       LEU  68  96.681  -9.196  -7.902
  531    HB2  LEU  68           HB2      LEU  68  95.216 -10.926  -8.507
  532    HB3  LEU  68           HB1      LEU  68  96.491 -12.142  -8.496
  533    HG   LEU  68           HG       LEU  68  96.628 -11.990  -6.043
  534   HD11  LEU  68          HD11      LEU  68  94.728 -10.698  -4.908
  535   HD12  LEU  68          HD12      LEU  68  94.483  -9.897  -6.460
  536   HD13  LEU  68          HD13      LEU  68  96.017  -9.720  -5.609
  537   HD21  LEU  68          HD21      LEU  68  95.024 -13.565  -7.134
  538   HD22  LEU  68          HD22      LEU  68  93.768 -12.336  -6.994
  539   HD23  LEU  68          HD23      LEU  68  94.480 -13.038  -5.542
  540    H    ILE  69           HN       ILE  69  97.782  -8.536  -6.153
  541    HA   ILE  69           HA       ILE  69  99.888 -10.317  -5.086
  542    HB   ILE  69           HB       ILE  69  99.615  -7.304  -5.074
  543   HG12  ILE  69          HG12      ILE  69 102.044  -8.725  -6.051
  544   HG13  ILE  69          HG11      ILE  69 100.587  -8.961  -7.012
  545   HG21  ILE  69          HG21      ILE  69 101.101  -9.080  -3.272
  546   HG22  ILE  69          HG22      ILE  69 100.782  -7.355  -3.129
  547   HG23  ILE  69          HG23      ILE  69 102.143  -7.922  -4.097
  548   HD11  ILE  69          HD11      ILE  69 100.307  -6.450  -7.049
  549   HD12  ILE  69          HD12      ILE  69 101.729  -7.042  -7.908
  550   HD13  ILE  69          HD13      ILE  69 101.901  -6.327  -6.303
  551    H    ARG  70           HN       ARG  70 100.010 -10.764  -2.922
  552    HA   ARG  70           HA       ARG  70  97.805  -9.772  -1.220
  553    HB2  ARG  70           HB2      ARG  70  97.495 -12.160  -2.123
  554    HB3  ARG  70           HB1      ARG  70  98.829 -12.603  -1.059
  555    HG2  ARG  70           HG2      ARG  70  97.624 -12.049   0.889
  556    HG3  ARG  70           HG1      ARG  70  96.468 -11.053   0.006
  557    HD2  ARG  70           HD2      ARG  70  95.512 -13.251   0.699
  558    HD3  ARG  70           HD1      ARG  70  95.502 -13.018  -1.048
  559    HE   ARG  70           HE       ARG  70  97.870 -14.316  -0.545
  560   HH11  ARG  70          HH21      ARG  70  94.525 -14.855   0.162
  561   HH12  ARG  70          HH22      ARG  70  94.654 -16.581   0.124
  562   HH21  ARG  70          HH11      ARG  70  98.045 -16.579  -0.598
  563   HH22  ARG  70          HH12      ARG  70  96.646 -17.557  -0.307
  564    H    MET  71           HN       MET  71  98.396  -9.025   0.697
  565    HA   MET  71           HA       MET  71 100.950  -9.881   1.900
  566    HB2  MET  71           HB2      MET  71 100.265  -6.977   2.059
  567    HB3  MET  71           HB1      MET  71 101.840  -7.765   2.075
  568    HG2  MET  71           HG2      MET  71 101.142  -8.387  -0.429
  569    HG3  MET  71           HG1      MET  71 100.154  -6.940  -0.252
  570    HE1  MET  71           HE1      MET  71 101.157  -4.661   0.731
  571    HE2  MET  71           HE2      MET  71 102.879  -4.339   0.933
  572    HE3  MET  71           HE3      MET  71 102.074  -5.487   1.999
  573    H    GLU  72           HN       GLU  72 100.964  -9.754   4.154
  574    HA   GLU  72           HA       GLU  72  98.313  -9.325   5.357
  575    HB2  GLU  72           HB2      GLU  72  99.363 -11.590   5.678
  576    HB3  GLU  72           HB1      GLU  72 100.680 -10.806   6.552
  577    HG2  GLU  72           HG2      GLU  72  98.846  -9.790   8.052
  578    HG3  GLU  72           HG1      GLU  72  97.769 -10.985   7.332
  579    H    ILE  73           HN       ILE  73  98.108  -7.485   6.600
  580    HA   ILE  73           HA       ILE  73 100.609  -6.320   7.659
  581    HB   ILE  73           HB       ILE  73  99.941  -4.142   6.934
  582   HG12  ILE  73          HG12      ILE  73  97.394  -5.584   6.189
  583   HG13  ILE  73          HG11      ILE  73  97.583  -4.106   7.127
  584   HG21  ILE  73          HG21      ILE  73 100.544  -4.450   4.730
  585   HG22  ILE  73          HG22      ILE  73  99.371  -5.741   4.476
  586   HG23  ILE  73          HG23      ILE  73 100.880  -6.075   5.315
  587   HD11  ILE  73          HD11      ILE  73  96.727  -3.548   4.910
  588   HD12  ILE  73          HD12      ILE  73  98.058  -4.415   4.151
  589   HD13  ILE  73          HD13      ILE  73  98.375  -2.945   5.056
  590    H    SER  74           HN       SER  74 100.327  -4.749   9.345
  591    HA   SER  74           HA       SER  74  97.846  -5.083  10.939
  592    HB2  SER  74           HB2      SER  74 100.730  -4.956  11.837
  593    HB3  SER  74           HB1      SER  74  99.379  -4.680  12.932
  594    HG   SER  74           HG       SER  74  98.587  -6.772  12.146
  595    H    LEU  75           HN       LEU  75  97.176  -3.249  12.135
  596    HA   LEU  75           HA       LEU  75  97.586  -0.783  10.756
  597    HB2  LEU  75           HB2      LEU  75  95.535  -1.556  12.191
  598    HB3  LEU  75           HB1      LEU  75  96.457  -0.896  13.541
  599    HG   LEU  75           HG       LEU  75  96.713   1.227  12.136
  600   HD11  LEU  75          HD11      LEU  75  94.727   1.481  10.511
  601   HD12  LEU  75          HD12      LEU  75  94.657  -0.279  10.526
  602   HD13  LEU  75          HD13      LEU  75  96.109   0.543   9.952
  603   HD21  LEU  75          HD21      LEU  75  93.927   0.411  12.990
  604   HD22  LEU  75          HD22      LEU  75  94.510   2.065  12.811
  605   HD23  LEU  75          HD23      LEU  75  95.182   1.026  14.067
  606    H    ALA  76           HN       ALA  76  99.098   0.642  10.918
  607    HA   ALA  76           HA       ALA  76 100.982   0.478  13.162
  608    HB1  ALA  76           HB1      ALA  76 101.265   1.787  10.454
  609    HB2  ALA  76           HB2      ALA  76 102.024   0.287  10.981
  610    HB3  ALA  76           HB3      ALA  76 102.493   1.814  11.721
  611    H    TRP  77           HN       TRP  77  98.970   2.727  11.371
  612    HA   TRP  77           HA       TRP  77  98.448   4.375  13.671
  613    HB2  TRP  77           HB2      TRP  77  99.599   6.415  12.904
  614    HB3  TRP  77           HB1      TRP  77 100.776   5.114  13.138
  615    HD1  TRP  77           HD1      TRP  77 101.997   4.165  11.035
  616    HE1  TRP  77           HE1      TRP  77 101.872   4.651   8.511
  617    HE3  TRP  77           HE3      TRP  77  98.154   7.524  10.953
  618    HZ2  TRP  77           HZ2      TRP  77 100.545   6.424   6.745
  619    HZ3  TRP  77           HZ3      TRP  77  97.493   8.620   8.830
  620    HH2  TRP  77           HH2      TRP  77  98.671   8.065   6.717
  621    H    ALA  78           HN       ALA  78  97.126   6.316  13.068
  622    HA   ALA  78           HA       ALA  78  95.923   6.235  10.369
  623    HB1  ALA  78           HB1      ALA  78  94.490   4.804  11.721
  624    HB2  ALA  78           HB2      ALA  78  93.662   6.319  11.363
  625    HB3  ALA  78           HB3      ALA  78  94.369   6.056  12.957
  626    H    ARG  79           HN       ARG  79  95.885   8.356   9.641
  627    HA   ARG  79           HA       ARG  79  95.102  10.433  11.509
  628    HB2  ARG  79           HB2      ARG  79  97.704  10.017  11.541
  629    HB3  ARG  79           HB1      ARG  79  97.671  10.934  10.037
  630    HG2  ARG  79           HG2      ARG  79  96.621  12.823  11.155
  631    HG3  ARG  79           HG1      ARG  79  96.482  11.903  12.654
  632    HD2  ARG  79           HD2      ARG  79  99.160  11.659  12.143
  633    HD3  ARG  79           HD1      ARG  79  98.838  13.259  11.482
  634    HE   ARG  79           HE       ARG  79  97.637  13.417  13.887
  635   HH11  ARG  79          HH21      ARG  79 100.722  12.218  12.875
  636   HH12  ARG  79          HH22      ARG  79 101.517  12.606  14.364
  637   HH21  ARG  79          HH11      ARG  79  98.672  13.929  15.845
  638   HH22  ARG  79          HH12      ARG  79 100.356  13.576  16.046
  639    H    ASP  80           HN       ASP  80  93.978  12.032  10.618
  640    HA   ASP  80           HA       ASP  80  92.898  13.290   9.056
  641    HB2  ASP  80           HB2      ASP  80  95.426  13.836   8.742
  642    HB3  ASP  80           HB1      ASP  80  95.239  12.971   7.218
  643    H    GLY  81           HN       GLY  81  91.989  10.667   8.869
  644    HA2  GLY  81           HA2      GLY  81  90.571   9.603   7.399
  645    HA3  GLY  81           HA1      GLY  81  91.123  10.679   6.126
  646    H    LEU  82           HN       LEU  82  94.010   9.877   6.673
  647    HA   LEU  82           HA       LEU  82  93.917   7.507   4.979
  648    HB2  LEU  82           HB2      LEU  82  96.445   8.827   5.922
  649    HB3  LEU  82           HB1      LEU  82  96.117   7.998   4.400
  650    HG   LEU  82           HG       LEU  82  95.054  10.701   5.258
  651   HD11  LEU  82          HD11      LEU  82  97.436  10.455   4.350
  652   HD12  LEU  82          HD12      LEU  82  96.387  11.568   3.472
  653   HD13  LEU  82          HD13      LEU  82  96.697   9.956   2.828
  654   HD21  LEU  82          HD21      LEU  82  94.344   8.878   2.952
  655   HD22  LEU  82          HD22      LEU  82  94.126  10.624   2.839
  656   HD23  LEU  82          HD23      LEU  82  93.257   9.706   4.067
  657    H    LEU  83           HN       LEU  83  95.286   5.649   5.433
  658    HA   LEU  83           HA       LEU  83  95.685   5.131   8.349
  659    HB2  LEU  83           HB2      LEU  83  94.625   3.190   6.308
  660    HB3  LEU  83           HB1      LEU  83  94.814   2.928   8.039
  661    HG   LEU  83           HG       LEU  83  93.037   5.068   6.846
  662   HD11  LEU  83          HD11      LEU  83  91.198   3.474   7.600
  663   HD12  LEU  83          HD12      LEU  83  92.449   2.247   7.770
  664   HD13  LEU  83          HD13      LEU  83  92.117   2.950   6.188
  665   HD21  LEU  83          HD21      LEU  83  93.549   4.005   9.629
  666   HD22  LEU  83          HD22      LEU  83  92.031   4.807   9.230
  667   HD23  LEU  83          HD23      LEU  83  93.554   5.680   9.077
  668    H    GLY  84           HN       GLY  84  97.664   4.202   8.815
  669    HA2  GLY  84           HA2      GLY  84  99.327   3.363   6.539
  670    HA3  GLY  84           HA1      GLY  84  99.905   3.807   8.137
  671    H    PHE  85           HN       PHE  85 100.490   1.400   6.679
  672    HA   PHE  85           HA       PHE  85  99.643  -0.527   8.723
  673    HB2  PHE  85           HB2      PHE  85  99.155  -0.771   5.761
  674    HB3  PHE  85           HB1      PHE  85  99.307  -2.188   6.792
  675    HD1  PHE  85           HD2      PHE  85  97.743  -2.490   8.733
  676    HD2  PHE  85           HD1      PHE  85  97.162   0.548   5.758
  677    HE1  PHE  85           HE2      PHE  85  95.384  -2.248   9.447
  678    HE2  PHE  85           HE1      PHE  85  94.797   0.785   6.471
  679    HZ   PHE  85           HZ       PHE  85  93.914  -0.606   8.316
  680    H    GLU  86           HN       GLU  86 101.251  -1.934   9.269
  681    HA   GLU  86           HA       GLU  86 103.748  -1.732   7.716
  682    HB2  GLU  86           HB2      GLU  86 104.826  -2.625   9.764
  683    HB3  GLU  86           HB1      GLU  86 103.948  -1.129  10.080
  684    HG2  GLU  86           HG2      GLU  86 101.961  -2.863  10.589
  685    HG3  GLU  86           HG1      GLU  86 103.324  -3.916  10.954
  686    H    CYS  87           HN       CYS  87 104.436  -3.454   6.586
  687    HA   CYS  87           HA       CYS  87 102.792  -5.748   6.302
  688    HB2  CYS  87           HB2      CYS  87 104.112  -4.927   4.443
  689    HB3  CYS  87           HB1      CYS  87 105.601  -5.208   5.343
  690    HG   CYS  87           HG       CYS  87 103.938  -7.363   3.930
  691    H    GLN  88           HN       GLN  88 102.663  -7.475   7.539
  692    HA   GLN  88           HA       GLN  88 104.847  -8.120   9.391
  693    HB2  GLN  88           HB2      GLN  88 102.153  -9.472   9.186
  694    HB3  GLN  88           HB1      GLN  88 103.274  -9.490  10.547
  695    HG2  GLN  88           HG2      GLN  88 101.832  -7.044   9.490
  696    HG3  GLN  88           HG1      GLN  88 101.408  -7.929  10.953
  697   HE21  GLN  88          HE21      GLN  88 104.098  -6.061   9.474
  698   HE22  GLN  88          HE22      GLN  88 104.762  -5.561  10.954
  699    H    HIS  89           HN       HIS  89 103.090  -9.406   6.616
  700    HA   HIS  89           HA       HIS  89 105.263 -11.187   5.992
  701    HB2  HIS  89           HB2      HIS  89 104.483 -13.107   6.871
  702    HB3  HIS  89           HB1      HIS  89 103.189 -12.196   7.644
  703    HD2  HIS  89           HD2      HIS  89 100.732 -13.105   6.821
  704    HE1  HIS  89           HE1      HIS  89 101.839 -14.526   3.000
  705    HE2  HIS  89           HE2      HIS  89  99.910 -14.273   4.633
  706    H    ILE  90           HN       ILE  90 105.257 -11.740   3.845
  707    HA   ILE  90           HA       ILE  90 102.879 -11.223   2.175
  708    HB   ILE  90           HB       ILE  90 104.019  -9.073   2.205
  709   HG12  ILE  90          HG12      ILE  90 104.638 -10.652  -0.316
  710   HG13  ILE  90          HG11      ILE  90 103.113  -9.848   0.047
  711   HG21  ILE  90          HG21      ILE  90 106.419  -8.993   1.383
  712   HG22  ILE  90          HG22      ILE  90 106.464 -10.745   1.572
  713   HG23  ILE  90          HG23      ILE  90 106.204  -9.715   2.976
  714   HD11  ILE  90          HD11      ILE  90 105.765  -8.652  -0.661
  715   HD12  ILE  90          HD12      ILE  90 104.672  -7.737   0.376
  716   HD13  ILE  90          HD13      ILE  90 104.156  -8.223  -1.240
  717    H    ASP  91           HN       ASP  91 102.715 -12.409   0.423
  718    HA   ASP  91           HA       ASP  91 104.039 -14.857   0.298
  719    HB2  ASP  91           HB2      ASP  91 102.628 -13.437  -1.967
  720    HB3  ASP  91           HB1      ASP  91 102.964 -15.162  -1.865
  721    H    LEU  92           HN       LEU  92 105.626 -15.700  -0.861
  722    HA   LEU  92           HA       LEU  92 107.906 -14.208  -1.459
  723    HB2  LEU  92           HB2      LEU  92 107.605 -16.791  -1.195
  724    HB3  LEU  92           HB1      LEU  92 107.340 -16.766  -2.937
  725    HG   LEU  92           HG       LEU  92 109.547 -15.309  -2.952
  726   HD11  LEU  92          HD11      LEU  92 109.762 -16.875  -0.361
  727   HD12  LEU  92          HD12      LEU  92 109.776 -15.119  -0.526
  728   HD13  LEU  92          HD13      LEU  92 111.112 -16.076  -1.166
  729   HD21  LEU  92          HD21      LEU  92 109.425 -18.309  -2.529
  730   HD22  LEU  92          HD22      LEU  92 110.870 -17.462  -3.081
  731   HD23  LEU  92          HD23      LEU  92 109.409 -17.448  -4.068
  732    H    ASP  93           HN       ASP  93 105.335 -15.310  -3.635
  733    HA   ASP  93           HA       ASP  93 106.501 -14.291  -6.019
  734    HB2  ASP  93           HB2      ASP  93 104.696 -16.027  -5.932
  735    HB3  ASP  93           HB1      ASP  93 103.567 -14.764  -5.445
  736    H    SER  94           HN       SER  94 104.147 -13.007  -3.703
  737    HA   SER  94           HA       SER  94 103.515 -10.624  -5.056
  738    HB2  SER  94           HB2      SER  94 103.504 -11.412  -2.153
  739    HB3  SER  94           HB1      SER  94 103.069  -9.785  -2.655
  740    HG   SER  94           HG       SER  94 101.878 -12.238  -3.453
  741    H    ILE  95           HN       ILE  95 106.130 -11.472  -2.853
  742    HA   ILE  95           HA       ILE  95 107.202  -8.916  -2.434
  743    HB   ILE  95           HB       ILE  95 108.431 -11.673  -2.453
  744   HG12  ILE  95          HG12      ILE  95 108.033  -9.686  -0.205
  745   HG13  ILE  95          HG11      ILE  95 106.830 -10.894  -0.645
  746   HG21  ILE  95          HG21      ILE  95 109.747  -8.985  -2.079
  747   HG22  ILE  95          HG22      ILE  95 110.310 -10.371  -3.013
  748   HG23  ILE  95          HG23      ILE  95 110.367 -10.415  -1.252
  749   HD11  ILE  95          HD11      ILE  95 108.780 -11.341   1.188
  750   HD12  ILE  95          HD12      ILE  95 109.589 -11.920  -0.268
  751   HD13  ILE  95          HD13      ILE  95 108.047 -12.621   0.224
  752    H    SER  96           HN       SER  96 107.678 -11.240  -5.063
  753    HA   SER  96           HA       SER  96 109.753  -9.712  -6.267
  754    HB2  SER  96           HB2      SER  96 108.701 -12.263  -6.668
  755    HB3  SER  96           HB1      SER  96 108.240 -11.397  -8.134
  756    HG   SER  96           HG       SER  96 110.318 -11.114  -8.632
  757    H    HIS  97           HN       HIS  97 106.243  -9.854  -6.803
  758    HA   HIS  97           HA       HIS  97 106.305  -8.199  -9.091
  759    HB2  HIS  97           HB2      HIS  97 104.179  -8.780  -7.026
  760    HB3  HIS  97           HB1      HIS  97 103.916  -7.587  -8.283
  761    HD2  HIS  97           HD2      HIS  97 104.200 -11.469  -7.932
  762    HE1  HIS  97           HE1      HIS  97 103.207 -10.575 -11.933
  763    HE2  HIS  97           HE2      HIS  97 103.495 -12.451 -10.247
  764    H    LEU  98           HN       LEU  98 106.383  -7.531  -5.659
  765    HA   LEU  98           HA       LEU  98 106.124  -4.663  -5.878
  766    HB2  LEU  98           HB2      LEU  98 106.018  -6.362  -3.767
  767    HB3  LEU  98           HB1      LEU  98 107.709  -5.883  -3.664
  768    HG   LEU  98           HG       LEU  98 106.391  -4.369  -2.300
  769   HD11  LEU  98          HD11      LEU  98 108.269  -3.528  -3.901
  770   HD12  LEU  98          HD12      LEU  98 107.228  -2.340  -3.118
  771   HD13  LEU  98          HD13      LEU  98 106.945  -2.785  -4.800
  772   HD21  LEU  98          HD21      LEU  98 104.868  -3.254  -4.607
  773   HD22  LEU  98          HD22      LEU  98 104.389  -3.434  -2.921
  774   HD23  LEU  98          HD23      LEU  98 104.332  -4.823  -4.004
  775    H    ARG  99           HN       ARG  99 108.782  -6.957  -6.114
  776    HA   ARG  99           HA       ARG  99 110.853  -4.992  -6.074
  777    HB2  ARG  99           HB2      ARG  99 110.682  -7.801  -7.166
  778    HB3  ARG  99           HB1      ARG  99 112.128  -6.817  -7.366
  779    HG2  ARG  99           HG2      ARG  99 112.501  -6.683  -5.031
  780    HG3  ARG  99           HG1      ARG  99 110.863  -7.215  -4.653
  781    HD2  ARG  99           HD2      ARG  99 111.497  -9.382  -4.682
  782    HD3  ARG  99           HD1      ARG  99 112.225  -9.204  -6.275
  783    HE   ARG  99           HE       ARG  99 113.808  -8.136  -4.083
  784   HH11  ARG  99          HH21      ARG  99 113.041 -10.830  -6.118
  785   HH12  ARG  99          HH22      ARG  99 114.561 -11.624  -5.872
  786   HH21  ARG  99          HH11      ARG  99 115.804  -9.174  -3.757
  787   HH22  ARG  99          HH12      ARG  99 116.125 -10.686  -4.538
  788    H    ARG 100           HN       ARG 100 108.888  -6.480  -8.593
  789    HA   ARG 100           HA       ARG 100 110.075  -5.347 -10.894
  790    HB2  ARG 100           HB2      ARG 100 107.246  -6.213 -10.303
  791    HB3  ARG 100           HB1      ARG 100 107.800  -5.695 -11.894
  792    HG2  ARG 100           HG2      ARG 100 109.641  -7.456 -11.675
  793    HG3  ARG 100           HG1      ARG 100 108.744  -8.077 -10.289
  794    HD2  ARG 100           HD2      ARG 100 107.919  -7.986 -13.180
  795    HD3  ARG 100           HD1      ARG 100 107.911  -9.356 -12.074
  796    HE   ARG 100           HE       ARG 100 106.105  -7.766 -10.907
  797   HH11  ARG 100          HH21      ARG 100 106.620  -8.598 -14.227
  798   HH12  ARG 100          HH22      ARG 100 104.952  -8.449 -14.667
  799   HH21  ARG 100          HH11      ARG 100 103.916  -7.569 -11.476
  800   HH22  ARG 100          HH12      ARG 100 103.420  -7.866 -13.109
  801    H    LEU 101           HN       LEU 101 107.480  -4.188  -8.762
  802    HA   LEU 101           HA       LEU 101 106.862  -1.875 -10.266
  803    HB2  LEU 101           HB2      LEU 101 106.285  -2.857  -7.509
  804    HB3  LEU 101           HB1      LEU 101 106.109  -1.126  -7.778
  805    HG   LEU 101           HG       LEU 101 103.979  -2.266  -8.161
  806   HD11  LEU 101          HD11      LEU 101 103.450  -0.961  -9.939
  807   HD12  LEU 101          HD12      LEU 101 104.682  -1.684 -10.972
  808   HD13  LEU 101          HD13      LEU 101 105.122  -0.418  -9.825
  809   HD21  LEU 101          HD21      LEU 101 104.524  -4.473  -8.771
  810   HD22  LEU 101          HD22      LEU 101 105.645  -3.953 -10.028
  811   HD23  LEU 101          HD23      LEU 101 103.912  -3.785 -10.273
  812    H    VAL 102           HN       VAL 102 109.129  -2.498  -7.644
  813    HA   VAL 102           HA       VAL 102 109.956   0.201  -7.272
  814    HB   VAL 102           HB       VAL 102 111.313  -2.424  -6.631
  815   HG11  VAL 102          HG11      VAL 102 112.027   0.441  -5.967
  816   HG12  VAL 102          HG12      VAL 102 113.043  -0.776  -6.738
  817   HG13  VAL 102          HG13      VAL 102 112.630  -0.927  -5.031
  818   HG21  VAL 102          HG21      VAL 102 109.083  -1.746  -5.522
  819   HG22  VAL 102          HG22      VAL 102 110.001  -0.457  -4.748
  820   HG23  VAL 102          HG23      VAL 102 110.422  -2.141  -4.446
  821    H    GLU 103           HN       GLU 103 111.251  -2.497  -9.188
  822    HA   GLU 103           HA       GLU 103 113.576  -1.191 -10.098
  823    HB2  GLU 103           HB2      GLU 103 111.971  -3.537 -11.049
  824    HB3  GLU 103           HB1      GLU 103 113.262  -2.902 -12.068
  825    HG2  GLU 103           HG2      GLU 103 114.021  -4.727 -10.528
  826    HG3  GLU 103           HG1      GLU 103 114.892  -3.212 -10.304
  827    H    LEU 104           HN       LEU 104 110.360  -1.498 -11.630
  828    HA   LEU 104           HA       LEU 104 111.061  -0.035 -13.957
  829    HB2  LEU 104           HB2      LEU 104 108.345  -0.478 -12.689
  830    HB3  LEU 104           HB1      LEU 104 108.614   0.147 -14.316
  831    HG   LEU 104           HG       LEU 104 109.881  -2.462 -13.516
  832   HD11  LEU 104          HD11      LEU 104 107.608  -2.860 -12.876
  833   HD12  LEU 104          HD12      LEU 104 107.794  -3.561 -14.483
  834   HD13  LEU 104          HD13      LEU 104 106.992  -2.003 -14.288
  835   HD21  LEU 104          HD21      LEU 104 110.338  -1.228 -15.707
  836   HD22  LEU 104          HD22      LEU 104 108.662  -1.560 -16.139
  837   HD23  LEU 104          HD23      LEU 104 109.786  -2.893 -15.877
  838    H    ASN 105           HN       ASN 105 109.695   0.909 -10.844
  839    HA   ASN 105           HA       ASN 105 109.172   3.618 -11.583
  840    HB2  ASN 105           HB2      ASN 105 109.518   2.295  -8.887
  841    HB3  ASN 105           HB1      ASN 105 109.032   3.975  -9.105
  842   HD21  ASN 105          HD21      ASN 105 107.405   3.421 -11.529
  843   HD22  ASN 105          HD22      ASN 105 106.020   2.602 -10.987
  844    H    LEU 106           HN       LEU 106 111.982   1.884 -10.502
  845    HA   LEU 106           HA       LEU 106 113.503   4.058  -9.520
  846    HB2  LEU 106           HB2      LEU 106 113.927   1.478  -9.397
  847    HB3  LEU 106           HB1      LEU 106 114.744   1.710 -10.939
  848    HG   LEU 106           HG       LEU 106 115.439   3.550  -8.666
  849   HD11  LEU 106          HD11      LEU 106 115.490   1.292  -7.667
  850   HD12  LEU 106          HD12      LEU 106 117.120   1.941  -7.860
  851   HD13  LEU 106          HD13      LEU 106 116.512   0.732  -8.991
  852   HD21  LEU 106          HD21      LEU 106 117.652   3.445  -9.764
  853   HD22  LEU 106          HD22      LEU 106 116.401   3.894 -10.921
  854   HD23  LEU 106          HD23      LEU 106 117.033   2.249 -10.901
  855    H    GLY 107           HN       GLY 107 113.202   2.606 -12.743
  856    HA2  GLY 107           HA2      GLY 107 113.306   3.821 -14.773
  857    HA3  GLY 107           HA1      GLY 107 114.159   5.114 -13.933
  858    H    ASP 108           HN       ASP 108 116.326   5.195 -14.081
  859    HA   ASP 108           HA       ASP 108 117.949   2.855 -14.446
  860    HB2  ASP 108           HB2      ASP 108 116.895   3.509 -16.767
  861    HB3  ASP 108           HB1      ASP 108 118.122   4.774 -16.745
  862    H    GLU 109           HN       GLU 109 120.283   3.768 -15.228
  863    HA   GLU 109           HA       GLU 109 121.381   5.158 -13.141
  864    HB2  GLU 109           HB2      GLU 109 122.223   5.085 -16.042
  865    HB3  GLU 109           HB1      GLU 109 123.205   5.821 -14.775
  866    HG2  GLU 109           HG2      GLU 109 123.288   3.702 -13.560
  867    HG3  GLU 109           HG1      GLU 109 122.225   2.952 -14.749
  868    H    GLU 110           HN       GLU 110 121.791   7.287 -12.624
  869    HA   GLU 110           HA       GLU 110 120.826   9.396 -14.420
  870    HB2  GLU 110           HB2      GLU 110 119.705  10.420 -12.289
  871    HB3  GLU 110           HB1      GLU 110 118.846   9.186 -13.209
  872    HG2  GLU 110           HG2      GLU 110 119.609   7.452 -11.666
  873    HG3  GLU 110           HG1      GLU 110 120.562   8.636 -10.772
  874    H    LEU 111           HN       LEU 111 121.048  11.552 -12.770
  875    HA   LEU 111           HA       LEU 111 123.904  11.489 -11.986
  876    HB2  LEU 111           HB2      LEU 111 122.394  13.976 -12.760
  877    HB3  LEU 111           HB1      LEU 111 124.135  13.702 -12.744
  878    HG   LEU 111           HG       LEU 111 123.427  11.776 -14.499
  879   HD11  LEU 111          HD11      LEU 111 121.363  13.979 -14.825
  880   HD12  LEU 111          HD12      LEU 111 121.035  12.292 -14.430
  881   HD13  LEU 111          HD13      LEU 111 121.682  12.717 -16.014
  882   HD21  LEU 111          HD21      LEU 111 125.088  13.386 -15.065
  883   HD22  LEU 111          HD22      LEU 111 123.938  14.719 -14.973
  884   HD23  LEU 111          HD23      LEU 111 123.843  13.563 -16.301
  885    H    LEU 112           HN       LEU 112 123.027  14.408 -11.133
  886    HA   LEU 112           HA       LEU 112 122.603  15.471  -9.149
  887    HB2  LEU 112           HB2      LEU 112 120.612  13.233  -9.161
  888    HB3  LEU 112           HB1      LEU 112 120.802  14.189  -7.692
  889    HG   LEU 112           HG       LEU 112 120.507  15.603 -10.330
  890   HD11  LEU 112          HD11      LEU 112 118.301  14.308  -8.712
  891   HD12  LEU 112          HD12      LEU 112 118.644  14.102 -10.430
  892   HD13  LEU 112          HD13      LEU 112 118.007  15.635  -9.835
  893   HD21  LEU 112          HD21      LEU 112 121.015  16.641  -7.976
  894   HD22  LEU 112          HD22      LEU 112 119.304  16.348  -7.666
  895   HD23  LEU 112          HD23      LEU 112 119.793  17.401  -8.994
  896    H    GLU 113           HN       GLU 113 124.179  12.605  -9.348
  897    HA   GLU 113           HA       GLU 113 125.316  11.236  -7.853
  898    HB2  GLU 113           HB2      GLU 113 126.082  14.085  -7.370
  899    HB3  GLU 113           HB1      GLU 113 126.753  12.846  -6.311
  900    HG2  GLU 113           HG2      GLU 113 126.826  12.511  -9.306
  901    HG3  GLU 113           HG1      GLU 113 128.059  13.459  -8.476
  902    H    ARG 114           HN       ARG 114 124.837  13.874  -5.559
  903    HA   ARG 114           HA       ARG 114 124.578  12.752  -3.214
  904    HB2  ARG 114           HB2      ARG 114 122.589  14.700  -4.384
  905    HB3  ARG 114           HB1      ARG 114 122.592  14.244  -2.682
  906    HG2  ARG 114           HG2      ARG 114 123.893  16.262  -2.879
  907    HG3  ARG 114           HG1      ARG 114 125.017  14.939  -2.581
  908    HD2  ARG 114           HD2      ARG 114 125.885  15.013  -4.722
  909    HD3  ARG 114           HD1      ARG 114 124.384  15.601  -5.428
  910    HE   ARG 114           HE       ARG 114 125.222  17.681  -3.867
  911   HH11  ARG 114          HH21      ARG 114 126.641  15.719  -6.339
  912   HH12  ARG 114          HH22      ARG 114 127.687  16.970  -6.924
  913   HH21  ARG 114          HH11      ARG 114 126.591  19.326  -4.628
  914   HH22  ARG 114          HH12      ARG 114 127.658  19.012  -5.956
  915    H    GLU 115           HN       GLU 115 121.541  12.988  -5.068
  916    HA   GLU 115           HA       GLU 115 119.925  11.363  -3.638
  917    HB2  GLU 115           HB2      GLU 115 120.189  11.740  -6.605
  918    HB3  GLU 115           HB1      GLU 115 118.998  10.609  -5.961
  919    HG2  GLU 115           HG2      GLU 115 119.220  13.473  -5.009
  920    HG3  GLU 115           HG1      GLU 115 118.158  12.984  -6.329
  921    H    LEU 116           HN       LEU 116 122.337  10.249  -5.989
  922    HA   LEU 116           HA       LEU 116 121.728   7.484  -5.738
  923    HB2  LEU 116           HB2      LEU 116 123.037   8.599  -7.609
  924    HB3  LEU 116           HB1      LEU 116 124.406   8.654  -6.499
  925    HG   LEU 116           HG       LEU 116 123.810   6.074  -6.182
  926   HD11  LEU 116          HD11      LEU 116 122.902   5.042  -8.143
  927   HD12  LEU 116          HD12      LEU 116 122.971   6.551  -9.051
  928   HD13  LEU 116          HD13      LEU 116 121.806   6.364  -7.741
  929   HD21  LEU 116          HD21      LEU 116 125.450   5.564  -7.970
  930   HD22  LEU 116          HD22      LEU 116 125.958   6.952  -7.008
  931   HD23  LEU 116          HD23      LEU 116 125.253   7.198  -8.605
  932    H    ALA 117           HN       ALA 117 124.096   9.596  -4.128
  933    HA   ALA 117           HA       ALA 117 125.268   7.482  -2.640
  934    HB1  ALA 117           HB1      ALA 117 125.378  10.359  -1.749
  935    HB2  ALA 117           HB2      ALA 117 126.264   9.837  -3.182
  936    HB3  ALA 117           HB3      ALA 117 126.619   9.113  -1.613
  937    H    LEU 118           HN       LEU 118 122.402   9.329  -2.209
  938    HA   LEU 118           HA       LEU 118 122.093   9.307   0.551
  939    HB2  LEU 118           HB2      LEU 118 120.016   8.936  -1.618
  940    HB3  LEU 118           HB1      LEU 118 119.615   9.142   0.082
  941    HG   LEU 118           HG       LEU 118 121.143  11.121  -1.632
  942   HD11  LEU 118          HD11      LEU 118 118.477  11.547  -0.289
  943   HD12  LEU 118          HD12      LEU 118 118.569  10.794  -1.880
  944   HD13  LEU 118          HD13      LEU 118 119.184  12.430  -1.642
  945   HD21  LEU 118          HD21      LEU 118 120.526  12.517   0.572
  946   HD22  LEU 118          HD22      LEU 118 122.015  11.580   0.468
  947   HD23  LEU 118          HD23      LEU 118 120.613  10.917   1.311
  948    H    LEU 119           HN       LEU 119 121.843   6.639  -1.725
  949    HA   LEU 119           HA       LEU 119 120.440   4.804  -0.102
  950    HB2  LEU 119           HB2      LEU 119 122.720   4.114  -1.972
  951    HB3  LEU 119           HB1      LEU 119 121.379   3.076  -1.489
  952    HG   LEU 119           HG       LEU 119 121.235   5.566  -3.209
  953   HD11  LEU 119          HD11      LEU 119 121.942   3.469  -4.326
  954   HD12  LEU 119          HD12      LEU 119 120.352   3.996  -4.880
  955   HD13  LEU 119          HD13      LEU 119 120.489   2.672  -3.722
  956   HD21  LEU 119          HD21      LEU 119 118.754   4.863  -3.320
  957   HD22  LEU 119          HD22      LEU 119 119.292   5.682  -1.857
  958   HD23  LEU 119          HD23      LEU 119 119.082   3.932  -1.858
  959    H    VAL 120           HN       VAL 120 123.648   6.068   0.013
  960    HA   VAL 120           HA       VAL 120 125.073   4.176   1.492
  961    HB   VAL 120           HB       VAL 120 125.215   7.184   1.631
  962   HG11  VAL 120          HG11      VAL 120 126.393   5.695   3.436
  963   HG12  VAL 120          HG12      VAL 120 127.323   6.950   2.624
  964   HG13  VAL 120          HG13      VAL 120 127.486   5.270   2.120
  965   HG21  VAL 120          HG21      VAL 120 126.583   7.119  -0.249
  966   HG22  VAL 120          HG22      VAL 120 125.476   5.801  -0.635
  967   HG23  VAL 120          HG23      VAL 120 127.069   5.447   0.033
  968    H    SER 121           HN       SER 121 123.003   6.840   2.624
  969    HA   SER 121           HA       SER 121 123.521   6.487   5.374
  970    HB2  SER 121           HB2      SER 121 121.729   8.008   5.750
  971    HB3  SER 121           HB1      SER 121 122.508   8.515   4.253
  972    HG   SER 121           HG       SER 121 119.984   7.885   4.623
  973    H    ALA 122           HN       ALA 122 121.712   4.491   3.271
  974    HA   ALA 122           HA       ALA 122 120.180   3.442   5.568
  975    HB1  ALA 122           HB1      ALA 122 118.725   4.158   3.760
  976    HB2  ALA 122           HB2      ALA 122 118.693   2.397   3.859
  977    HB3  ALA 122           HB3      ALA 122 119.638   3.193   2.600
  978    H    HIS 123           HN       HIS 123 120.838   1.742   2.548
  979    HA   HIS 123           HA       HIS 123 122.440  -0.234   4.080
  980    HB2  HIS 123           HB2      HIS 123 119.969  -0.829   3.500
  981    HB3  HIS 123           HB1      HIS 123 120.586  -1.051   1.862
  982    HD2  HIS 123           HD2      HIS 123 121.962  -2.322   5.398
  983    HE1  HIS 123           HE1      HIS 123 122.178  -5.465   2.584
  984    HE2  HIS 123           HE2      HIS 123 122.655  -4.809   4.992
  985    H    ASP 124           HN       ASP 124 122.658  -1.964   1.847
  986    HA   ASP 124           HA       ASP 124 124.595  -2.360   0.522
  987    HB2  ASP 124           HB2      ASP 124 122.754  -0.496  -0.988
  988    HB3  ASP 124           HB1      ASP 124 124.140  -1.287  -1.739
  989    H    ASP 125           HN       ASP 125 125.535  -0.793   2.374
  990    HA   ASP 125           HA       ASP 125 127.508   0.380   2.690
  991    HB2  ASP 125           HB2      ASP 125 127.451   1.415  -0.129
  992    HB3  ASP 125           HB1      ASP 125 128.834   1.085   0.911
  993   H5'1  C2E 501          H5'1      C2E 501 105.408   3.325  10.428
  994   H5'2  C2E 501          H5'2      C2E 501 104.689   1.928  11.246
  995    H4'  C2E 501           H4'      C2E 501 106.971   0.761  10.528
  996    H3'  C2E 501           H3'      C2E 501 106.805   3.161   8.721
  997    H2'  C2E 501           H2'      C2E 501 106.987   1.922   6.747
  998   HO2'  C2E 501          HO2'      C2E 501 108.172   0.165   6.685
  999    H1'  C2E 501           H1'      C2E 501 105.309  -0.084   7.341
 1000    H8   C2E 501           H8       C2E 501 103.589   2.501   9.304
 1001    HN1  C2E 501           HN1      C2E 501 103.138   3.746   3.042
 1002   HN21  C2E 501          HN21      C2E 501 104.579   2.492   1.910
 1003   HN22  C2E 501          HN22      C2E 501 105.639   1.344   2.695
 1004   H511  C2E 501          H511      C2E 501 108.139   4.517  10.113
 1005   H512  C2E 501          H512      C2E 501 109.832   4.565  10.649
 1006    H4A  C2E 501           H4A      C2E 501 108.961   5.257  12.941
 1007    H3A  C2E 501           H3A      C2E 501 106.303   5.324  11.495
 1008    H2A  C2E 501           H2A      C2E 501 105.758   7.348  12.446
 1009   HO2A  C2E 501          HO2A      C2E 501 107.250   6.434  14.470
 1010    H1A  C2E 501           H1A      C2E 501 108.158   8.608  12.228
 1011    H81  C2E 501           H81      C2E 501 108.257   6.582   9.141
 1012   HN11  C2E 501          HN11      C2E 501 104.231  11.520   8.561
 1013   HN24  C2E 501          HN24      C2E 501 104.442  11.713  12.040
 1014   HN23  C2E 501          HN23      C2E 501 103.751  12.353  10.566
 1015   H5'1  C2E 502          H5'1      C2E 502 101.048  10.191   4.330
 1016   H5'2  C2E 502          H5'2      C2E 502  99.888  11.503   4.045
 1017    H4'  C2E 502           H4'      C2E 502  99.667  11.941   6.265
 1018    H3'  C2E 502           H3'      C2E 502 102.645  11.446   6.467
 1019    H2'  C2E 502           H2'      C2E 502 102.354  11.172   8.835
 1020   HO2'  C2E 502          HO2'      C2E 502  99.958  11.420   9.506
 1021    H1'  C2E 502           H1'      C2E 502 100.202   9.564   8.659
 1022    H8   C2E 502           H8       C2E 502 102.392   8.730   5.646
 1023    HN1  C2E 502           HN1      C2E 502 104.184   5.853  11.067
 1024   HN21  C2E 502          HN21      C2E 502 103.054   6.653  12.784
 1025   HN22  C2E 502          HN22      C2E 502 101.857   7.921  12.614
 1026   H511  C2E 502          H511      C2E 502 104.539  16.207   6.167
 1027   H512  C2E 502          H512      C2E 502 102.937  15.760   5.545
 1028    H4A  C2E 502           H4A      C2E 502 104.280  15.943   3.620
 1029    H3A  C2E 502           H3A      C2E 502 104.070  13.036   4.477
 1030    H2A  C2E 502           H2A      C2E 502 105.510  12.391   2.753
 1031   HO2A  C2E 502          HO2A      C2E 502 106.110  14.262   1.195
 1032    H1A  C2E 502           H1A      C2E 502 107.266  14.506   2.876
 1033    H81  C2E 502           H81      C2E 502 106.594  13.780   6.444
 1034   HN11  C2E 502          HN11      C2E 502 110.478   9.473   3.750
 1035   HN24  C2E 502          HN24      C2E 502 110.376   9.636   1.534
 1036   HN23  C2E 502          HN23      C2E 502 109.358  10.806   0.725
  Start of MODEL    2
    1    H    MET   1           H        MET   1 105.199  22.790  19.331
    2    HA   MET   1           HA       MET   1 104.479  22.904  16.755
    3    HB2  MET   1           HB2      MET   1 105.771  24.851  18.649
    4    HB3  MET   1           HB1      MET   1 105.378  25.360  17.008
    5    HG2  MET   1           HG2      MET   1 103.546  25.816  18.670
    6    HG3  MET   1           HG1      MET   1 103.045  24.798  17.322
    7    HE1  MET   1           HE1      MET   1 101.776  22.697  17.629
    8    HE2  MET   1           HE2      MET   1 101.003  24.013  18.509
    9    HE3  MET   1           HE3      MET   1 101.088  22.410  19.233
   10    H    SER   2           HN       SER   2 105.809  21.606  15.400
   11    HA   SER   2           HA       SER   2 107.947  23.031  14.133
   12    HB2  SER   2           HB2      SER   2 108.769  20.442  15.434
   13    HB3  SER   2           HB1      SER   2 109.792  21.659  14.678
   14    HG   SER   2           HG       SER   2 109.206  21.476  17.195
   15    H    ASP   3           HN       ASP   3 105.550  22.053  13.208
   16    HA   ASP   3           HA       ASP   3 106.318  19.662  11.675
   17    HB2  ASP   3           HB2      ASP   3 104.128  19.447  12.760
   18    HB3  ASP   3           HB1      ASP   3 103.583  20.944  12.002
   19    H    GLN   4           HN       GLN   4 107.361  20.101   9.945
   20    HA   GLN   4           HA       GLN   4 106.450  22.348   8.252
   21    HB2  GLN   4           HB2      GLN   4 109.248  21.173   8.414
   22    HB3  GLN   4           HB1      GLN   4 108.750  22.492   7.355
   23    HG2  GLN   4           HG2      GLN   4 109.786  23.492   9.286
   24    HG3  GLN   4           HG1      GLN   4 108.050  23.763   9.433
   25   HE21  GLN   4          HE21      GLN   4 109.406  20.552  10.026
   26   HE22  GLN   4          HE22      GLN   4 109.162  20.567  11.705
   27    H    HIS   5           HN       HIS   5 107.015  19.025   8.546
   28    HA   HIS   5           HA       HIS   5 105.791  17.544   7.037
   29    HB2  HIS   5           HB2      HIS   5 105.942  17.788   4.656
   30    HB3  HIS   5           HB1      HIS   5 105.437  19.337   5.317
   31    HD2  HIS   5           HD2      HIS   5 109.203  18.038   4.878
   32    HE1  HIS   5           HE1      HIS   5 108.738  21.706   2.853
   33    HE2  HIS   5           HE2      HIS   5 110.397  19.900   3.502
   34    H    ASP   6           HN       ASP   6 108.679  18.279   8.112
   35    HA   ASP   6           HA       ASP   6 110.707  17.149   6.756
   36    HB2  ASP   6           HB2      ASP   6 110.035  16.678   9.669
   37    HB3  ASP   6           HB1      ASP   6 111.596  16.305   8.937
   38    H    GLU   7           HN       GLU   7 111.673  15.004   6.706
   39    HA   GLU   7           HA       GLU   7 109.607  12.985   6.323
   40    HB2  GLU   7           HB2      GLU   7 111.354  11.726   5.101
   41    HB3  GLU   7           HB1      GLU   7 111.082  13.338   4.441
   42    HG2  GLU   7           HG2      GLU   7 113.240  12.799   6.488
   43    HG3  GLU   7           HG1      GLU   7 113.525  12.607   4.763
   44    H    ARG   8           HN       ARG   8 109.397  11.162   7.442
   45    HA   ARG   8           HA       ARG   8 111.360  10.626   9.596
   46    HB2  ARG   8           HB2      ARG   8 108.356  10.480   9.628
   47    HB3  ARG   8           HB1      ARG   8 109.338   9.564  10.759
   48    HG2  ARG   8           HG2      ARG   8 108.862  11.561  11.919
   49    HG3  ARG   8           HG1      ARG   8 110.497  11.795  11.311
   50    HD2  ARG   8           HD2      ARG   8 108.805  13.724  11.010
   51    HD3  ARG   8           HD1      ARG   8 109.794  13.274   9.633
   52    HE   ARG   8           HE       ARG   8 107.638  11.806   9.137
   53   HH11  ARG   8          HH21      ARG   8 107.913  15.043  10.333
   54   HH12  ARG   8          HH22      ARG   8 106.445  15.586   9.593
   55   HH21  ARG   8          HH11      ARG   8 105.718  12.519   8.157
   56   HH22  ARG   8          HH12      ARG   8 105.202  14.159   8.364
   57    H    ARG   9           HN       ARG   9 109.970   9.496   6.758
   58    HA   ARG   9           HA       ARG   9 110.431   6.667   7.505
   59    HB2  ARG   9           HB2      ARG   9 109.206   6.397   5.137
   60    HB3  ARG   9           HB1      ARG   9 108.307   6.552   6.639
   61    HG2  ARG   9           HG2      ARG   9 108.220   9.033   6.251
   62    HG3  ARG   9           HG1      ARG   9 108.939   8.746   4.669
   63    HD2  ARG   9           HD2      ARG   9 107.041   7.679   3.852
   64    HD3  ARG   9           HD1      ARG   9 106.480   7.222   5.457
   65    HE   ARG   9           HE       ARG   9 106.129   9.789   5.706
   66   HH11  ARG   9          HH21      ARG   9 105.736   7.909   2.816
   67   HH12  ARG   9          HH22      ARG   9 104.563   8.976   2.121
   68   HH21  ARG   9          HH11      ARG   9 104.592  11.188   4.788
   69   HH22  ARG   9          HH12      ARG   9 103.917  10.827   3.235
   70    H    ARG  10           HN       ARG  10 112.589   6.582   7.246
   71    HA   ARG  10           HA       ARG  10 114.651   7.068   6.154
   72    HB2  ARG  10           HB2      ARG  10 113.711   5.001   4.219
   73    HB3  ARG  10           HB1      ARG  10 115.186   5.071   5.173
   74    HG2  ARG  10           HG2      ARG  10 114.098   3.425   6.354
   75    HG3  ARG  10           HG1      ARG  10 113.430   4.822   7.193
   76    HD2  ARG  10           HD2      ARG  10 111.473   4.783   5.676
   77    HD3  ARG  10           HD1      ARG  10 112.142   3.377   4.857
   78    HE   ARG  10           HE       ARG  10 110.735   3.379   7.354
   79   HH11  ARG  10          HH21      ARG  10 113.295   1.893   5.557
   80   HH12  ARG  10          HH22      ARG  10 113.152   0.361   6.354
   81   HH21  ARG  10          HH11      ARG  10 110.541   1.369   8.399
   82   HH22  ARG  10          HH12      ARG  10 111.593   0.065   7.961
   83    H    PHE  11           HN       PHE  11 112.541   6.283   3.366
   84    HA   PHE  11           HA       PHE  11 113.062   8.904   2.213
   85    HB2  PHE  11           HB2      PHE  11 114.346   6.390   1.249
   86    HB3  PHE  11           HB1      PHE  11 113.747   7.512   0.028
   87    HD1  PHE  11           HD2      PHE  11 114.453   9.971   0.198
   88    HD2  PHE  11           HD1      PHE  11 116.384   6.816   2.380
   89    HE1  PHE  11           HE2      PHE  11 116.429  11.426   0.548
   90    HE2  PHE  11           HE1      PHE  11 118.362   8.275   2.733
   91    HZ   PHE  11           HZ       PHE  11 118.382  10.578   1.816
   92    H    HIS  12           HN       HIS  12 111.944   9.096   0.046
   93    HA   HIS  12           HA       HIS  12 109.244   8.732   0.228
   94    HB2  HIS  12           HB2      HIS  12 109.348   8.715  -2.381
   95    HB3  HIS  12           HB1      HIS  12 109.938  10.129  -1.510
   96    HD2  HIS  12           HD2      HIS  12 112.831  10.318  -1.382
   97    HE1  HIS  12           HE1      HIS  12 113.494   7.398  -4.352
   98    HE2  HIS  12           HE2      HIS  12 114.587   9.216  -2.964
   99    H    ARG  13           HN       ARG  13 107.839   7.100   0.060
  100    HA   ARG  13           HA       ARG  13 108.855   4.417  -0.497
  101    HB2  ARG  13           HB2      ARG  13 105.993   4.560   0.010
  102    HB3  ARG  13           HB1      ARG  13 107.245   3.739   0.939
  103    HG2  ARG  13           HG2      ARG  13 107.838   5.907   2.009
  104    HG3  ARG  13           HG1      ARG  13 106.527   6.680   1.120
  105    HD2  ARG  13           HD2      ARG  13 105.399   6.201   3.064
  106    HD3  ARG  13           HD1      ARG  13 105.113   4.688   2.211
  107    HE   ARG  13           HE       ARG  13 107.355   4.068   3.484
  108   HH11  ARG  13          HH21      ARG  13 104.588   5.847   4.600
  109   HH12  ARG  13          HH22      ARG  13 104.791   5.375   6.251
  110   HH21  ARG  13          HH11      ARG  13 107.606   3.450   5.645
  111   HH22  ARG  13          HH12      ARG  13 106.493   4.020   6.844
  112    H    ILE  14           HN       ILE  14 107.994   3.050  -2.092
  113    HA   ILE  14           HA       ILE  14 107.563   4.065  -4.621
  114    HB   ILE  14           HB       ILE  14 106.273   1.526  -3.616
  115   HG12  ILE  14          HG12      ILE  14 108.504   1.431  -2.754
  116   HG13  ILE  14          HG11      ILE  14 108.515   0.483  -4.239
  117   HG21  ILE  14          HG21      ILE  14 107.008   0.778  -5.937
  118   HG22  ILE  14          HG22      ILE  14 107.367   2.471  -6.272
  119   HG23  ILE  14          HG23      ILE  14 105.716   1.977  -5.894
  120   HD11  ILE  14          HD11      ILE  14 109.592   3.268  -3.794
  121   HD12  ILE  14          HD12      ILE  14 109.255   2.654  -5.412
  122   HD13  ILE  14          HD13      ILE  14 110.448   1.849  -4.394
  123    H    ALA  15           HN       ALA  15 106.097   5.875  -4.410
  124    HA   ALA  15           HA       ALA  15 103.337   5.228  -3.679
  125    HB1  ALA  15           HB1      ALA  15 104.165   7.278  -2.747
  126    HB2  ALA  15           HB2      ALA  15 102.978   7.693  -3.985
  127    HB3  ALA  15           HB3      ALA  15 104.702   7.843  -4.329
  128    H    PHE  16           HN       PHE  16 101.934   4.632  -5.087
  129    HA   PHE  16           HA       PHE  16 101.771   5.867  -7.713
  130    HB2  PHE  16           HB2      PHE  16 101.746   3.787  -8.943
  131    HB3  PHE  16           HB1      PHE  16 103.245   3.853  -8.018
  132    HD1  PHE  16           HD2      PHE  16 102.934   2.902  -5.484
  133    HD2  PHE  16           HD1      PHE  16 100.618   1.757  -8.917
  134    HE1  PHE  16           HE2      PHE  16 102.355   0.764  -4.384
  135    HE2  PHE  16           HE1      PHE  16 100.049  -0.389  -7.814
  136    HZ   PHE  16           HZ       PHE  16 100.926  -0.886  -5.548
  137    H    ASP  17           HN       ASP  17  99.610   5.471  -8.682
  138    HA   ASP  17           HA       ASP  17  97.664   5.044  -6.540
  139    HB2  ASP  17           HB2      ASP  17  97.338   6.142  -9.343
  140    HB3  ASP  17           HB1      ASP  17  96.049   6.024  -8.146
  141    H    ALA  18           HN       ALA  18  95.979   3.557  -6.677
  142    HA   ALA  18           HA       ALA  18  95.325   1.964  -8.872
  143    HB1  ALA  18           HB1      ALA  18  97.410   0.859  -8.841
  144    HB2  ALA  18           HB2      ALA  18  96.352  -0.223  -7.934
  145    HB3  ALA  18           HB3      ALA  18  97.471   0.839  -7.079
  146    H    ASP  19           HN       ASP  19  94.237  -0.173  -8.047
  147    HA   ASP  19           HA       ASP  19  92.490   0.673  -5.832
  148    HB2  ASP  19           HB2      ASP  19  91.939  -1.797  -7.411
  149    HB3  ASP  19           HB1      ASP  19  90.827  -0.572  -6.804
  150    H    SER  20           HN       SER  20  92.410  -0.361  -3.906
  151    HA   SER  20           HA       SER  20  93.783  -2.960  -3.666
  152    HB2  SER  20           HB2      SER  20  94.589  -2.112  -1.381
  153    HB3  SER  20           HB1      SER  20  95.431  -1.513  -2.808
  154    HG   SER  20           HG       SER  20  94.646   0.422  -2.455
  155    H    GLU  21           HN       GLU  21  93.043  -4.274  -1.989
  156    HA   GLU  21           HA       GLU  21  90.484  -3.467  -0.716
  157    HB2  GLU  21           HB2      GLU  21  91.091  -6.227  -1.821
  158    HB3  GLU  21           HB1      GLU  21  89.568  -5.665  -1.135
  159    HG2  GLU  21           HG2      GLU  21  90.759  -4.269  -3.525
  160    HG3  GLU  21           HG1      GLU  21  89.820  -5.745  -3.732
  161    H    ILE  22           HN       ILE  22  90.189  -4.219   1.379
  162    HA   ILE  22           HA       ILE  22  92.450  -5.765   2.508
  163    HB   ILE  22           HB       ILE  22  91.101  -3.310   3.635
  164   HG12  ILE  22          HG12      ILE  22  94.016  -3.985   3.129
  165   HG13  ILE  22          HG11      ILE  22  93.009  -3.053   2.022
  166   HG21  ILE  22          HG21      ILE  22  91.278  -4.813   5.489
  167   HG22  ILE  22          HG22      ILE  22  92.675  -3.744   5.603
  168   HG23  ILE  22          HG23      ILE  22  92.864  -5.377   4.970
  169   HD11  ILE  22          HD11      ILE  22  93.633  -2.315   4.892
  170   HD12  ILE  22          HD12      ILE  22  92.601  -1.390   3.802
  171   HD13  ILE  22          HD13      ILE  22  94.323  -1.557   3.459
  172    H    LEU  23           HN       LEU  23  91.987  -7.374   3.824
  173    HA   LEU  23           HA       LEU  23  89.150  -7.805   4.583
  174    HB2  LEU  23           HB2      LEU  23  90.978 -10.108   4.060
  175    HB3  LEU  23           HB1      LEU  23  89.230  -9.981   3.854
  176    HG   LEU  23           HG       LEU  23  89.984  -8.154   2.034
  177   HD11  LEU  23          HD11      LEU  23  91.980  -8.976   0.826
  178   HD12  LEU  23          HD12      LEU  23  92.255 -10.161   2.103
  179   HD13  LEU  23          HD13      LEU  23  92.386  -8.438   2.454
  180   HD21  LEU  23          HD21      LEU  23  88.570 -10.155   1.633
  181   HD22  LEU  23          HD22      LEU  23  90.023 -11.151   1.554
  182   HD23  LEU  23          HD23      LEU  23  89.734  -9.914   0.332
  183    H    GLN  24           HN       GLN  24  88.858  -7.936   6.653
  184    HA   GLN  24           HA       GLN  24  91.009  -9.068   8.366
  185    HB2  GLN  24           HB2      GLN  24  91.109  -6.737   8.840
  186    HB3  GLN  24           HB1      GLN  24  89.352  -6.590   8.863
  187    HG2  GLN  24           HG2      GLN  24  89.158  -7.723  10.922
  188    HG3  GLN  24           HG1      GLN  24  90.767  -8.429  10.789
  189   HE21  GLN  24          HE21      GLN  24  89.025  -5.918  12.257
  190   HE22  GLN  24          HE22      GLN  24  90.337  -4.932  12.689
  191    H    GLY  25           HN       GLY  25  90.107 -11.052   8.775
  192    HA2  GLY  25           HA2      GLY  25  88.753 -12.492   9.992
  193    HA3  GLY  25           HA1      GLY  25  87.734 -11.122  10.436
  194    H    GLU  26           HN       GLU  26  85.719 -11.434   9.708
  195    HA   GLU  26           HA       GLU  26  85.301 -12.819   7.137
  196    HB2  GLU  26           HB2      GLU  26  82.929 -12.942   7.934
  197    HB3  GLU  26           HB1      GLU  26  84.073 -13.760   8.997
  198    HG2  GLU  26           HG2      GLU  26  84.127 -11.824  10.488
  199    HG3  GLU  26           HG1      GLU  26  83.054 -10.936   9.408
  200    H    ARG  27           HN       ARG  27  85.953  -9.817   7.932
  201    HA   ARG  27           HA       ARG  27  83.763  -8.568   6.381
  202    HB2  ARG  27           HB2      ARG  27  85.535  -7.587   8.575
  203    HB3  ARG  27           HB1      ARG  27  84.710  -6.471   7.490
  204    HG2  ARG  27           HG2      ARG  27  82.614  -7.018   8.275
  205    HG3  ARG  27           HG1      ARG  27  83.075  -8.678   8.656
  206    HD2  ARG  27           HD2      ARG  27  84.167  -8.037  10.649
  207    HD3  ARG  27           HD1      ARG  27  84.188  -6.339  10.186
  208    HE   ARG  27           HE       ARG  27  81.520  -6.972  10.309
  209   HH11  ARG  27          HH21      ARG  27  84.244  -7.230  12.427
  210   HH12  ARG  27          HH22      ARG  27  83.312  -7.042  13.874
  211   HH21  ARG  27          HH11      ARG  27  80.289  -6.727  12.204
  212   HH22  ARG  27          HH12      ARG  27  81.073  -6.757  13.749
  213    H    ARG  28           HN       ARG  28  84.214  -7.550   4.517
  214    HA   ARG  28           HA       ARG  28  87.038  -6.934   3.847
  215    HB2  ARG  28           HB2      ARG  28  86.281  -8.945   2.609
  216    HB3  ARG  28           HB1      ARG  28  84.929  -8.018   1.957
  217    HG2  ARG  28           HG2      ARG  28  86.545  -6.419   0.939
  218    HG3  ARG  28           HG1      ARG  28  87.872  -7.414   1.536
  219    HD2  ARG  28           HD2      ARG  28  86.915  -9.340   0.238
  220    HD3  ARG  28           HD1      ARG  28  85.735  -8.228  -0.449
  221    HE   ARG  28           HE       ARG  28  88.552  -7.494  -0.762
  222   HH11  ARG  28          HH21      ARG  28  85.677  -8.917  -2.071
  223   HH12  ARG  28          HH22      ARG  28  86.180  -8.745  -3.720
  224   HH21  ARG  28          HH11      ARG  28  89.214  -7.266  -2.921
  225   HH22  ARG  28          HH12      ARG  28  88.182  -7.813  -4.201
  226    H    TRP  29           HN       TRP  29  87.391  -5.146   2.589
  227    HA   TRP  29           HA       TRP  29  85.135  -3.411   1.909
  228    HB2  TRP  29           HB2      TRP  29  87.466  -2.554   3.630
  229    HB3  TRP  29           HB1      TRP  29  86.162  -1.508   3.066
  230    HD1  TRP  29           HD1      TRP  29  83.614  -2.353   3.932
  231    HE1  TRP  29           HE1      TRP  29  82.977  -3.197   6.289
  232    HE3  TRP  29           HE3      TRP  29  88.214  -3.716   5.636
  233    HZ2  TRP  29           HZ2      TRP  29  84.270  -4.306   8.597
  234    HZ3  TRP  29           HZ3      TRP  29  88.500  -4.659   7.902
  235    HH2  TRP  29           HH2      TRP  29  86.533  -4.965   9.391
  236    H    GLU  30           HN       GLU  30  85.714  -1.715   0.457
  237    HA   GLU  30           HA       GLU  30  88.080  -2.369  -1.153
  238    HB2  GLU  30           HB2      GLU  30  85.911  -0.445  -1.971
  239    HB3  GLU  30           HB1      GLU  30  86.983  -1.407  -2.989
  240    HG2  GLU  30           HG2      GLU  30  85.810  -3.448  -1.810
  241    HG3  GLU  30           HG1      GLU  30  84.545  -2.275  -1.459
  242    H    VAL  31           HN       VAL  31  89.754  -0.886  -1.356
  243    HA   VAL  31           HA       VAL  31  89.331   1.881  -0.461
  244    HB   VAL  31           HB       VAL  31  91.383   1.771   0.946
  245   HG11  VAL  31          HG11      VAL  31  90.318   0.651   2.839
  246   HG12  VAL  31          HG12      VAL  31  89.220  -0.196   1.752
  247   HG13  VAL  31          HG13      VAL  31  89.107   1.556   1.929
  248   HG21  VAL  31          HG21      VAL  31  92.082  -0.561   1.653
  249   HG22  VAL  31          HG22      VAL  31  92.497  -0.142  -0.008
  250   HG23  VAL  31          HG23      VAL  31  91.110  -1.182   0.320
  251    H    LEU  32           HN       LEU  32  91.009   3.331  -1.130
  252    HA   LEU  32           HA       LEU  32  92.370   2.406  -3.566
  253    HB2  LEU  32           HB2      LEU  32  92.831   4.893  -3.845
  254    HB3  LEU  32           HB1      LEU  32  91.137   4.418  -3.944
  255    HG   LEU  32           HG       LEU  32  92.169   5.129  -1.234
  256   HD11  LEU  32          HD11      LEU  32  91.557   7.219  -3.344
  257   HD12  LEU  32          HD12      LEU  32  93.161   6.873  -2.699
  258   HD13  LEU  32          HD13      LEU  32  91.909   7.530  -1.644
  259   HD21  LEU  32          HD21      LEU  32  89.947   5.781  -0.867
  260   HD22  LEU  32          HD22      LEU  32  89.759   4.447  -2.006
  261   HD23  LEU  32          HD23      LEU  32  89.660   6.115  -2.574
  262    H    LEU  33           HN       LEU  33  94.534   2.110  -3.600
  263    HA   LEU  33           HA       LEU  33  95.967   2.575  -1.095
  264    HB2  LEU  33           HB2      LEU  33  96.365   0.413  -1.975
  265    HB3  LEU  33           HB1      LEU  33  96.608   1.023  -3.609
  266    HG   LEU  33           HG       LEU  33  98.475   2.148  -1.595
  267   HD11  LEU  33          HD11      LEU  33  98.425  -0.065  -0.674
  268   HD12  LEU  33          HD12      LEU  33  99.870   0.034  -1.674
  269   HD13  LEU  33          HD13      LEU  33  98.440  -0.799  -2.275
  270   HD21  LEU  33          HD21      LEU  33  99.097   0.693  -4.171
  271   HD22  LEU  33          HD22      LEU  33 100.019   1.976  -3.389
  272   HD23  LEU  33          HD23      LEU  33  98.488   2.346  -4.178
  273    H    HIS  34           HN       HIS  34  97.230   4.202  -0.761
  274    HA   HIS  34           HA       HIS  34  97.796   6.088  -2.923
  275    HB2  HIS  34           HB2      HIS  34  98.027   6.165   0.082
  276    HB3  HIS  34           HB1      HIS  34  98.640   7.470  -0.939
  277    HD2  HIS  34           HD2      HIS  34  95.181   5.899   0.118
  278    HE1  HIS  34           HE1      HIS  34  94.415   9.502  -1.943
  279    HE2  HIS  34           HE2      HIS  34  93.363   7.631  -0.591
  280    H    ASP  35           HN       ASP  35  99.592   3.818  -0.877
  281    HA   ASP  35           HA       ASP  35 101.713   3.838  -2.712
  282    HB2  ASP  35           HB2      ASP  35 103.494   4.978  -1.497
  283    HB3  ASP  35           HB1      ASP  35 102.130   6.088  -1.660
  284    H    VAL  36           HN       VAL  36 103.598   2.552  -2.010
  285    HA   VAL  36           HA       VAL  36 103.146   0.860   0.332
  286    HB   VAL  36           HB       VAL  36 102.045  -0.138  -1.782
  287   HG11  VAL  36          HG11      VAL  36 103.414  -1.046  -3.458
  288   HG12  VAL  36          HG12      VAL  36 104.857  -0.978  -2.447
  289   HG13  VAL  36          HG13      VAL  36 104.189   0.504  -3.126
  290   HG21  VAL  36          HG21      VAL  36 102.549  -2.340  -1.071
  291   HG22  VAL  36          HG22      VAL  36 102.788  -1.361   0.372
  292   HG23  VAL  36          HG23      VAL  36 104.178  -1.896  -0.569
  293    H    SER  37           HN       SER  37 104.969  -0.706   0.616
  294    HA   SER  37           HA       SER  37 107.527   0.169  -0.482
  295    HB2  SER  37           HB2      SER  37 107.138   1.416   1.692
  296    HB3  SER  37           HB1      SER  37 107.067  -0.148   2.500
  297    HG   SER  37           HG       SER  37 109.223   1.097   1.169
  298    H    LEU  38           HN       LEU  38 109.230  -1.545   0.194
  299    HA   LEU  38           HA       LEU  38 108.178  -4.079  -0.452
  300    HB2  LEU  38           HB2      LEU  38 110.826  -3.641   0.947
  301    HB3  LEU  38           HB1      LEU  38 110.387  -4.948  -0.151
  302    HG   LEU  38           HG       LEU  38 109.900  -2.725  -1.710
  303   HD11  LEU  38          HD11      LEU  38 112.524  -2.156  -0.330
  304   HD12  LEU  38          HD12      LEU  38 111.023  -1.411   0.217
  305   HD13  LEU  38          HD13      LEU  38 111.608  -1.116  -1.421
  306   HD21  LEU  38          HD21      LEU  38 111.082  -4.702  -2.480
  307   HD22  LEU  38          HD22      LEU  38 112.441  -4.356  -1.412
  308   HD23  LEU  38          HD23      LEU  38 112.105  -3.298  -2.781
  309    H    HIS  39           HN       HIS  39 107.678  -2.444   2.323
  310    HA   HIS  39           HA       HIS  39 106.761  -4.771   3.700
  311    HB2  HIS  39           HB2      HIS  39 108.282  -4.274   5.745
  312    HB3  HIS  39           HB1      HIS  39 108.954  -5.194   4.398
  313    HD2  HIS  39           HD2      HIS  39 108.658  -1.387   3.740
  314    HE1  HIS  39           HE1      HIS  39 112.706  -2.175   4.642
  315    HE2  HIS  39           HE2      HIS  39 111.083  -0.421   3.783
  316    H    GLY  40           HN       GLY  40 105.458  -2.465   2.904
  317    HA2  GLY  40           HA2      GLY  40 104.148  -1.651   5.271
  318    HA3  GLY  40           HA1      GLY  40 105.268  -0.388   4.771
  319    H    ILE  41           HN       ILE  41 102.297  -0.348   4.817
  320    HA   ILE  41           HA       ILE  41 101.906   0.566   2.052
  321    HB   ILE  41           HB       ILE  41 100.870  -1.368   1.520
  322   HG12  ILE  41          HG12      ILE  41  98.736  -0.422   3.461
  323   HG13  ILE  41          HG11      ILE  41  98.966   0.247   1.847
  324   HG21  ILE  41          HG21      ILE  41 100.508  -1.861   4.484
  325   HG22  ILE  41          HG22      ILE  41 101.767  -2.542   3.453
  326   HG23  ILE  41          HG23      ILE  41 100.082  -3.004   3.213
  327   HD11  ILE  41          HD11      ILE  41  97.671  -1.400   1.031
  328   HD12  ILE  41          HD12      ILE  41  97.564  -2.146   2.623
  329   HD13  ILE  41          HD13      ILE  41  98.887  -2.573   1.538
  330    H    LEU  42           HN       LEU  42 100.329   2.066   1.756
  331    HA   LEU  42           HA       LEU  42  99.058   3.187   4.191
  332    HB2  LEU  42           HB2      LEU  42 100.999   4.458   2.738
  333    HB3  LEU  42           HB1      LEU  42  99.555   5.000   1.890
  334    HG   LEU  42           HG       LEU  42  99.831   5.166   4.901
  335   HD11  LEU  42          HD11      LEU  42 100.451   7.514   4.593
  336   HD12  LEU  42          HD12      LEU  42 100.377   7.328   2.843
  337   HD13  LEU  42          HD13      LEU  42 101.621   6.485   3.765
  338   HD21  LEU  42          HD21      LEU  42  97.552   5.344   4.238
  339   HD22  LEU  42          HD22      LEU  42  97.956   6.324   2.829
  340   HD23  LEU  42          HD23      LEU  42  98.099   7.005   4.450
  341    H    VAL  43           HN       VAL  43  96.858   3.666   3.968
  342    HA   VAL  43           HA       VAL  43  95.685   3.448   1.279
  343    HB   VAL  43           HB       VAL  43  94.010   1.840   2.014
  344   HG11  VAL  43          HG11      VAL  43  96.726   0.794   2.836
  345   HG12  VAL  43          HG12      VAL  43  96.318   1.133   1.154
  346   HG13  VAL  43          HG13      VAL  43  95.414  -0.087   2.051
  347   HG21  VAL  43          HG21      VAL  43  95.521   1.998   4.640
  348   HG22  VAL  43          HG22      VAL  43  94.351   0.735   4.261
  349   HG23  VAL  43          HG23      VAL  43  93.830   2.416   4.360
  350    H    GLY  44           HN       GLY  44  93.227   3.746   1.456
  351    HA2  GLY  44           HA2      GLY  44  92.743   6.187   3.071
  352    HA3  GLY  44           HA1      GLY  44  91.823   5.700   1.643
  353    H    GLN  45           HN       GLN  45  90.956   6.260   4.569
  354    HA   GLN  45           HA       GLN  45  90.125   3.665   5.478
  355    HB2  GLN  45           HB2      GLN  45  89.303   4.784   7.412
  356    HB3  GLN  45           HB1      GLN  45  90.829   5.547   6.982
  357    HG2  GLN  45           HG2      GLN  45  89.545   7.432   7.291
  358    HG3  GLN  45           HG1      GLN  45  89.229   7.156   5.582
  359   HE21  GLN  45          HE21      GLN  45  87.905   5.493   8.498
  360   HE22  GLN  45          HE22      GLN  45  86.282   5.819   8.124
  361    HA   PRO  46           HA       PRO  46  86.198   4.301   3.358
  362    HB2  PRO  46           HB2      PRO  46  85.290   1.749   3.375
  363    HB3  PRO  46           HB1      PRO  46  86.659   2.225   2.346
  364    HG2  PRO  46           HG2      PRO  46  86.667   0.802   4.966
  365    HG3  PRO  46           HG1      PRO  46  87.680   0.534   3.537
  366    HD2  PRO  46           HD2      PRO  46  88.458   2.011   5.797
  367    HD3  PRO  46           HD1      PRO  46  89.222   2.106   4.198
  368    H    GLN  47           HN       GLN  47  83.886   4.161   3.982
  369    HA   GLN  47           HA       GLN  47  83.449   4.764   6.711
  370    HB2  GLN  47           HB2      GLN  47  81.651   4.272   4.357
  371    HB3  GLN  47           HB1      GLN  47  80.975   4.501   5.971
  372    HG2  GLN  47           HG2      GLN  47  81.928   6.677   6.173
  373    HG3  GLN  47           HG1      GLN  47  82.977   6.427   4.779
  374   HE21  GLN  47          HE21      GLN  47  81.734   8.610   4.234
  375   HE22  GLN  47          HE22      GLN  47  80.308   8.425   3.333
  376    H    ASP  48           HN       ASP  48  82.822   1.802   4.842
  377    HA   ASP  48           HA       ASP  48  81.453   0.468   6.977
  378    HB2  ASP  48           HB2      ASP  48  82.562  -0.355   4.317
  379    HB3  ASP  48           HB1      ASP  48  82.044  -1.589   5.464
  380    H    TRP  49           HN       TRP  49  84.500   1.433   7.043
  381    HA   TRP  49           HA       TRP  49  86.085  -0.822   7.552
  382    HB2  TRP  49           HB2      TRP  49  86.889   1.525   7.271
  383    HB3  TRP  49           HB1      TRP  49  86.321   1.864   8.902
  384    HD1  TRP  49           HD1      TRP  49  87.632   0.853  10.892
  385    HE1  TRP  49           HE1      TRP  49  90.021  -0.202  11.092
  386    HE3  TRP  49           HE3      TRP  49  88.486  -0.098   6.012
  387    HZ2  TRP  49           HZ2      TRP  49  92.043  -1.326   9.247
  388    HZ3  TRP  49           HZ3      TRP  49  90.581  -1.156   5.238
  389    HH2  TRP  49           HH2      TRP  49  92.333  -1.778   6.864
  390    H    ASN  50           HN       ASN  50  84.272  -2.050   8.747
  391    HA   ASN  50           HA       ASN  50  84.171  -1.322  11.589
  392    HB2  ASN  50           HB2      ASN  50  82.087  -2.068  10.308
  393    HB3  ASN  50           HB1      ASN  50  82.792  -3.684  10.292
  394   HD21  ASN  50          HD21      ASN  50  83.842  -4.016  12.801
  395   HD22  ASN  50          HD22      ASN  50  82.649  -3.821  13.993
  396    H    GLY  51           HN       GLY  51  86.453  -1.748  11.899
  397    HA2  GLY  51           HA2      GLY  51  86.933  -4.589  12.508
  398    HA3  GLY  51           HA1      GLY  51  88.098  -3.738  11.502
  399    H    ASP  52           HN       ASP  52  88.714  -4.935  13.951
  400    HA   ASP  52           HA       ASP  52  88.969  -2.775  15.914
  401    HB2  ASP  52           HB2      ASP  52  89.384  -5.741  15.938
  402    HB3  ASP  52           HB1      ASP  52  90.132  -4.744  17.185
  403    HA   PRO  53           HA       PRO  53  92.953  -1.712  13.997
  404    HB2  PRO  53           HB2      PRO  53  93.181  -0.338  16.649
  405    HB3  PRO  53           HB1      PRO  53  93.513   0.290  15.026
  406    HG2  PRO  53           HG2      PRO  53  91.296   0.952  16.334
  407    HG3  PRO  53           HG1      PRO  53  91.296   0.698  14.580
  408    HD2  PRO  53           HD2      PRO  53  90.193  -1.045  16.732
  409    HD3  PRO  53           HD1      PRO  53  89.665  -0.857  15.044
  410    H    GLN  54           HN       GLN  54  92.360  -3.186  17.097
  411    HA   GLN  54           HA       GLN  54  95.118  -3.733  17.652
  412    HB2  GLN  54           HB2      GLN  54  92.590  -4.862  18.871
  413    HB3  GLN  54           HB1      GLN  54  94.218  -5.123  19.496
  414    HG2  GLN  54           HG2      GLN  54  93.505  -2.285  19.009
  415    HG3  GLN  54           HG1      GLN  54  92.594  -3.073  20.294
  416   HE21  GLN  54          HE21      GLN  54  94.297  -4.631  21.649
  417   HE22  GLN  54          HE22      GLN  54  95.672  -3.787  22.176
  418    H    ARG  55           HN       ARG  55  92.608  -5.336  15.858
  419    HA   ARG  55           HA       ARG  55  94.122  -7.851  15.840
  420    HB2  ARG  55           HB2      ARG  55  91.377  -7.066  14.851
  421    HB3  ARG  55           HB1      ARG  55  92.122  -8.592  14.380
  422    HG2  ARG  55           HG2      ARG  55  92.479  -9.008  16.892
  423    HG3  ARG  55           HG1      ARG  55  91.368  -7.664  17.156
  424    HD2  ARG  55           HD2      ARG  55  90.209  -9.867  17.165
  425    HD3  ARG  55           HD1      ARG  55  89.624  -8.803  15.890
  426    HE   ARG  55           HE       ARG  55  90.380 -10.367  14.363
  427   HH11  ARG  55          HH21      ARG  55  92.048 -10.709  17.376
  428   HH12  ARG  55          HH22      ARG  55  92.941 -12.108  16.881
  429   HH21  ARG  55          HH11      ARG  55  91.551 -12.201  13.705
  430   HH22  ARG  55          HH12      ARG  55  92.660 -12.952  14.804
  431    HA   PRO  56           HA       PRO  56  96.193  -7.022  12.100
  432    HB2  PRO  56           HB2      PRO  56  96.254  -9.537  10.957
  433    HB3  PRO  56           HB1      PRO  56  97.316  -9.012  12.277
  434    HG2  PRO  56           HG2      PRO  56  94.816 -10.630  12.390
  435    HG3  PRO  56           HG1      PRO  56  96.324 -10.814  13.304
  436    HD2  PRO  56           HD2      PRO  56  94.113  -9.679  14.396
  437    HD3  PRO  56           HD1      PRO  56  95.755  -9.163  14.840
  438    H    PHE  57           HN       PHE  57  96.059  -6.996   9.801
  439    HA   PHE  57           HA       PHE  57  93.350  -7.407   8.676
  440    HB2  PHE  57           HB2      PHE  57  95.191  -5.048   8.178
  441    HB3  PHE  57           HB1      PHE  57  93.635  -5.324   7.402
  442    HD1  PHE  57           HD2      PHE  57  95.215  -4.896  10.772
  443    HD2  PHE  57           HD1      PHE  57  91.662  -4.513   8.394
  444    HE1  PHE  57           HE2      PHE  57  94.078  -3.734  12.649
  445    HE2  PHE  57           HE1      PHE  57  90.527  -3.356  10.265
  446    HZ   PHE  57           HZ       PHE  57  91.733  -2.968  12.394
  447    H    GLU  58           HN       GLU  58  93.439  -7.731   6.276
  448    HA   GLU  58           HA       GLU  58  96.130  -8.540   5.363
  449    HB2  GLU  58           HB2      GLU  58  93.513  -9.833   4.527
  450    HB3  GLU  58           HB1      GLU  58  95.137 -10.350   4.067
  451    HG2  GLU  58           HG2      GLU  58  95.634 -10.689   6.517
  452    HG3  GLU  58           HG1      GLU  58  93.931 -10.380   6.846
  453    H    ALA  59           HN       ALA  59  96.766  -7.670   3.356
  454    HA   ALA  59           HA       ALA  59  94.745  -5.974   1.994
  455    HB1  ALA  59           HB1      ALA  59  96.197  -4.318   2.378
  456    HB2  ALA  59           HB2      ALA  59  97.341  -5.138   1.317
  457    HB3  ALA  59           HB3      ALA  59  97.377  -5.440   3.052
  458    H    ARG  60           HN       ARG  60  94.486  -6.165  -0.117
  459    HA   ARG  60           HA       ARG  60  96.306  -7.951  -1.629
  460    HB2  ARG  60           HB2      ARG  60  93.295  -7.761  -1.674
  461    HB3  ARG  60           HB1      ARG  60  94.211  -8.439  -3.021
  462    HG2  ARG  60           HG2      ARG  60  95.359  -9.924  -1.230
  463    HG3  ARG  60           HG1      ARG  60  94.021  -9.451  -0.183
  464    HD2  ARG  60           HD2      ARG  60  93.650 -10.642  -2.935
  465    HD3  ARG  60           HD1      ARG  60  93.653 -11.600  -1.458
  466    HE   ARG  60           HE       ARG  60  91.777  -9.782  -0.873
  467   HH11  ARG  60          HH21      ARG  60  92.386 -11.620  -3.745
  468   HH12  ARG  60          HH22      ARG  60  90.724 -11.665  -4.231
  469   HH21  ARG  60          HH11      ARG  60  89.600  -9.841  -1.508
  470   HH22  ARG  60          HH12      ARG  60  89.148 -10.659  -2.967
  471    H    LEU  61           HN       LEU  61  97.214  -6.923  -3.369
  472    HA   LEU  61           HA       LEU  61  96.033  -4.324  -4.141
  473    HB2  LEU  61           HB2      LEU  61  98.793  -5.252  -4.887
  474    HB3  LEU  61           HB1      LEU  61  98.178  -3.607  -4.748
  475    HG   LEU  61           HG       LEU  61  98.586  -5.539  -2.444
  476   HD11  LEU  61          HD11      LEU  61 100.089  -3.053  -3.314
  477   HD12  LEU  61          HD12      LEU  61 100.707  -4.704  -3.305
  478   HD13  LEU  61          HD13      LEU  61 100.344  -3.889  -1.783
  479   HD21  LEU  61          HD21      LEU  61  97.380  -2.792  -2.686
  480   HD22  LEU  61          HD22      LEU  61  98.215  -3.246  -1.200
  481   HD23  LEU  61          HD23      LEU  61  96.818  -4.172  -1.744
  482    H    TYR  62           HN       TYR  62  95.571  -3.835  -6.239
  483    HA   TYR  62           HA       TYR  62  95.896  -6.010  -8.213
  484    HB2  TYR  62           HB2      TYR  62  93.523  -4.136  -8.128
  485    HB3  TYR  62           HB1      TYR  62  93.712  -5.597  -9.092
  486    HD1  TYR  62           HD1      TYR  62  93.537  -4.386  -5.557
  487    HD2  TYR  62           HD2      TYR  62  93.001  -7.682  -8.260
  488    HE1  TYR  62           HE1      TYR  62  92.526  -5.726  -3.727
  489    HE2  TYR  62           HE2      TYR  62  91.993  -9.019  -6.432
  490    HH   TYR  62           HH       TYR  62  92.347  -8.565  -3.413
  491    H    LEU  63           HN       LEU  63  97.403  -5.320  -9.544
  492    HA   LEU  63           HA       LEU  63  97.422  -2.496 -10.416
  493    HB2  LEU  63           HB2      LEU  63  99.484  -3.759  -9.395
  494    HB3  LEU  63           HB1      LEU  63  99.624  -4.455 -11.006
  495    HG   LEU  63           HG       LEU  63  99.575  -1.499 -10.337
  496   HD11  LEU  63          HD11      LEU  63 101.743  -3.407 -11.244
  497   HD12  LEU  63          HD12      LEU  63 101.704  -2.447  -9.766
  498   HD13  LEU  63          HD13      LEU  63 101.909  -1.653 -11.328
  499   HD21  LEU  63          HD21      LEU  63  99.583  -3.029 -12.943
  500   HD22  LEU  63          HD22      LEU  63 100.241  -1.395 -12.841
  501   HD23  LEU  63          HD23      LEU  63  98.545  -1.686 -12.461
  502    H    GLY  64           HN       GLY  64  98.759  -5.291 -12.106
  503    HA2  GLY  64           HA2      GLY  64  97.529  -4.502 -14.586
  504    HA3  GLY  64           HA1      GLY  64  98.509  -5.945 -14.316
  505    H    LEU  65           HN       LEU  65  96.422  -6.497 -15.850
  506    HA   LEU  65           HA       LEU  65  94.042  -7.029 -14.351
  507    HB2  LEU  65           HB2      LEU  65  94.970  -7.825 -17.110
  508    HB3  LEU  65           HB1      LEU  65  93.449  -8.410 -16.437
  509    HG   LEU  65           HG       LEU  65  92.694  -6.091 -16.096
  510   HD11  LEU  65          HD11      LEU  65  94.632  -4.818 -15.717
  511   HD12  LEU  65          HD12      LEU  65  94.170  -4.331 -17.347
  512   HD13  LEU  65          HD13      LEU  65  95.469  -5.500 -17.112
  513   HD21  LEU  65          HD21      LEU  65  92.441  -7.364 -18.323
  514   HD22  LEU  65          HD22      LEU  65  93.739  -6.331 -18.922
  515   HD23  LEU  65          HD23      LEU  65  92.222  -5.614 -18.377
  516    H    ASP  66           HN       ASP  66  96.951  -8.832 -15.194
  517    HA   ASP  66           HA       ASP  66  95.929 -11.332 -14.009
  518    HB2  ASP  66           HB2      ASP  66  98.551 -10.899 -15.386
  519    HB3  ASP  66           HB1      ASP  66  97.595 -12.373 -15.234
  520    H    VAL  67           HN       VAL  67  97.209  -8.596 -12.836
  521    HA   VAL  67           HA       VAL  67  99.286  -9.926 -11.204
  522    HB   VAL  67           HB       VAL  67  98.838  -7.051 -11.974
  523   HG11  VAL  67          HG11      VAL  67 100.935  -6.754 -10.394
  524   HG12  VAL  67          HG12      VAL  67 100.274  -8.172  -9.581
  525   HG13  VAL  67          HG13      VAL  67  99.311  -6.701  -9.710
  526   HG21  VAL  67          HG21      VAL  67 101.383  -8.684 -11.965
  527   HG22  VAL  67          HG22      VAL  67 101.017  -7.230 -12.896
  528   HG23  VAL  67          HG23      VAL  67 100.242  -8.758 -13.311
  529    H    LEU  68           HN       LEU  68  98.142 -10.876  -9.621
  530    HA   LEU  68           HA       LEU  68  96.544  -9.128  -7.851
  531    HB2  LEU  68           HB2      LEU  68  95.033 -10.788  -8.449
  532    HB3  LEU  68           HB1      LEU  68  96.292 -11.998  -8.676
  533    HG   LEU  68           HG       LEU  68  96.599 -12.141  -6.227
  534   HD11  LEU  68          HD11      LEU  68  95.988  -9.907  -5.538
  535   HD12  LEU  68          HD12      LEU  68  94.835 -11.015  -4.805
  536   HD13  LEU  68          HD13      LEU  68  94.376 -10.082  -6.227
  537   HD21  LEU  68          HD21      LEU  68  94.255 -13.031  -5.711
  538   HD22  LEU  68          HD22      LEU  68  95.051 -13.717  -7.128
  539   HD23  LEU  68          HD23      LEU  68  93.804 -12.485  -7.327
  540    H    ILE  69           HN       ILE  69  97.658  -8.558  -6.094
  541    HA   ILE  69           HA       ILE  69  99.760 -10.391  -5.108
  542    HB   ILE  69           HB       ILE  69  99.555  -7.429  -4.557
  543   HG12  ILE  69          HG12      ILE  69  99.634  -7.775  -6.998
  544   HG13  ILE  69          HG11      ILE  69 101.165  -7.116  -6.417
  545   HG21  ILE  69          HG21      ILE  69 101.034  -9.086  -3.202
  546   HG22  ILE  69          HG22      ILE  69 101.768  -7.596  -3.799
  547   HG23  ILE  69          HG23      ILE  69 102.047  -9.116  -4.645
  548   HD11  ILE  69          HD11      ILE  69 100.549  -9.972  -7.192
  549   HD12  ILE  69          HD12      ILE  69 101.997  -9.525  -6.297
  550   HD13  ILE  69          HD13      ILE  69 101.730  -8.888  -7.916
  551    H    ARG  70           HN       ARG  70  99.901 -10.892  -2.960
  552    HA   ARG  70           HA       ARG  70  97.726  -9.922  -1.209
  553    HB2  ARG  70           HB2      ARG  70  98.776 -12.762  -1.193
  554    HB3  ARG  70           HB1      ARG  70  97.376 -12.127  -0.329
  555    HG2  ARG  70           HG2      ARG  70  96.197 -11.744  -2.420
  556    HG3  ARG  70           HG1      ARG  70  97.620 -12.217  -3.349
  557    HD2  ARG  70           HD2      ARG  70  96.183 -14.132  -3.302
  558    HD3  ARG  70           HD1      ARG  70  97.499 -14.466  -2.180
  559    HE   ARG  70           HE       ARG  70  95.112 -13.271  -1.006
  560   HH11  ARG  70          HH21      ARG  70  96.917 -16.124  -1.779
  561   HH12  ARG  70          HH22      ARG  70  96.134 -17.105  -0.586
  562   HH21  ARG  70          HH11      ARG  70  94.086 -14.552   0.555
  563   HH22  ARG  70          HH12      ARG  70  94.531 -16.216   0.734
  564    H    MET  71           HN       MET  71  98.337  -9.195   0.673
  565    HA   MET  71           HA       MET  71 100.916 -10.005   1.835
  566    HB2  MET  71           HB2      MET  71 100.344  -7.108   2.010
  567    HB3  MET  71           HB1      MET  71 101.873  -7.948   1.759
  568    HG2  MET  71           HG2      MET  71 100.849  -8.473  -0.623
  569    HG3  MET  71           HG1      MET  71  99.832  -7.080  -0.271
  570    HE1  MET  71           HE1      MET  71 102.582  -4.420   0.652
  571    HE2  MET  71           HE2      MET  71 102.470  -5.780   1.763
  572    HE3  MET  71           HE3      MET  71 101.000  -5.088   1.083
  573    H    GLU  72           HN       GLU  72 100.959  -9.796   4.096
  574    HA   GLU  72           HA       GLU  72  98.316  -9.357   5.317
  575    HB2  GLU  72           HB2      GLU  72  99.493 -11.557   5.718
  576    HB3  GLU  72           HB1      GLU  72 100.738 -10.662   6.593
  577    HG2  GLU  72           HG2      GLU  72  98.817  -9.699   8.003
  578    HG3  GLU  72           HG1      GLU  72  97.816 -10.964   7.295
  579    H    ILE  73           HN       ILE  73  98.039  -7.530   6.598
  580    HA   ILE  73           HA       ILE  73 100.500  -6.165   7.511
  581    HB   ILE  73           HB       ILE  73  99.378  -4.015   6.861
  582   HG12  ILE  73          HG12      ILE  73  97.564  -5.895   5.317
  583   HG13  ILE  73          HG11      ILE  73  97.083  -5.007   6.761
  584   HG21  ILE  73          HG21      ILE  73 100.662  -5.986   5.160
  585   HG22  ILE  73          HG22      ILE  73 100.823  -4.234   5.134
  586   HG23  ILE  73          HG23      ILE  73  99.534  -5.014   4.220
  587   HD11  ILE  73          HD11      ILE  73  96.429  -3.899   4.590
  588   HD12  ILE  73          HD12      ILE  73  98.146  -3.669   4.261
  589   HD13  ILE  73          HD13      ILE  73  97.404  -2.894   5.653
  590    H    SER  74           HN       SER  74 100.218  -4.658   9.208
  591    HA   SER  74           HA       SER  74  97.745  -4.991  10.814
  592    HB2  SER  74           HB2      SER  74  99.440  -4.480  12.766
  593    HB3  SER  74           HB1      SER  74  99.291  -6.117  12.136
  594    HG   SER  74           HG       SER  74 101.344  -4.268  11.889
  595    H    LEU  75           HN       LEU  75  97.166  -3.115  12.110
  596    HA   LEU  75           HA       LEU  75  97.635  -0.658  10.700
  597    HB2  LEU  75           HB2      LEU  75  95.546  -1.435  12.156
  598    HB3  LEU  75           HB1      LEU  75  96.450  -0.656  13.454
  599    HG   LEU  75           HG       LEU  75  96.675   1.354  11.892
  600   HD11  LEU  75          HD11      LEU  75  96.089   0.683   9.753
  601   HD12  LEU  75          HD12      LEU  75  94.539   1.325  10.300
  602   HD13  LEU  75          HD13      LEU  75  94.834  -0.412  10.336
  603   HD21  LEU  75          HD21      LEU  75  95.145   1.290  13.821
  604   HD22  LEU  75          HD22      LEU  75  93.909   0.536  12.811
  605   HD23  LEU  75          HD23      LEU  75  94.435   2.187  12.479
  606    H    ALA  76           HN       ALA  76  99.047   0.797  10.913
  607    HA   ALA  76           HA       ALA  76 100.990   0.645  13.115
  608    HB1  ALA  76           HB1      ALA  76 102.402   2.090  11.635
  609    HB2  ALA  76           HB2      ALA  76 101.166   1.917  10.386
  610    HB3  ALA  76           HB3      ALA  76 102.040   0.502  10.966
  611    H    TRP  77           HN       TRP  77  98.956   2.889  11.350
  612    HA   TRP  77           HA       TRP  77  98.437   4.537  13.663
  613    HB2  TRP  77           HB2      TRP  77  99.504   6.594  12.825
  614    HB3  TRP  77           HB1      TRP  77 100.721   5.331  13.043
  615    HD1  TRP  77           HD1      TRP  77 101.863   4.327  10.897
  616    HE1  TRP  77           HE1      TRP  77 101.721   4.845   8.389
  617    HE3  TRP  77           HE3      TRP  77  98.062   7.741  10.900
  618    HZ2  TRP  77           HZ2      TRP  77 100.389   6.630   6.660
  619    HZ3  TRP  77           HZ3      TRP  77  97.388   8.851   8.788
  620    HH2  TRP  77           HH2      TRP  77  98.533   8.292   6.659
  621    H    ALA  78           HN       ALA  78  97.191   6.590  12.941
  622    HA   ALA  78           HA       ALA  78  95.871   6.376  10.328
  623    HB1  ALA  78           HB1      ALA  78  94.389   6.122  12.948
  624    HB2  ALA  78           HB2      ALA  78  94.480   4.922  11.657
  625    HB3  ALA  78           HB3      ALA  78  93.620   6.440  11.393
  626    H    ARG  79           HN       ARG  79  95.758   8.449   9.561
  627    HA   ARG  79           HA       ARG  79  94.935  10.566  11.368
  628    HB2  ARG  79           HB2      ARG  79  97.494  10.294  11.498
  629    HB3  ARG  79           HB1      ARG  79  97.519  10.957   9.865
  630    HG2  ARG  79           HG2      ARG  79  96.472  13.001  10.601
  631    HG3  ARG  79           HG1      ARG  79  96.169  12.329  12.206
  632    HD2  ARG  79           HD2      ARG  79  98.575  12.180  12.624
  633    HD3  ARG  79           HD1      ARG  79  98.913  12.774  11.000
  634    HE   ARG  79           HE       ARG  79  97.262  14.643  12.317
  635   HH11  ARG  79          HH21      ARG  79 100.452  13.303  12.436
  636   HH12  ARG  79          HH22      ARG  79 101.176  14.734  13.092
  637   HH21  ARG  79          HH11      ARG  79  98.203  16.517  13.177
  638   HH22  ARG  79          HH12      ARG  79  99.902  16.553  13.513
  639    H    ASP  80           HN       ASP  80  93.748  12.102  10.407
  640    HA   ASP  80           HA       ASP  80  92.640  13.269   8.786
  641    HB2  ASP  80           HB2      ASP  80  94.988  14.074   8.492
  642    HB3  ASP  80           HB1      ASP  80  95.166  12.899   7.188
  643    H    GLY  81           HN       GLY  81  91.796  10.615   8.660
  644    HA2  GLY  81           HA2      GLY  81  90.424   9.499   7.184
  645    HA3  GLY  81           HA1      GLY  81  91.006  10.531   5.891
  646    H    LEU  82           HN       LEU  82  93.881   9.791   6.531
  647    HA   LEU  82           HA       LEU  82  93.852   7.349   4.938
  648    HB2  LEU  82           HB2      LEU  82  96.358   8.712   5.869
  649    HB3  LEU  82           HB1      LEU  82  96.038   7.862   4.356
  650    HG   LEU  82           HG       LEU  82  94.871  10.542   5.159
  651   HD11  LEU  82          HD11      LEU  82  97.172  10.824   4.540
  652   HD12  LEU  82          HD12      LEU  82  96.214  11.283   3.132
  653   HD13  LEU  82          HD13      LEU  82  97.007   9.709   3.183
  654   HD21  LEU  82          HD21      LEU  82  94.522   8.793   2.707
  655   HD22  LEU  82          HD22      LEU  82  94.060  10.495   2.757
  656   HD23  LEU  82          HD23      LEU  82  93.265   9.334   3.820
  657    H    LEU  83           HN       LEU  83  95.305   5.552   5.497
  658    HA   LEU  83           HA       LEU  83  95.613   5.166   8.438
  659    HB2  LEU  83           HB2      LEU  83  94.622   3.127   6.458
  660    HB3  LEU  83           HB1      LEU  83  94.797   2.920   8.198
  661    HG   LEU  83           HG       LEU  83  93.011   5.015   6.936
  662   HD11  LEU  83          HD11      LEU  83  91.169   3.410   7.679
  663   HD12  LEU  83          HD12      LEU  83  92.430   2.192   7.867
  664   HD13  LEU  83          HD13      LEU  83  92.110   2.891   6.279
  665   HD21  LEU  83          HD21      LEU  83  93.461   3.973   9.740
  666   HD22  LEU  83          HD22      LEU  83  91.959   4.783   9.296
  667   HD23  LEU  83          HD23      LEU  83  93.493   5.643   9.176
  668    H    GLY  84           HN       GLY  84  97.633   4.295   8.980
  669    HA2  GLY  84           HA2      GLY  84  99.391   3.515   6.784
  670    HA3  GLY  84           HA1      GLY  84  99.859   3.832   8.449
  671    H    PHE  85           HN       PHE  85 100.510   1.536   6.806
  672    HA   PHE  85           HA       PHE  85  99.571  -0.534   8.657
  673    HB2  PHE  85           HB2      PHE  85  99.123  -0.452   5.694
  674    HB3  PHE  85           HB1      PHE  85  99.353  -1.999   6.497
  675    HD1  PHE  85           HD2      PHE  85  97.839  -2.639   8.405
  676    HD2  PHE  85           HD1      PHE  85  97.086   0.752   5.884
  677    HE1  PHE  85           HE2      PHE  85  95.482  -2.598   9.168
  678    HE2  PHE  85           HE1      PHE  85  94.725   0.789   6.645
  679    HZ   PHE  85           HZ       PHE  85  93.931  -0.879   8.285
  680    H    GLU  86           HN       GLU  86 101.196  -1.927   9.207
  681    HA   GLU  86           HA       GLU  86 103.710  -1.669   7.699
  682    HB2  GLU  86           HB2      GLU  86 104.827  -2.348   9.682
  683    HB3  GLU  86           HB1      GLU  86 103.585  -1.222  10.227
  684    HG2  GLU  86           HG2      GLU  86 102.089  -3.269  10.582
  685    HG3  GLU  86           HG1      GLU  86 103.546  -4.241  10.377
  686    H    CYS  87           HN       CYS  87 104.364  -3.363   6.478
  687    HA   CYS  87           HA       CYS  87 102.680  -5.614   6.124
  688    HB2  CYS  87           HB2      CYS  87 104.441  -4.474   4.525
  689    HB3  CYS  87           HB1      CYS  87 105.536  -5.655   5.245
  690    HG   CYS  87           HG       CYS  87 104.445  -6.883   3.252
  691    H    GLN  88           HN       GLN  88 102.496  -7.344   7.344
  692    HA   GLN  88           HA       GLN  88 104.563  -8.021   9.290
  693    HB2  GLN  88           HB2      GLN  88 101.841  -8.079   9.419
  694    HB3  GLN  88           HB1      GLN  88 102.174  -9.757   8.999
  695    HG2  GLN  88           HG2      GLN  88 102.190  -9.652  11.387
  696    HG3  GLN  88           HG1      GLN  88 103.876  -9.769  10.889
  697   HE21  GLN  88          HE21      GLN  88 102.695  -6.683  10.106
  698   HE22  GLN  88          HE22      GLN  88 103.259  -5.854  11.476
  699    H    HIS  89           HN       HIS  89 103.069  -9.305   6.364
  700    HA   HIS  89           HA       HIS  89 105.360 -10.897   5.758
  701    HB2  HIS  89           HB2      HIS  89 104.749 -12.984   6.401
  702    HB3  HIS  89           HB1      HIS  89 103.652 -12.161   7.505
  703    HD2  HIS  89           HD2      HIS  89 101.055 -12.988   7.141
  704    HE1  HIS  89           HE1      HIS  89 101.358 -14.238   3.121
  705    HE2  HIS  89           HE2      HIS  89  99.801 -14.061   5.120
  706    H    ILE  90           HN       ILE  90 105.325 -11.641   3.628
  707    HA   ILE  90           HA       ILE  90 102.918 -11.219   1.980
  708    HB   ILE  90           HB       ILE  90 104.015  -9.041   1.939
  709   HG12  ILE  90          HG12      ILE  90 104.633 -10.605  -0.589
  710   HG13  ILE  90          HG11      ILE  90 103.046  -9.970  -0.166
  711   HG21  ILE  90          HG21      ILE  90 106.461 -10.700   1.325
  712   HG22  ILE  90          HG22      ILE  90 106.239  -9.520   2.612
  713   HG23  ILE  90          HG23      ILE  90 106.382  -8.985   0.939
  714   HD11  ILE  90          HD11      ILE  90 104.399  -7.702   0.115
  715   HD12  ILE  90          HD12      ILE  90 103.840  -8.233  -1.472
  716   HD13  ILE  90          HD13      ILE  90 105.515  -8.499  -0.994
  717    H    ASP  91           HN       ASP  91 102.743 -12.437   0.264
  718    HA   ASP  91           HA       ASP  91 104.048 -14.893   0.197
  719    HB2  ASP  91           HB2      ASP  91 103.075 -14.195  -2.440
  720    HB3  ASP  91           HB1      ASP  91 102.446 -15.373  -1.294
  721    H    LEU  92           HN       LEU  92 105.660 -15.783  -0.919
  722    HA   LEU  92           HA       LEU  92 107.926 -14.290  -1.596
  723    HB2  LEU  92           HB2      LEU  92 107.774 -16.804  -1.151
  724    HB3  LEU  92           HB1      LEU  92 107.292 -16.964  -2.841
  725    HG   LEU  92           HG       LEU  92 109.447 -15.432  -3.228
  726   HD11  LEU  92          HD11      LEU  92 110.134 -16.978  -0.712
  727   HD12  LEU  92          HD12      LEU  92 109.878 -15.235  -0.776
  728   HD13  LEU  92          HD13      LEU  92 111.227 -15.960  -1.649
  729   HD21  LEU  92          HD21      LEU  92 109.273 -17.567  -4.283
  730   HD22  LEU  92          HD22      LEU  92 109.346 -18.418  -2.740
  731   HD23  LEU  92          HD23      LEU  92 110.784 -17.617  -3.374
  732    H    ASP  93           HN       ASP  93 105.354 -15.551  -3.690
  733    HA   ASP  93           HA       ASP  93 106.497 -14.630  -6.128
  734    HB2  ASP  93           HB2      ASP  93 103.689 -15.417  -5.342
  735    HB3  ASP  93           HB1      ASP  93 104.107 -14.897  -6.974
  736    H    SER  94           HN       SER  94 104.108 -13.286  -3.876
  737    HA   SER  94           HA       SER  94 103.444 -10.981  -5.348
  738    HB2  SER  94           HB2      SER  94 103.072 -10.071  -2.884
  739    HB3  SER  94           HB1      SER  94 102.009 -11.300  -3.561
  740    HG   SER  94           HG       SER  94 102.875 -11.782  -1.444
  741    H    ILE  95           HN       ILE  95 106.087 -11.710  -3.150
  742    HA   ILE  95           HA       ILE  95 107.112  -9.114  -2.813
  743    HB   ILE  95           HB       ILE  95 108.368 -11.857  -2.727
  744   HG12  ILE  95          HG12      ILE  95 107.932  -9.746  -0.596
  745   HG13  ILE  95          HG11      ILE  95 106.813 -11.069  -0.915
  746   HG21  ILE  95          HG21      ILE  95 110.343 -10.596  -1.664
  747   HG22  ILE  95          HG22      ILE  95 109.680  -9.150  -2.426
  748   HG23  ILE  95          HG23      ILE  95 110.203 -10.511  -3.418
  749   HD11  ILE  95          HD11      ILE  95 109.153 -12.451  -0.674
  750   HD12  ILE  95          HD12      ILE  95 108.054 -12.154   0.669
  751   HD13  ILE  95          HD13      ILE  95 109.452 -11.108   0.429
  752    H    SER  96           HN       SER  96 107.623 -11.543  -5.346
  753    HA   SER  96           HA       SER  96 109.671 -10.052  -6.616
  754    HB2  SER  96           HB2      SER  96 108.647 -12.624  -6.892
  755    HB3  SER  96           HB1      SER  96 108.141 -11.838  -8.387
  756    HG   SER  96           HG       SER  96 110.607 -11.079  -7.998
  757    H    HIS  97           HN       HIS  97 106.172 -10.181  -7.029
  758    HA   HIS  97           HA       HIS  97 106.180  -8.622  -9.408
  759    HB2  HIS  97           HB2      HIS  97 104.070  -9.234  -7.336
  760    HB3  HIS  97           HB1      HIS  97 103.764  -8.119  -8.658
  761    HD2  HIS  97           HD2      HIS  97 103.363 -11.793  -8.065
  762    HE1  HIS  97           HE1      HIS  97 104.007 -11.453 -12.222
  763    HE2  HIS  97           HE2      HIS  97 103.247 -13.015 -10.369
  764    H    LEU  98           HN       LEU  98 105.841  -7.786  -5.963
  765    HA   LEU  98           HA       LEU  98 105.587  -4.975  -6.384
  766    HB2  LEU  98           HB2      LEU  98 105.285  -6.449  -4.184
  767    HB3  LEU  98           HB1      LEU  98 106.993  -6.074  -3.966
  768    HG   LEU  98           HG       LEU  98 105.159  -3.800  -4.642
  769   HD11  LEU  98          HD11      LEU  98 105.279  -5.173  -1.946
  770   HD12  LEU  98          HD12      LEU  98 103.849  -4.910  -2.944
  771   HD13  LEU  98          HD13      LEU  98 104.664  -3.540  -2.189
  772   HD21  LEU  98          HD21      LEU  98 107.439  -4.078  -2.660
  773   HD22  LEU  98          HD22      LEU  98 106.705  -2.577  -3.219
  774   HD23  LEU  98          HD23      LEU  98 107.646  -3.564  -4.333
  775    H    ARG  99           HN       ARG  99 108.368  -7.124  -6.274
  776    HA   ARG  99           HA       ARG  99 110.367  -5.155  -6.065
  777    HB2  ARG  99           HB2      ARG  99 110.222  -7.932  -7.100
  778    HB3  ARG  99           HB1      ARG  99 111.547  -6.955  -7.725
  779    HG2  ARG  99           HG2      ARG  99 112.486  -6.635  -5.597
  780    HG3  ARG  99           HG1      ARG  99 110.976  -7.012  -4.767
  781    HD2  ARG  99           HD2      ARG  99 111.233  -9.311  -5.058
  782    HD3  ARG  99           HD1      ARG  99 112.303  -9.124  -6.443
  783    HE   ARG  99           HE       ARG  99 113.058  -8.945  -3.618
  784   HH11  ARG  99          HH21      ARG  99 113.882  -8.574  -6.963
  785   HH12  ARG  99          HH22      ARG  99 115.590  -8.607  -6.685
  786   HH21  ARG  99          HH11      ARG  99 115.297  -8.984  -3.253
  787   HH22  ARG  99          HH12      ARG  99 116.391  -8.839  -4.587
  788    H    ARG 100           HN       ARG 100 108.449  -6.280  -8.803
  789    HA   ARG 100           HA       ARG 100 109.774  -5.017 -10.937
  790    HB2  ARG 100           HB2      ARG 100 106.855  -5.592 -10.467
  791    HB3  ARG 100           HB1      ARG 100 107.468  -4.904 -11.963
  792    HG2  ARG 100           HG2      ARG 100 108.806  -7.369 -10.902
  793    HG3  ARG 100           HG1      ARG 100 107.225  -7.546 -11.662
  794    HD2  ARG 100           HD2      ARG 100 108.820  -7.827 -13.414
  795    HD3  ARG 100           HD1      ARG 100 108.157  -6.211 -13.626
  796    HE   ARG 100           HE       ARG 100 110.676  -6.547 -12.126
  797   HH11  ARG 100          HH21      ARG 100 108.926  -5.427 -14.902
  798   HH12  ARG 100          HH22      ARG 100 110.207  -4.407 -15.464
  799   HH21  ARG 100          HH11      ARG 100 112.350  -5.214 -12.861
  800   HH22  ARG 100          HH12      ARG 100 112.145  -4.288 -14.311
  801    H    LEU 101           HN       LEU 101 107.300  -3.840  -8.698
  802    HA   LEU 101           HA       LEU 101 106.994  -1.279  -9.866
  803    HB2  LEU 101           HB2      LEU 101 106.401  -2.361  -7.112
  804    HB3  LEU 101           HB1      LEU 101 106.110  -0.673  -7.519
  805    HG   LEU 101           HG       LEU 101 104.076  -2.039  -7.826
  806   HD11  LEU 101          HD11      LEU 101 103.438  -0.930  -9.727
  807   HD12  LEU 101          HD12      LEU 101 104.854  -1.448 -10.640
  808   HD13  LEU 101          HD13      LEU 101 104.983  -0.115  -9.491
  809   HD21  LEU 101          HD21      LEU 101 105.555  -4.091  -8.499
  810   HD22  LEU 101          HD22      LEU 101 105.427  -3.434 -10.129
  811   HD23  LEU 101          HD23      LEU 101 103.972  -3.901  -9.247
  812    H    VAL 102           HN       VAL 102 109.168  -2.466  -7.325
  813    HA   VAL 102           HA       VAL 102 110.166   0.111  -6.647
  814    HB   VAL 102           HB       VAL 102 110.395  -2.376  -5.530
  815   HG11  VAL 102          HG11      VAL 102 113.151  -1.688  -6.592
  816   HG12  VAL 102          HG12      VAL 102 112.151  -3.005  -7.198
  817   HG13  VAL 102          HG13      VAL 102 112.730  -3.036  -5.539
  818   HG21  VAL 102          HG21      VAL 102 112.201  -1.207  -4.074
  819   HG22  VAL 102          HG22      VAL 102 110.604  -0.467  -4.167
  820   HG23  VAL 102          HG23      VAL 102 111.933   0.186  -5.123
  821    H    GLU 103           HN       GLU 103 111.375  -2.447  -8.800
  822    HA   GLU 103           HA       GLU 103 113.718  -1.071  -9.601
  823    HB2  GLU 103           HB2      GLU 103 112.142  -3.242 -11.000
  824    HB3  GLU 103           HB1      GLU 103 113.744  -2.690 -11.489
  825    HG2  GLU 103           HG2      GLU 103 114.392  -3.184  -9.000
  826    HG3  GLU 103           HG1      GLU 103 112.937  -4.177  -9.002
  827    H    LEU 104           HN       LEU 104 110.475  -1.269 -11.064
  828    HA   LEU 104           HA       LEU 104 111.159   0.226 -13.373
  829    HB2  LEU 104           HB2      LEU 104 108.562  -0.543 -12.070
  830    HB3  LEU 104           HB1      LEU 104 108.569   0.576 -13.432
  831    HG   LEU 104           HG       LEU 104 110.125  -1.983 -13.668
  832   HD11  LEU 104          HD11      LEU 104 107.119  -1.707 -13.962
  833   HD12  LEU 104          HD12      LEU 104 107.977  -2.767 -12.844
  834   HD13  LEU 104          HD13      LEU 104 108.054  -3.069 -14.579
  835   HD21  LEU 104          HD21      LEU 104 108.408  -0.520 -15.688
  836   HD22  LEU 104          HD22      LEU 104 109.698  -1.680 -16.004
  837   HD23  LEU 104          HD23      LEU 104 110.087  -0.076 -15.384
  838    H    ASN 105           HN       ASN 105 109.766   1.198 -10.250
  839    HA   ASN 105           HA       ASN 105 109.365   3.917 -11.083
  840    HB2  ASN 105           HB2      ASN 105 108.395   4.239  -9.045
  841    HB3  ASN 105           HB1      ASN 105 108.348   2.481  -9.048
  842   HD21  ASN 105          HD21      ASN 105 110.572   1.492  -8.148
  843   HD22  ASN 105          HD22      ASN 105 111.161   2.244  -6.745
  844    H    LEU 106           HN       LEU 106 112.016   2.113  -9.742
  845    HA   LEU 106           HA       LEU 106 113.512   4.314  -8.732
  846    HB2  LEU 106           HB2      LEU 106 113.965   1.448  -9.255
  847    HB3  LEU 106           HB1      LEU 106 115.409   2.442  -9.433
  848    HG   LEU 106           HG       LEU 106 113.630   2.775  -7.020
  849   HD11  LEU 106          HD11      LEU 106 114.089   0.423  -6.975
  850   HD12  LEU 106          HD12      LEU 106 115.248   1.172  -5.878
  851   HD13  LEU 106          HD13      LEU 106 115.756   0.671  -7.490
  852   HD21  LEU 106          HD21      LEU 106 116.634   3.031  -7.308
  853   HD22  LEU 106          HD22      LEU 106 115.608   3.691  -6.035
  854   HD23  LEU 106          HD23      LEU 106 115.539   4.367  -7.662
  855    H    GLY 107           HN       GLY 107 113.442   2.642 -11.856
  856    HA2  GLY 107           HA2      GLY 107 113.787   4.605 -13.617
  857    HA3  GLY 107           HA1      GLY 107 115.424   4.472 -12.980
  858    H    ASP 108           HN       ASP 108 116.550   2.443 -13.221
  859    HA   ASP 108           HA       ASP 108 115.501   0.285 -14.759
  860    HB2  ASP 108           HB2      ASP 108 115.738   2.073 -16.521
  861    HB3  ASP 108           HB1      ASP 108 117.476   2.045 -16.222
  862    H    GLU 109           HN       GLU 109 116.605  -1.429 -14.077
  863    HA   GLU 109           HA       GLU 109 118.316  -2.766 -13.323
  864    HB2  GLU 109           HB2      GLU 109 119.470  -1.533 -15.333
  865    HB3  GLU 109           HB1      GLU 109 120.333  -0.665 -14.062
  866    HG2  GLU 109           HG2      GLU 109 121.691  -2.558 -14.585
  867    HG3  GLU 109           HG1      GLU 109 120.888  -2.952 -13.067
  868    H    GLU 110           HN       GLU 110 117.330  -0.015 -12.010
  869    HA   GLU 110           HA       GLU 110 117.544   1.002  -9.969
  870    HB2  GLU 110           HB2      GLU 110 117.161  -1.208  -9.073
  871    HB3  GLU 110           HB1      GLU 110 118.850  -1.647  -9.321
  872    HG2  GLU 110           HG2      GLU 110 119.602  -0.153  -7.637
  873    HG3  GLU 110           HG1      GLU 110 118.062   0.702  -7.595
  874    H    LEU 111           HN       LEU 111 120.567  -0.873  -9.956
  875    HA   LEU 111           HA       LEU 111 122.765  -0.207  -9.859
  876    HB2  LEU 111           HB2      LEU 111 121.715   1.356 -11.813
  877    HB3  LEU 111           HB1      LEU 111 122.190   2.599 -10.657
  878    HG   LEU 111           HG       LEU 111 124.451   1.266 -10.553
  879   HD11  LEU 111          HD11      LEU 111 124.999  -0.055 -12.435
  880   HD12  LEU 111          HD12      LEU 111 123.620   0.537 -13.363
  881   HD13  LEU 111          HD13      LEU 111 123.366  -0.578 -12.021
  882   HD21  LEU 111          HD21      LEU 111 123.544   2.991 -12.873
  883   HD22  LEU 111          HD22      LEU 111 125.229   2.539 -12.618
  884   HD23  LEU 111          HD23      LEU 111 124.385   3.510 -11.413
  885    H    LEU 112           HN       LEU 112 123.532  -0.030  -7.855
  886    HA   LEU 112           HA       LEU 112 123.974   0.777  -5.753
  887    HB2  LEU 112           HB2      LEU 112 123.373   3.310  -7.268
  888    HB3  LEU 112           HB1      LEU 112 123.673   3.358  -5.533
  889    HG   LEU 112           HG       LEU 112 125.818   2.064  -5.985
  890   HD11  LEU 112          HD11      LEU 112 125.081   2.834  -8.826
  891   HD12  LEU 112          HD12      LEU 112 125.283   1.197  -8.201
  892   HD13  LEU 112          HD13      LEU 112 126.676   2.270  -8.331
  893   HD21  LEU 112          HD21      LEU 112 125.368   4.837  -7.111
  894   HD22  LEU 112          HD22      LEU 112 126.972   4.130  -6.923
  895   HD23  LEU 112          HD23      LEU 112 125.960   4.410  -5.506
  896    H    GLU 113           HN       GLU 113 122.820   0.572  -3.941
  897    HA   GLU 113           HA       GLU 113 120.133   0.152  -3.790
  898    HB2  GLU 113           HB2      GLU 113 121.659   1.556  -1.594
  899    HB3  GLU 113           HB1      GLU 113 120.279   0.470  -1.427
  900    HG2  GLU 113           HG2      GLU 113 121.717  -1.328  -2.514
  901    HG3  GLU 113           HG1      GLU 113 123.086  -0.235  -2.312
  902    H    ARG 114           HN       ARG 114 121.736   3.276  -3.155
  903    HA   ARG 114           HA       ARG 114 120.957   5.431  -3.282
  904    HB2  ARG 114           HB2      ARG 114 120.067   4.316  -5.539
  905    HB3  ARG 114           HB1      ARG 114 118.505   4.593  -4.771
  906    HG2  ARG 114           HG2      ARG 114 119.557   7.003  -4.307
  907    HG3  ARG 114           HG1      ARG 114 120.540   6.583  -5.709
  908    HD2  ARG 114           HD2      ARG 114 117.511   6.550  -5.604
  909    HD3  ARG 114           HD1      ARG 114 118.493   7.782  -6.388
  910    HE   ARG 114           HE       ARG 114 118.088   5.023  -7.316
  911   HH11  ARG 114          HH21      ARG 114 119.601   8.123  -7.666
  912   HH12  ARG 114          HH22      ARG 114 120.056   7.864  -9.315
  913   HH21  ARG 114          HH11      ARG 114 118.688   4.683  -9.475
  914   HH22  ARG 114          HH12      ARG 114 119.542   5.920 -10.338
  915    H    GLU 115           HN       GLU 115 118.929   6.799  -2.763
  916    HA   GLU 115           HA       GLU 115 117.380   7.405  -1.178
  917    HB2  GLU 115           HB2      GLU 115 116.551   4.516  -1.531
  918    HB3  GLU 115           HB1      GLU 115 115.592   5.754  -0.720
  919    HG2  GLU 115           HG2      GLU 115 115.098   6.861  -2.690
  920    HG3  GLU 115           HG1      GLU 115 116.585   6.345  -3.480
  921    H    LEU 116           HN       LEU 116 117.313   4.141   0.022
  922    HA   LEU 116           HA       LEU 116 117.747   4.807   2.694
  923    HB2  LEU 116           HB2      LEU 116 118.393   2.172   1.345
  924    HB3  LEU 116           HB1      LEU 116 118.109   2.420   3.067
  925    HG   LEU 116           HG       LEU 116 115.990   3.341   1.160
  926   HD11  LEU 116          HD11      LEU 116 116.432   1.152   0.256
  927   HD12  LEU 116          HD12      LEU 116 114.997   1.015   1.272
  928   HD13  LEU 116          HD13      LEU 116 116.557   0.450   1.870
  929   HD21  LEU 116          HD21      LEU 116 116.087   3.500   3.781
  930   HD22  LEU 116          HD22      LEU 116 115.628   1.798   3.720
  931   HD23  LEU 116          HD23      LEU 116 114.579   3.021   3.002
  932    H    ALA 117           HN       ALA 117 120.114   4.018   0.199
  933    HA   ALA 117           HA       ALA 117 122.259   3.746   2.045
  934    HB1  ALA 117           HB1      ALA 117 123.627   4.359  -0.168
  935    HB2  ALA 117           HB2      ALA 117 122.064   4.054  -0.926
  936    HB3  ALA 117           HB3      ALA 117 122.848   2.787   0.018
  937    H    LEU 118           HN       LEU 118 120.874   6.390   0.251
  938    HA   LEU 118           HA       LEU 118 122.790   8.361   0.513
  939    HB2  LEU 118           HB2      LEU 118 119.860   8.968   0.914
  940    HB3  LEU 118           HB1      LEU 118 121.089   9.977   0.156
  941    HG   LEU 118           HG       LEU 118 120.091   7.331  -0.929
  942   HD11  LEU 118          HD11      LEU 118 119.689  10.075  -2.127
  943   HD12  LEU 118          HD12      LEU 118 118.526   9.383  -0.998
  944   HD13  LEU 118          HD13      LEU 118 118.853   8.576  -2.531
  945   HD21  LEU 118          HD21      LEU 118 121.370   8.203  -2.982
  946   HD22  LEU 118          HD22      LEU 118 122.347   7.614  -1.637
  947   HD23  LEU 118          HD23      LEU 118 122.130   9.349  -1.877
  948    H    LEU 119           HN       LEU 119 120.175   7.675   2.911
  949    HA   LEU 119           HA       LEU 119 121.080   9.627   4.749
  950    HB2  LEU 119           HB2      LEU 119 119.178   7.352   4.778
  951    HB3  LEU 119           HB1      LEU 119 119.798   7.856   6.350
  952    HG   LEU 119           HG       LEU 119 118.775   9.905   4.388
  953   HD11  LEU 119          HD11      LEU 119 117.009   8.156   4.704
  954   HD12  LEU 119          HD12      LEU 119 116.552   9.729   5.357
  955   HD13  LEU 119          HD13      LEU 119 117.088   8.446   6.442
  956   HD21  LEU 119          HD21      LEU 119 118.822  11.332   6.194
  957   HD22  LEU 119          HD22      LEU 119 120.062  10.205   6.742
  958   HD23  LEU 119          HD23      LEU 119 118.412  10.063   7.348
  959    H    VAL 120           HN       VAL 120 121.563   6.143   4.590
  960    HA   VAL 120           HA       VAL 120 123.085   5.805   6.895
  961    HB   VAL 120           HB       VAL 120 123.264   4.299   4.278
  962   HG11  VAL 120          HG11      VAL 120 125.310   3.859   5.457
  963   HG12  VAL 120          HG12      VAL 120 124.245   2.490   5.774
  964   HG13  VAL 120          HG13      VAL 120 124.466   3.738   7.001
  965   HG21  VAL 120          HG21      VAL 120 121.865   2.665   5.491
  966   HG22  VAL 120          HG22      VAL 120 121.071   4.239   5.422
  967   HG23  VAL 120          HG23      VAL 120 121.864   3.714   6.908
  968    H    SER 121           HN       SER 121 124.401   6.498   3.586
  969    HA   SER 121           HA       SER 121 127.089   6.564   4.550
  970    HB2  SER 121           HB2      SER 121 125.827   7.711   2.052
  971    HB3  SER 121           HB1      SER 121 127.560   7.698   2.366
  972    HG   SER 121           HG       SER 121 127.051   5.311   2.796
  973    H    ALA 122           HN       ALA 122 124.645   9.018   3.939
  974    HA   ALA 122           HA       ALA 122 126.076  10.831   5.738
  975    HB1  ALA 122           HB1      ALA 122 125.705  12.725   4.065
  976    HB2  ALA 122           HB2      ALA 122 125.402  11.466   2.869
  977    HB3  ALA 122           HB3      ALA 122 126.968  11.559   3.672
  978    H    HIS 123           HN       HIS 123 124.553  12.701   6.470
  979    HA   HIS 123           HA       HIS 123 121.895  11.793   6.847
  980    HB2  HIS 123           HB2      HIS 123 121.487  14.031   7.749
  981    HB3  HIS 123           HB1      HIS 123 123.003  13.386   8.370
  982    HD2  HIS 123           HD2      HIS 123 125.124  14.262   6.106
  983    HE1  HIS 123           HE1      HIS 123 123.435  18.122   6.345
  984    HE2  HIS 123           HE2      HIS 123 125.450  16.792   5.560
  985    H    ASP 124           HN       ASP 124 122.910  14.733   5.084
  986    HA   ASP 124           HA       ASP 124 122.164  15.666   3.130
  987    HB2  ASP 124           HB2      ASP 124 120.775  13.102   2.417
  988    HB3  ASP 124           HB1      ASP 124 121.587  14.259   1.363
  989    H    ASP 125           HN       ASP 125 120.689  16.476   5.168
  990    HA   ASP 125           HA       ASP 125 118.026  15.831   5.420
  991    HB2  ASP 125           HB2      ASP 125 117.704  18.301   5.933
  992    HB3  ASP 125           HB1      ASP 125 118.936  17.470   6.879
  993   H5'1  C2E 501          H5'1      C2E 501 104.534   1.315  11.610
  994   H5'2  C2E 501          H5'2      C2E 501 106.104   1.388  12.431
  995    H4'  C2E 501           H4'      C2E 501 106.833   0.092  10.718
  996    H3'  C2E 501           H3'      C2E 501 106.670   2.817   9.455
  997    H2'  C2E 501           H2'      C2E 501 107.043   1.930   7.300
  998   HO2'  C2E 501          HO2'      C2E 501 107.836  -0.110   6.952
  999    H1'  C2E 501           H1'      C2E 501 105.314  -0.130   7.471
 1000    H8   C2E 501           H8       C2E 501 103.683   2.399   9.679
 1001    HN1  C2E 501           HN1      C2E 501 103.144   3.933   3.489
 1002   HN21  C2E 501          HN21      C2E 501 104.497   2.667   2.269
 1003   HN22  C2E 501          HN22      C2E 501 105.532   1.446   2.974
 1004   H511  C2E 501          H511      C2E 501 107.541   4.980   9.567
 1005   H512  C2E 501          H512      C2E 501 109.108   5.813   9.561
 1006    H4A  C2E 501           H4A      C2E 501 108.449   5.756  12.263
 1007    H3A  C2E 501           H3A      C2E 501 105.846   5.954  10.744
 1008    H2A  C2E 501           H2A      C2E 501 105.207   7.831  11.946
 1009   HO2A  C2E 501          HO2A      C2E 501 107.100   8.347  13.686
 1010    H1A  C2E 501           H1A      C2E 501 107.511   9.210  11.880
 1011    H81  C2E 501           H81      C2E 501 107.658   7.243   8.688
 1012   HN11  C2E 501          HN11      C2E 501 103.688  12.238   8.256
 1013   HN24  C2E 501          HN24      C2E 501 104.005  12.414  11.725
 1014   HN23  C2E 501          HN23      C2E 501 103.285  13.073  10.273
 1015   H5'1  C2E 502          H5'1      C2E 502 100.534  10.551   4.193
 1016   H5'2  C2E 502          H5'2      C2E 502  99.223  11.699   3.858
 1017    H4'  C2E 502           H4'      C2E 502  99.072  12.367   6.043
 1018    H3'  C2E 502           H3'      C2E 502 102.050  11.913   6.200
 1019    H2'  C2E 502           H2'      C2E 502 101.821  11.737   8.597
 1020   HO2'  C2E 502          HO2'      C2E 502  99.355  12.001   9.209
 1021    H1'  C2E 502           H1'      C2E 502  99.655  10.128   8.552
 1022    H8   C2E 502           H8       C2E 502 101.804   9.160   5.558
 1023    HN1  C2E 502           HN1      C2E 502 103.610   6.444  11.056
 1024   HN21  C2E 502          HN21      C2E 502 102.512   7.340  12.754
 1025   HN22  C2E 502          HN22      C2E 502 101.334   8.618  12.545
 1026   H511  C2E 502          H511      C2E 502 103.294  16.959   5.585
 1027   H512  C2E 502          H512      C2E 502 101.838  16.068   5.095
 1028    H4A  C2E 502           H4A      C2E 502 103.244  16.462   3.153
 1029    H3A  C2E 502           H3A      C2E 502 103.108  13.594   4.111
 1030    H2A  C2E 502           H2A      C2E 502 104.607  12.932   2.427
 1031   HO2A  C2E 502          HO2A      C2E 502 103.610  15.213   1.155
 1032    H1A  C2E 502           H1A      C2E 502 106.286  15.116   2.492
 1033    H81  C2E 502           H81      C2E 502 105.700  14.443   6.079
 1034   HN11  C2E 502          HN11      C2E 502 109.687  10.269   3.309
 1035   HN24  C2E 502          HN24      C2E 502 109.521  10.413   1.098
 1036   HN23  C2E 502          HN23      C2E 502 108.436  11.536   0.310
  Start of MODEL    3
    1    H    MET   1           H        MET   1 113.586  24.477   8.778
    2    HA   MET   1           HA       MET   1 113.812  21.635   9.459
    3    HB2  MET   1           HB2      MET   1 111.269  23.270   9.714
    4    HB3  MET   1           HB1      MET   1 111.409  21.521   9.904
    5    HG2  MET   1           HG2      MET   1 113.127  22.020  11.744
    6    HG3  MET   1           HG1      MET   1 112.550  23.684  11.677
    7    HE1  MET   1           HE1      MET   1 112.613  22.521  14.157
    8    HE2  MET   1           HE2      MET   1 111.045  22.292  14.928
    9    HE3  MET   1           HE3      MET   1 111.440  23.844  14.191
   10    H    SER   2           HN       SER   2 111.186  23.450   8.005
   11    HA   SER   2           HA       SER   2 111.291  23.985   5.547
   12    HB2  SER   2           HB2      SER   2 112.132  21.079   5.506
   13    HB3  SER   2           HB1      SER   2 111.549  21.939   4.087
   14    HG   SER   2           HG       SER   2 113.237  23.516   4.583
   15    H    ASP   3           HN       ASP   3 109.463  23.568   4.196
   16    HA   ASP   3           HA       ASP   3 107.191  22.514   5.689
   17    HB2  ASP   3           HB2      ASP   3 105.925  23.328   3.625
   18    HB3  ASP   3           HB1      ASP   3 106.736  24.565   4.584
   19    H    GLN   4           HN       GLN   4 109.298  20.738   4.680
   20    HA   GLN   4           HA       GLN   4 107.712  19.083   2.808
   21    HB2  GLN   4           HB2      GLN   4 109.876  19.775   1.875
   22    HB3  GLN   4           HB1      GLN   4 110.708  19.097   3.272
   23    HG2  GLN   4           HG2      GLN   4 108.855  17.255   1.852
   24    HG3  GLN   4           HG1      GLN   4 110.303  17.719   0.964
   25   HE21  GLN   4          HE21      GLN   4 110.539  17.657   4.461
   26   HE22  GLN   4          HE22      GLN   4 111.431  16.219   4.562
   27    H    HIS   5           HN       HIS   5 108.335  19.408   5.966
   28    HA   HIS   5           HA       HIS   5 108.361  18.008   7.789
   29    HB2  HIS   5           HB2      HIS   5 107.038  15.797   6.373
   30    HB3  HIS   5           HB1      HIS   5 106.533  16.667   7.819
   31    HD2  HIS   5           HD2      HIS   5 106.192  17.014   3.898
   32    HE1  HIS   5           HE1      HIS   5 103.619  19.824   5.716
   33    HE2  HIS   5           HE2      HIS   5 104.318  18.790   3.506
   34    H    ASP   6           HN       ASP   6 110.395  17.360   8.234
   35    HA   ASP   6           HA       ASP   6 112.180  15.986   6.742
   36    HB2  ASP   6           HB2      ASP   6 111.736  15.452   9.686
   37    HB3  ASP   6           HB1      ASP   6 113.237  15.227   8.789
   38    H    GLU   7           HN       GLU   7 112.691  13.880   6.270
   39    HA   GLU   7           HA       GLU   7 110.473  12.067   6.121
   40    HB2  GLU   7           HB2      GLU   7 112.142  10.546   5.033
   41    HB3  GLU   7           HB1      GLU   7 111.955  12.121   4.259
   42    HG2  GLU   7           HG2      GLU   7 114.039  11.920   6.385
   43    HG3  GLU   7           HG1      GLU   7 114.373  11.080   4.875
   44    H    ARG   8           HN       ARG   8 110.054  10.316   7.249
   45    HA   ARG   8           HA       ARG   8 111.820   9.606   9.516
   46    HB2  ARG   8           HB2      ARG   8 108.842   9.903   9.352
   47    HB3  ARG   8           HB1      ARG   8 109.529   8.723  10.458
   48    HG2  ARG   8           HG2      ARG   8 109.404  10.622  11.809
   49    HG3  ARG   8           HG1      ARG   8 111.063  10.707  11.225
   50    HD2  ARG   8           HD2      ARG   8 109.887  12.886  11.048
   51    HD3  ARG   8           HD1      ARG   8 110.413  12.276   9.486
   52    HE   ARG   8           HE       ARG   8 108.027  11.447   9.243
   53   HH11  ARG   8          HH21      ARG   8 108.877  14.152  11.249
   54   HH12  ARG   8          HH22      ARG   8 107.322  14.900  11.119
   55   HH21  ARG   8          HH11      ARG   8 106.002  12.437   9.072
   56   HH22  ARG   8          HH12      ARG   8 105.699  13.934   9.888
   57    H    ARG   9           HN       ARG   9 110.324   8.589   6.640
   58    HA   ARG   9           HA       ARG   9 110.365   5.735   7.377
   59    HB2  ARG   9           HB2      ARG   9 109.407   7.081   4.835
   60    HB3  ARG   9           HB1      ARG   9 109.288   5.361   5.196
   61    HG2  ARG   9           HG2      ARG   9 107.750   5.722   6.966
   62    HG3  ARG   9           HG1      ARG   9 108.118   7.439   7.028
   63    HD2  ARG   9           HD2      ARG   9 107.192   6.702   4.382
   64    HD3  ARG   9           HD1      ARG   9 106.019   6.225   5.602
   65    HE   ARG   9           HE       ARG   9 106.387   8.704   6.390
   66   HH11  ARG   9          HH21      ARG   9 106.317   7.479   3.143
   67   HH12  ARG   9          HH22      ARG   9 105.738   8.961   2.459
   68   HH21  ARG   9          HH11      ARG   9 105.631  10.635   5.488
   69   HH22  ARG   9          HH12      ARG   9 105.349  10.742   3.783
   70    H    ARG  10           HN       ARG  10 112.701   5.846   7.581
   71    HA   ARG  10           HA       ARG  10 114.883   5.898   6.725
   72    HB2  ARG  10           HB2      ARG  10 114.855   3.871   4.919
   73    HB3  ARG  10           HB1      ARG  10 114.810   3.624   6.659
   74    HG2  ARG  10           HG2      ARG  10 112.194   4.040   5.259
   75    HG3  ARG  10           HG1      ARG  10 113.007   2.502   5.034
   76    HD2  ARG  10           HD2      ARG  10 111.465   2.371   6.925
   77    HD3  ARG  10           HD1      ARG  10 113.124   2.200   7.484
   78    HE   ARG  10           HE       ARG  10 111.348   4.498   7.926
   79   HH11  ARG  10          HH21      ARG  10 114.428   2.949   8.323
   80   HH12  ARG  10          HH22      ARG  10 114.943   4.004   9.595
   81   HH21  ARG  10          HH11      ARG  10 112.032   5.881   9.589
   82   HH22  ARG  10          HH12      ARG  10 113.591   5.659  10.313
   83    H    PHE  11           HN       PHE  11 113.362   4.877   3.700
   84    HA   PHE  11           HA       PHE  11 114.234   7.393   2.433
   85    HB2  PHE  11           HB2      PHE  11 115.508   4.908   2.085
   86    HB3  PHE  11           HB1      PHE  11 114.526   5.124   0.639
   87    HD1  PHE  11           HD1      PHE  11 116.645   7.267   2.891
   88    HD2  PHE  11           HD2      PHE  11 115.585   6.206  -1.136
   89    HE1  PHE  11           HE1      PHE  11 118.293   8.910   2.020
   90    HE2  PHE  11           HE2      PHE  11 117.234   7.850  -1.999
   91    HZ   PHE  11           HZ       PHE  11 118.576   9.193  -0.418
   92    H    HIS  12           HN       HIS  12 112.975   8.066   0.688
   93    HA   HIS  12           HA       HIS  12 110.301   7.865   0.712
   94    HB2  HIS  12           HB2      HIS  12 110.264   8.452  -1.660
   95    HB3  HIS  12           HB1      HIS  12 111.558   9.322  -0.834
   96    HD2  HIS  12           HD2      HIS  12 114.215   8.247  -1.366
   97    HE1  HIS  12           HE1      HIS  12 112.983   6.039  -4.746
   98    HE2  HIS  12           HE2      HIS  12 114.996   6.898  -3.460
   99    H    ARG  13           HN       ARG  13 108.673   6.699  -0.445
  100    HA   ARG  13           HA       ARG  13 109.440   3.895  -1.012
  101    HB2  ARG  13           HB2      ARG  13 106.583   4.583  -0.524
  102    HB3  ARG  13           HB1      ARG  13 107.502   3.163  -0.036
  103    HG2  ARG  13           HG2      ARG  13 108.380   4.214   1.863
  104    HG3  ARG  13           HG1      ARG  13 108.114   5.832   1.216
  105    HD2  ARG  13           HD2      ARG  13 105.772   4.026   1.749
  106    HD3  ARG  13           HD1      ARG  13 106.505   4.936   3.067
  107    HE   ARG  13           HE       ARG  13 105.968   6.626   0.824
  108   HH11  ARG  13          HH21      ARG  13 104.509   4.943   3.472
  109   HH12  ARG  13          HH22      ARG  13 103.199   6.063   3.641
  110   HH21  ARG  13          HH11      ARG  13 104.256   8.098   1.038
  111   HH22  ARG  13          HH12      ARG  13 103.056   7.852   2.263
  112    H    ILE  14           HN       ILE  14 107.434   2.919  -2.380
  113    HA   ILE  14           HA       ILE  14 107.533   4.361  -4.923
  114    HB   ILE  14           HB       ILE  14 106.454   1.630  -4.210
  115   HG12  ILE  14          HG12      ILE  14 108.873   1.717  -3.954
  116   HG13  ILE  14          HG11      ILE  14 108.484   0.833  -5.427
  117   HG21  ILE  14          HG21      ILE  14 106.647   1.351  -6.758
  118   HG22  ILE  14          HG22      ILE  14 106.723   3.111  -6.823
  119   HG23  ILE  14          HG23      ILE  14 105.297   2.313  -6.157
  120   HD11  ILE  14          HD11      ILE  14 109.672   3.571  -5.123
  121   HD12  ILE  14          HD12      ILE  14 108.712   3.211  -6.559
  122   HD13  ILE  14          HD13      ILE  14 110.150   2.260  -6.199
  123    H    ALA  15           HN       ALA  15 106.072   6.056  -4.690
  124    HA   ALA  15           HA       ALA  15 103.340   5.424  -3.847
  125    HB1  ALA  15           HB1      ALA  15 103.001   7.898  -4.174
  126    HB2  ALA  15           HB2      ALA  15 104.720   8.015  -4.547
  127    HB3  ALA  15           HB3      ALA  15 104.200   7.471  -2.953
  128    H    PHE  16           HN       PHE  16 101.887   4.819  -5.221
  129    HA   PHE  16           HA       PHE  16 101.649   6.081  -7.822
  130    HB2  PHE  16           HB2      PHE  16 101.653   4.065  -9.111
  131    HB3  PHE  16           HB1      PHE  16 103.134   4.054  -8.159
  132    HD1  PHE  16           HD2      PHE  16 102.747   2.998  -5.671
  133    HD2  PHE  16           HD1      PHE  16 100.481   2.058  -9.199
  134    HE1  PHE  16           HE2      PHE  16 102.105   0.819  -4.682
  135    HE2  PHE  16           HE1      PHE  16  99.846  -0.122  -8.208
  136    HZ   PHE  16           HZ       PHE  16 100.663  -0.741  -5.953
  137    H    ASP  17           HN       ASP  17  99.482   5.622  -8.769
  138    HA   ASP  17           HA       ASP  17  97.568   5.194  -6.596
  139    HB2  ASP  17           HB2      ASP  17  95.938   6.198  -8.097
  140    HB3  ASP  17           HB1      ASP  17  97.378   7.214  -8.037
  141    H    ALA  18           HN       ALA  18  95.951   3.619  -6.679
  142    HA   ALA  18           HA       ALA  18  95.356   1.996  -8.879
  143    HB1  ALA  18           HB1      ALA  18  97.616   1.084  -8.625
  144    HB2  ALA  18           HB2      ALA  18  96.425  -0.128  -8.150
  145    HB3  ALA  18           HB3      ALA  18  97.313   0.767  -6.916
  146    H    ASP  19           HN       ASP  19  94.281  -0.133  -8.052
  147    HA   ASP  19           HA       ASP  19  92.507   0.706  -5.856
  148    HB2  ASP  19           HB2      ASP  19  92.006  -1.778  -7.431
  149    HB3  ASP  19           HB1      ASP  19  90.870  -0.572  -6.832
  150    H    SER  20           HN       SER  20  92.427  -0.312  -3.926
  151    HA   SER  20           HA       SER  20  93.823  -2.893  -3.648
  152    HB2  SER  20           HB2      SER  20  94.619  -2.031  -1.380
  153    HB3  SER  20           HB1      SER  20  95.439  -1.387  -2.798
  154    HG   SER  20           HG       SER  20  93.191   0.009  -2.088
  155    H    GLU  21           HN       GLU  21  93.081  -4.191  -1.940
  156    HA   GLU  21           HA       GLU  21  90.490  -3.395  -0.720
  157    HB2  GLU  21           HB2      GLU  21  91.198  -6.112  -1.880
  158    HB3  GLU  21           HB1      GLU  21  89.706  -5.714  -1.036
  159    HG2  GLU  21           HG2      GLU  21  90.445  -3.992  -3.360
  160    HG3  GLU  21           HG1      GLU  21  89.903  -5.629  -3.717
  161    H    ILE  22           HN       ILE  22  90.225  -4.018   1.398
  162    HA   ILE  22           HA       ILE  22  92.475  -5.553   2.573
  163    HB   ILE  22           HB       ILE  22  91.006  -3.153   3.686
  164   HG12  ILE  22          HG12      ILE  22  93.343  -3.362   2.126
  165   HG13  ILE  22          HG11      ILE  22  92.809  -1.950   3.029
  166   HG21  ILE  22          HG21      ILE  22  92.511  -3.492   5.690
  167   HG22  ILE  22          HG22      ILE  22  92.924  -5.074   5.031
  168   HG23  ILE  22          HG23      ILE  22  91.262  -4.719   5.497
  169   HD11  ILE  22          HD11      ILE  22  95.144  -2.614   3.581
  170   HD12  ILE  22          HD12      ILE  22  94.539  -4.161   4.174
  171   HD13  ILE  22          HD13      ILE  22  94.080  -2.663   4.985
  172    H    LEU  23           HN       LEU  23  92.041  -7.167   3.857
  173    HA   LEU  23           HA       LEU  23  89.212  -7.684   4.589
  174    HB2  LEU  23           HB2      LEU  23  91.076  -9.952   4.060
  175    HB3  LEU  23           HB1      LEU  23  89.332  -9.840   3.823
  176    HG   LEU  23           HG       LEU  23  90.069  -8.010   2.024
  177   HD11  LEU  23          HD11      LEU  23  92.342  -9.970   1.761
  178   HD12  LEU  23          HD12      LEU  23  92.527  -8.521   2.747
  179   HD13  LEU  23          HD13      LEU  23  92.165  -8.377   1.027
  180   HD21  LEU  23          HD21      LEU  23  90.094 -11.021   1.690
  181   HD22  LEU  23          HD22      LEU  23  90.112  -9.901   0.328
  182   HD23  LEU  23          HD23      LEU  23  88.737  -9.925   1.432
  183    H    GLN  24           HN       GLN  24  88.927  -7.841   6.642
  184    HA   GLN  24           HA       GLN  24  91.109  -8.916   8.356
  185    HB2  GLN  24           HB2      GLN  24  91.097  -6.577   8.823
  186    HB3  GLN  24           HB1      GLN  24  89.336  -6.521   8.868
  187    HG2  GLN  24           HG2      GLN  24  89.227  -7.657  10.930
  188    HG3  GLN  24           HG1      GLN  24  90.864  -8.289  10.771
  189   HE21  GLN  24          HE21      GLN  24  89.001  -5.748  12.138
  190   HE22  GLN  24          HE22      GLN  24  90.295  -4.753  12.607
  191    H    GLY  25           HN       GLY  25  90.271 -10.953   8.716
  192    HA2  GLY  25           HA2      GLY  25  88.972 -12.456   9.912
  193    HA3  GLY  25           HA1      GLY  25  87.911 -11.129  10.385
  194    H    GLU  26           HN       GLU  26  85.912 -11.514   9.679
  195    HA   GLU  26           HA       GLU  26  85.502 -12.879   7.100
  196    HB2  GLU  26           HB2      GLU  26  83.321 -13.399   7.872
  197    HB3  GLU  26           HB1      GLU  26  84.378 -13.646   9.261
  198    HG2  GLU  26           HG2      GLU  26  83.834 -11.194   9.871
  199    HG3  GLU  26           HG1      GLU  26  82.505 -11.345   8.724
  200    H    ARG  27           HN       ARG  27  86.087  -9.869   7.907
  201    HA   ARG  27           HA       ARG  27  83.866  -8.657   6.374
  202    HB2  ARG  27           HB2      ARG  27  85.700  -7.580   8.485
  203    HB3  ARG  27           HB1      ARG  27  84.687  -6.554   7.469
  204    HG2  ARG  27           HG2      ARG  27  82.703  -7.364   8.369
  205    HG3  ARG  27           HG1      ARG  27  83.425  -8.905   8.837
  206    HD2  ARG  27           HD2      ARG  27  84.669  -7.825  10.620
  207    HD3  ARG  27           HD1      ARG  27  84.073  -6.246  10.117
  208    HE   ARG  27           HE       ARG  27  81.770  -7.528  10.599
  209   HH11  ARG  27          HH21      ARG  27  84.744  -7.395  12.367
  210   HH12  ARG  27          HH22      ARG  27  83.992  -7.613  13.912
  211   HH21  ARG  27          HH11      ARG  27  80.782  -7.819  12.622
  212   HH22  ARG  27          HH12      ARG  27  81.752  -7.853  14.057
  213    H    ARG  28           HN       ARG  28  84.283  -7.612   4.514
  214    HA   ARG  28           HA       ARG  28  87.093  -6.986   3.792
  215    HB2  ARG  28           HB2      ARG  28  86.348  -9.021   2.603
  216    HB3  ARG  28           HB1      ARG  28  84.967  -8.132   1.959
  217    HG2  ARG  28           HG2      ARG  28  86.485  -6.560   0.828
  218    HG3  ARG  28           HG1      ARG  28  87.879  -7.410   1.494
  219    HD2  ARG  28           HD2      ARG  28  86.732  -9.509   0.345
  220    HD3  ARG  28           HD1      ARG  28  85.979  -8.272  -0.656
  221    HE   ARG  28           HE       ARG  28  88.604  -7.582  -0.741
  222   HH11  ARG  28          HH21      ARG  28  86.888 -10.556  -1.176
  223   HH12  ARG  28          HH22      ARG  28  88.006 -11.192  -2.336
  224   HH21  ARG  28          HH11      ARG  28  90.074  -8.409  -2.260
  225   HH22  ARG  28          HH12      ARG  28  89.811  -9.976  -2.951
  226    H    TRP  29           HN       TRP  29  87.398  -5.199   2.471
  227    HA   TRP  29           HA       TRP  29  85.105  -3.504   1.825
  228    HB2  TRP  29           HB2      TRP  29  87.423  -2.629   3.546
  229    HB3  TRP  29           HB1      TRP  29  86.122  -1.587   2.968
  230    HD1  TRP  29           HD1      TRP  29  83.565  -2.488   3.780
  231    HE1  TRP  29           HE1      TRP  29  82.900  -3.321   6.138
  232    HE3  TRP  29           HE3      TRP  29  88.160  -3.724   5.582
  233    HZ2  TRP  29           HZ2      TRP  29  84.181  -4.381   8.482
  234    HZ3  TRP  29           HZ3      TRP  29  88.429  -4.636   7.864
  235    HH2  TRP  29           HH2      TRP  29  86.443  -4.976   9.320
  236    H    GLU  30           HN       GLU  30  85.660  -1.790   0.370
  237    HA   GLU  30           HA       GLU  30  88.036  -2.391  -1.244
  238    HB2  GLU  30           HB2      GLU  30  85.801  -0.515  -2.007
  239    HB3  GLU  30           HB1      GLU  30  86.924  -1.373  -3.062
  240    HG2  GLU  30           HG2      GLU  30  85.920  -3.534  -2.255
  241    HG3  GLU  30           HG1      GLU  30  84.708  -2.587  -1.392
  242    H    VAL  31           HN       VAL  31  89.707  -0.904  -1.421
  243    HA   VAL  31           HA       VAL  31  89.255   1.859  -0.533
  244    HB   VAL  31           HB       VAL  31  91.350   1.731   0.858
  245   HG11  VAL  31          HG11      VAL  31  89.069   1.687   1.840
  246   HG12  VAL  31          HG12      VAL  31  90.219   0.743   2.787
  247   HG13  VAL  31          HG13      VAL  31  89.072  -0.072   1.726
  248   HG21  VAL  31          HG21      VAL  31  92.012  -0.497  -0.292
  249   HG22  VAL  31          HG22      VAL  31  90.890  -1.255   0.837
  250   HG23  VAL  31          HG23      VAL  31  92.284  -0.361   1.444
  251    H    LEU  32           HN       LEU  32  90.956   3.303  -1.128
  252    HA   LEU  32           HA       LEU  32  92.360   2.439  -3.564
  253    HB2  LEU  32           HB2      LEU  32  92.577   4.779  -4.108
  254    HB3  LEU  32           HB1      LEU  32  90.906   4.504  -3.625
  255    HG   LEU  32           HG       LEU  32  93.097   5.655  -1.868
  256   HD11  LEU  32          HD11      LEU  32  90.691   6.867  -3.244
  257   HD12  LEU  32          HD12      LEU  32  92.387   7.275  -3.501
  258   HD13  LEU  32          HD13      LEU  32  91.602   7.685  -1.975
  259   HD21  LEU  32          HD21      LEU  32  90.237   4.846  -1.359
  260   HD22  LEU  32          HD22      LEU  32  90.959   6.169  -0.444
  261   HD23  LEU  32          HD23      LEU  32  91.665   4.558  -0.361
  262    H    LEU  33           HN       LEU  33  94.528   2.187  -3.577
  263    HA   LEU  33           HA       LEU  33  95.945   2.731  -1.068
  264    HB2  LEU  33           HB2      LEU  33  96.351   0.525  -1.857
  265    HB3  LEU  33           HB1      LEU  33  96.613   1.073  -3.509
  266    HG   LEU  33           HG       LEU  33  98.448   2.306  -1.535
  267   HD11  LEU  33          HD11      LEU  33  98.159  -0.055  -0.659
  268   HD12  LEU  33          HD12      LEU  33  99.799   0.362  -1.145
  269   HD13  LEU  33          HD13      LEU  33  98.794  -0.627  -2.202
  270   HD21  LEU  33          HD21      LEU  33 100.010   2.062  -3.298
  271   HD22  LEU  33          HD22      LEU  33  98.481   2.352  -4.128
  272   HD23  LEU  33          HD23      LEU  33  99.123   0.715  -4.013
  273    H    HIS  34           HN       HIS  34  97.222   4.384  -0.817
  274    HA   HIS  34           HA       HIS  34  97.755   6.115  -3.110
  275    HB2  HIS  34           HB2      HIS  34  98.002   6.457  -0.119
  276    HB3  HIS  34           HB1      HIS  34  98.520   7.700  -1.266
  277    HD2  HIS  34           HD2      HIS  34  95.128   5.787  -0.424
  278    HE1  HIS  34           HE1      HIS  34  94.211   9.595  -1.982
  279    HE2  HIS  34           HE2      HIS  34  93.226   7.480  -0.992
  280    H    ASP  35           HN       ASP  35  99.552   3.943  -1.018
  281    HA   ASP  35           HA       ASP  35 101.686   3.983  -2.816
  282    HB2  ASP  35           HB2      ASP  35 103.448   5.167  -1.631
  283    HB3  ASP  35           HB1      ASP  35 102.062   6.256  -1.758
  284    H    VAL  36           HN       VAL  36 103.530   2.671  -2.152
  285    HA   VAL  36           HA       VAL  36 103.080   0.999   0.217
  286    HB   VAL  36           HB       VAL  36 101.937  -0.008  -1.842
  287   HG11  VAL  36          HG11      VAL  36 103.256  -0.895  -3.588
  288   HG12  VAL  36          HG12      VAL  36 104.748  -0.731  -2.662
  289   HG13  VAL  36          HG13      VAL  36 103.950   0.703  -3.308
  290   HG21  VAL  36          HG21      VAL  36 102.789  -1.261   0.236
  291   HG22  VAL  36          HG22      VAL  36 104.169  -1.730  -0.754
  292   HG23  VAL  36          HG23      VAL  36 102.542  -2.219  -1.221
  293    H    SER  37           HN       SER  37 104.908  -0.581   0.503
  294    HA   SER  37           HA       SER  37 107.467   0.321  -0.580
  295    HB2  SER  37           HB2      SER  37 107.079   1.559   1.579
  296    HB3  SER  37           HB1      SER  37 106.962   0.001   2.393
  297    HG   SER  37           HG       SER  37 109.159   1.319   1.327
  298    H    LEU  38           HN       LEU  38 109.199  -1.357   0.162
  299    HA   LEU  38           HA       LEU  38 108.188  -3.915  -0.510
  300    HB2  LEU  38           HB2      LEU  38 110.865  -3.074   0.627
  301    HB3  LEU  38           HB1      LEU  38 110.505  -4.721   0.113
  302    HG   LEU  38           HG       LEU  38 110.190  -2.309  -1.693
  303   HD11  LEU  38          HD11      LEU  38 112.319  -3.262  -2.755
  304   HD12  LEU  38          HD12      LEU  38 112.524  -4.184  -1.266
  305   HD13  LEU  38          HD13      LEU  38 112.524  -2.420  -1.218
  306   HD21  LEU  38          HD21      LEU  38 109.969  -5.295  -2.017
  307   HD22  LEU  38          HD22      LEU  38 110.488  -4.314  -3.387
  308   HD23  LEU  38          HD23      LEU  38 108.917  -4.025  -2.644
  309    H    HIS  39           HN       HIS  39 107.806  -2.286   2.319
  310    HA   HIS  39           HA       HIS  39 107.030  -4.685   3.722
  311    HB2  HIS  39           HB2      HIS  39 109.617  -4.205   4.057
  312    HB3  HIS  39           HB1      HIS  39 109.017  -3.034   5.231
  313    HD2  HIS  39           HD2      HIS  39 107.626  -4.200   7.465
  314    HE1  HIS  39           HE1      HIS  39 108.730  -8.174   6.565
  315    HE2  HIS  39           HE2      HIS  39 107.692  -6.664   8.323
  316    H    GLY  40           HN       GLY  40 105.626  -2.374   2.832
  317    HA2  GLY  40           HA2      GLY  40 104.181  -1.707   5.178
  318    HA3  GLY  40           HA1      GLY  40 105.240  -0.374   4.735
  319    H    ILE  41           HN       ILE  41 102.326  -0.368   4.724
  320    HA   ILE  41           HA       ILE  41 101.905   0.486   1.941
  321    HB   ILE  41           HB       ILE  41 100.844  -1.423   1.413
  322   HG12  ILE  41          HG12      ILE  41  98.819  -0.620   3.531
  323   HG13  ILE  41          HG11      ILE  41  98.905   0.101   1.922
  324   HG21  ILE  41          HG21      ILE  41 101.904  -2.650   3.199
  325   HG22  ILE  41          HG22      ILE  41 100.204  -3.115   3.152
  326   HG23  ILE  41          HG23      ILE  41 100.777  -1.992   4.385
  327   HD11  ILE  41          HD11      ILE  41  98.523  -2.857   2.463
  328   HD12  ILE  41          HD12      ILE  41  98.502  -2.068   0.886
  329   HD13  ILE  41          HD13      ILE  41  97.226  -1.732   2.056
  330    H    LEU  42           HN       LEU  42 100.299   1.946   1.621
  331    HA   LEU  42           HA       LEU  42  99.017   3.076   4.040
  332    HB2  LEU  42           HB2      LEU  42 100.926   4.388   2.677
  333    HB3  LEU  42           HB1      LEU  42  99.545   4.823   1.680
  334    HG   LEU  42           HG       LEU  42  99.501   5.132   4.685
  335   HD11  LEU  42          HD11      LEU  42 101.399   6.433   3.673
  336   HD12  LEU  42          HD12      LEU  42 100.157   7.452   4.398
  337   HD13  LEU  42          HD13      LEU  42 100.225   7.255   2.647
  338   HD21  LEU  42          HD21      LEU  42  97.867   7.017   3.801
  339   HD22  LEU  42          HD22      LEU  42  97.311   5.353   3.934
  340   HD23  LEU  42          HD23      LEU  42  97.798   5.996   2.367
  341    H    VAL  43           HN       VAL  43  96.839   3.574   3.839
  342    HA   VAL  43           HA       VAL  43  95.596   3.368   1.187
  343    HB   VAL  43           HB       VAL  43  93.939   1.752   1.942
  344   HG11  VAL  43          HG11      VAL  43  96.157   1.031   0.948
  345   HG12  VAL  43          HG12      VAL  43  95.360  -0.191   1.938
  346   HG13  VAL  43          HG13      VAL  43  96.715   0.728   2.593
  347   HG21  VAL  43          HG21      VAL  43  94.368   0.583   4.143
  348   HG22  VAL  43          HG22      VAL  43  93.840   2.258   4.300
  349   HG23  VAL  43          HG23      VAL  43  95.541   1.847   4.511
  350    H    GLY  44           HN       GLY  44  93.144   3.697   1.437
  351    HA2  GLY  44           HA2      GLY  44  92.744   6.127   3.086
  352    HA3  GLY  44           HA1      GLY  44  91.775   5.662   1.686
  353    H    GLN  45           HN       GLN  45  90.958   6.280   4.595
  354    HA   GLN  45           HA       GLN  45  90.092   3.732   5.600
  355    HB2  GLN  45           HB2      GLN  45  90.858   5.626   7.030
  356    HB3  GLN  45           HB1      GLN  45  89.405   6.505   6.568
  357    HG2  GLN  45           HG2      GLN  45  88.875   3.757   7.514
  358    HG3  GLN  45           HG1      GLN  45  89.589   4.806   8.736
  359   HE21  GLN  45          HE21      GLN  45  87.668   5.138   9.988
  360   HE22  GLN  45          HE22      GLN  45  86.306   5.948   9.378
  361    HA   PRO  46           HA       PRO  46  86.175   4.572   3.454
  362    HB2  PRO  46           HB2      PRO  46  85.213   2.043   3.279
  363    HB3  PRO  46           HB1      PRO  46  86.585   2.569   2.279
  364    HG2  PRO  46           HG2      PRO  46  86.587   0.956   4.789
  365    HG3  PRO  46           HG1      PRO  46  87.574   0.768   3.332
  366    HD2  PRO  46           HD2      PRO  46  88.417   2.058   5.677
  367    HD3  PRO  46           HD1      PRO  46  89.160   2.266   4.081
  368    H    GLN  47           HN       GLN  47  83.840   4.301   4.028
  369    HA   GLN  47           HA       GLN  47  83.392   4.805   6.773
  370    HB2  GLN  47           HB2      GLN  47  81.974   5.133   4.398
  371    HB3  GLN  47           HB1      GLN  47  81.000   3.982   5.310
  372    HG2  GLN  47           HG2      GLN  47  80.209   6.092   6.018
  373    HG3  GLN  47           HG1      GLN  47  81.304   5.597   7.307
  374   HE21  GLN  47          HE21      GLN  47  83.567   6.539   7.201
  375   HE22  GLN  47          HE22      GLN  47  83.777   8.062   6.480
  376    H    ASP  48           HN       ASP  48  82.848   1.917   4.790
  377    HA   ASP  48           HA       ASP  48  81.512   0.428   6.824
  378    HB2  ASP  48           HB2      ASP  48  82.855  -0.343   4.242
  379    HB3  ASP  48           HB1      ASP  48  82.091  -1.529   5.300
  380    H    TRP  49           HN       TRP  49  84.507   1.543   7.045
  381    HA   TRP  49           HA       TRP  49  86.159  -0.683   7.535
  382    HB2  TRP  49           HB2      TRP  49  86.914   1.692   7.309
  383    HB3  TRP  49           HB1      TRP  49  86.294   1.989   8.930
  384    HD1  TRP  49           HD1      TRP  49  87.613   1.041  10.936
  385    HE1  TRP  49           HE1      TRP  49  90.009   0.014  11.182
  386    HE3  TRP  49           HE3      TRP  49  88.545   0.035   6.077
  387    HZ2  TRP  49           HZ2      TRP  49  92.072  -1.122   9.373
  388    HZ3  TRP  49           HZ3      TRP  49  90.658  -1.015   5.349
  389    HH2  TRP  49           HH2      TRP  49  92.391  -1.598   7.006
  390    H    ASN  50           HN       ASN  50  84.292  -1.940   8.670
  391    HA   ASN  50           HA       ASN  50  84.154  -1.267  11.523
  392    HB2  ASN  50           HB2      ASN  50  82.015  -1.870  10.665
  393    HB3  ASN  50           HB1      ASN  50  82.668  -3.261   9.804
  394   HD21  ASN  50          HD21      ASN  50  84.021  -2.863  12.953
  395   HD22  ASN  50          HD22      ASN  50  83.088  -4.043  13.739
  396    H    GLY  51           HN       GLY  51  86.437  -1.694  11.826
  397    HA2  GLY  51           HA2      GLY  51  86.923  -4.547  12.362
  398    HA3  GLY  51           HA1      GLY  51  88.090  -3.663  11.388
  399    H    ASP  52           HN       ASP  52  88.695  -4.915  13.835
  400    HA   ASP  52           HA       ASP  52  88.914  -2.781  15.821
  401    HB2  ASP  52           HB2      ASP  52  88.279  -4.877  16.750
  402    HB3  ASP  52           HB1      ASP  52  89.529  -5.733  15.853
  403    HA   PRO  53           HA       PRO  53  92.933  -1.752  14.124
  404    HB2  PRO  53           HB2      PRO  53  93.713  -0.103  16.222
  405    HB3  PRO  53           HB1      PRO  53  92.727   0.413  14.843
  406    HG2  PRO  53           HG2      PRO  53  91.892  -0.317  17.596
  407    HG3  PRO  53           HG1      PRO  53  91.244   0.920  16.504
  408    HD2  PRO  53           HD2      PRO  53  89.988  -1.453  16.934
  409    HD3  PRO  53           HD1      PRO  53  89.882  -0.588  15.385
  410    H    GLN  54           HN       GLN  54  92.315  -3.162  17.221
  411    HA   GLN  54           HA       GLN  54  95.076  -3.634  17.855
  412    HB2  GLN  54           HB2      GLN  54  92.568  -4.861  19.021
  413    HB3  GLN  54           HB1      GLN  54  94.190  -5.018  19.693
  414    HG2  GLN  54           HG2      GLN  54  94.245  -2.447  19.724
  415    HG3  GLN  54           HG1      GLN  54  92.504  -2.523  19.453
  416   HE21  GLN  54          HE21      GLN  54  92.797  -5.240  21.121
  417   HE22  GLN  54          HE22      GLN  54  92.714  -4.670  22.717
  418    H    ARG  55           HN       ARG  55  92.713  -5.206  15.906
  419    HA   ARG  55           HA       ARG  55  94.228  -7.726  15.922
  420    HB2  ARG  55           HB2      ARG  55  91.449  -6.953  15.331
  421    HB3  ARG  55           HB1      ARG  55  92.122  -8.082  14.161
  422    HG2  ARG  55           HG2      ARG  55  92.036  -9.803  15.635
  423    HG3  ARG  55           HG1      ARG  55  92.793  -8.850  16.909
  424    HD2  ARG  55           HD2      ARG  55  90.711  -7.926  17.599
  425    HD3  ARG  55           HD1      ARG  55  89.896  -8.481  16.139
  426    HE   ARG  55           HE       ARG  55  89.535 -10.485  17.229
  427   HH11  ARG  55          HH21      ARG  55  92.282  -8.864  18.579
  428   HH12  ARG  55          HH22      ARG  55  92.577 -10.074  19.783
  429   HH21  ARG  55          HH11      ARG  55  89.914 -12.070  18.810
  430   HH22  ARG  55          HH12      ARG  55  91.237 -11.887  19.914
  431    HA   PRO  56           HA       PRO  56  96.256  -6.899  12.161
  432    HB2  PRO  56           HB2      PRO  56  96.349  -9.365  10.968
  433    HB3  PRO  56           HB1      PRO  56  97.318  -8.935  12.391
  434    HG2  PRO  56           HG2      PRO  56  94.770 -10.474  12.233
  435    HG3  PRO  56           HG1      PRO  56  96.199 -10.758  13.242
  436    HD2  PRO  56           HD2      PRO  56  93.921  -9.564  14.192
  437    HD3  PRO  56           HD1      PRO  56  95.540  -9.223  14.844
  438    H    PHE  57           HN       PHE  57  96.147  -6.838   9.841
  439    HA   PHE  57           HA       PHE  57  93.435  -7.182   8.700
  440    HB2  PHE  57           HB2      PHE  57  95.307  -4.831   8.299
  441    HB3  PHE  57           HB1      PHE  57  93.777  -5.075   7.460
  442    HD1  PHE  57           HD2      PHE  57  95.270  -4.662  10.864
  443    HD2  PHE  57           HD1      PHE  57  91.739  -4.382   8.440
  444    HE1  PHE  57           HE2      PHE  57  94.066  -3.566  12.738
  445    HE2  PHE  57           HE1      PHE  57  90.536  -3.291  10.309
  446    HZ   PHE  57           HZ       PHE  57  91.697  -2.885  12.460
  447    H    GLU  58           HN       GLU  58  93.506  -7.541   6.334
  448    HA   GLU  58           HA       GLU  58  96.195  -8.292   5.366
  449    HB2  GLU  58           HB2      GLU  58  93.621  -9.633   4.498
  450    HB3  GLU  58           HB1      GLU  58  95.270 -10.154   4.150
  451    HG2  GLU  58           HG2      GLU  58  95.665 -10.621   6.508
  452    HG3  GLU  58           HG1      GLU  58  94.075  -9.989   6.931
  453    H    ALA  59           HN       ALA  59  96.774  -7.496   3.311
  454    HA   ALA  59           HA       ALA  59  94.720  -5.822   1.973
  455    HB1  ALA  59           HB1      ALA  59  96.832  -4.603   1.152
  456    HB2  ALA  59           HB2      ALA  59  97.654  -5.435   2.472
  457    HB3  ALA  59           HB3      ALA  59  96.314  -4.346   2.814
  458    H    ARG  60           HN       ARG  60  94.416  -6.054  -0.139
  459    HA   ARG  60           HA       ARG  60  96.239  -7.829  -1.654
  460    HB2  ARG  60           HB2      ARG  60  93.221  -7.631  -1.720
  461    HB3  ARG  60           HB1      ARG  60  94.155  -8.371  -3.020
  462    HG2  ARG  60           HG2      ARG  60  95.003  -9.376  -0.412
  463    HG3  ARG  60           HG1      ARG  60  93.278  -9.639  -0.669
  464    HD2  ARG  60           HD2      ARG  60  95.526 -10.488  -2.510
  465    HD3  ARG  60           HD1      ARG  60  94.505 -11.548  -1.542
  466    HE   ARG  60           HE       ARG  60  93.852 -10.447  -4.096
  467   HH11  ARG  60          HH21      ARG  60  92.560 -11.278  -0.995
  468   HH12  ARG  60          HH22      ARG  60  90.957 -11.557  -1.586
  469   HH21  ARG  60          HH11      ARG  60  91.751 -10.807  -4.876
  470   HH22  ARG  60          HH12      ARG  60  90.498 -11.289  -3.783
  471    H    LEU  61           HN       LEU  61  97.135  -6.810  -3.384
  472    HA   LEU  61           HA       LEU  61  95.936  -4.237  -4.203
  473    HB2  LEU  61           HB2      LEU  61  98.715  -5.159  -4.893
  474    HB3  LEU  61           HB1      LEU  61  98.082  -3.516  -4.830
  475    HG   LEU  61           HG       LEU  61  98.431  -5.344  -2.432
  476   HD11  LEU  61          HD11      LEU  61 100.600  -4.631  -3.233
  477   HD12  LEU  61          HD12      LEU  61 100.197  -3.651  -1.823
  478   HD13  LEU  61          HD13      LEU  61 100.029  -2.975  -3.443
  479   HD21  LEU  61          HD21      LEU  61  97.465  -2.497  -2.780
  480   HD22  LEU  61          HD22      LEU  61  98.027  -3.122  -1.230
  481   HD23  LEU  61          HD23      LEU  61  96.617  -3.838  -2.011
  482    H    TYR  62           HN       TYR  62  95.676  -3.732  -6.375
  483    HA   TYR  62           HA       TYR  62  95.943  -5.967  -8.288
  484    HB2  TYR  62           HB2      TYR  62  93.539  -4.145  -8.240
  485    HB3  TYR  62           HB1      TYR  62  93.747  -5.662  -9.116
  486    HD1  TYR  62           HD1      TYR  62  93.191  -4.137  -5.798
  487    HD2  TYR  62           HD2      TYR  62  93.515  -7.807  -8.004
  488    HE1  TYR  62           HE1      TYR  62  92.266  -5.384  -3.858
  489    HE2  TYR  62           HE2      TYR  62  92.590  -9.051  -6.068
  490    HH   TYR  62           HH       TYR  62  91.244  -7.417  -3.303
  491    H    LEU  63           HN       LEU  63  97.352  -5.272  -9.754
  492    HA   LEU  63           HA       LEU  63  97.290  -2.438 -10.609
  493    HB2  LEU  63           HB2      LEU  63  99.435  -3.614  -9.700
  494    HB3  LEU  63           HB1      LEU  63  99.497  -4.368 -11.290
  495    HG   LEU  63           HG       LEU  63  99.378  -1.381 -10.763
  496   HD11  LEU  63          HD11      LEU  63 101.712  -1.627 -11.935
  497   HD12  LEU  63          HD12      LEU  63 101.609  -3.303 -11.394
  498   HD13  LEU  63          HD13      LEU  63 101.571  -1.991 -10.217
  499   HD21  LEU  63          HD21      LEU  63  99.367  -3.067 -13.265
  500   HD22  LEU  63          HD22      LEU  63 100.035  -1.436 -13.293
  501   HD23  LEU  63          HD23      LEU  63  98.346  -1.686 -12.857
  502    H    GLY  64           HN       GLY  64  98.558  -5.250 -12.335
  503    HA2  GLY  64           HA2      GLY  64  97.209  -4.471 -14.764
  504    HA3  GLY  64           HA1      GLY  64  98.243  -5.885 -14.544
  505    H    LEU  65           HN       LEU  65  96.210  -6.622 -15.966
  506    HA   LEU  65           HA       LEU  65  93.843  -7.143 -14.442
  507    HB2  LEU  65           HB2      LEU  65  94.791  -8.110 -17.147
  508    HB3  LEU  65           HB1      LEU  65  93.252  -8.606 -16.444
  509    HG   LEU  65           HG       LEU  65  92.662  -6.167 -16.199
  510   HD11  LEU  65          HD11      LEU  65  94.046  -4.700 -17.852
  511   HD12  LEU  65          HD12      LEU  65  95.299  -5.921 -17.641
  512   HD13  LEU  65          HD13      LEU  65  94.710  -5.011 -16.250
  513   HD21  LEU  65          HD21      LEU  65  92.362  -5.843 -18.730
  514   HD22  LEU  65          HD22      LEU  65  91.684  -7.319 -18.042
  515   HD23  LEU  65          HD23      LEU  65  93.215  -7.375 -18.915
  516    H    ASP  66           HN       ASP  66  96.784  -8.941 -15.236
  517    HA   ASP  66           HA       ASP  66  95.813 -11.392 -13.911
  518    HB2  ASP  66           HB2      ASP  66  96.821 -11.548 -16.142
  519    HB3  ASP  66           HB1      ASP  66  98.291 -10.803 -15.517
  520    H    VAL  67           HN       VAL  67  97.098  -8.579 -12.872
  521    HA   VAL  67           HA       VAL  67  99.211  -9.817 -11.231
  522    HB   VAL  67           HB       VAL  67  98.624  -6.990 -12.054
  523   HG11  VAL  67          HG11      VAL  67 100.675  -6.533 -10.441
  524   HG12  VAL  67          HG12      VAL  67 100.052  -7.942  -9.585
  525   HG13  VAL  67          HG13      VAL  67  99.033  -6.518  -9.800
  526   HG21  VAL  67          HG21      VAL  67 101.253  -8.479 -11.925
  527   HG22  VAL  67          HG22      VAL  67 100.836  -7.077 -12.914
  528   HG23  VAL  67          HG23      VAL  67 100.154  -8.658 -13.297
  529    H    LEU  68           HN       LEU  68  98.070 -10.847  -9.668
  530    HA   LEU  68           HA       LEU  68  96.439  -9.165  -7.860
  531    HB2  LEU  68           HB2      LEU  68  94.962 -10.854  -8.397
  532    HB3  LEU  68           HB1      LEU  68  96.244 -12.000  -8.770
  533    HG   LEU  68           HG       LEU  68  96.691 -12.272  -6.342
  534   HD11  LEU  68          HD11      LEU  68  95.350 -11.233  -4.681
  535   HD12  LEU  68          HD12      LEU  68  94.164 -10.688  -5.865
  536   HD13  LEU  68          HD13      LEU  68  95.752  -9.929  -5.795
  537   HD21  LEU  68          HD21      LEU  68  93.766 -12.648  -7.036
  538   HD22  LEU  68          HD22      LEU  68  94.691 -13.561  -5.845
  539   HD23  LEU  68          HD23      LEU  68  95.059 -13.725  -7.562
  540    H    ILE  69           HN       ILE  69  97.524  -8.573  -6.080
  541    HA   ILE  69           HA       ILE  69  99.677 -10.357  -5.095
  542    HB   ILE  69           HB       ILE  69  99.405  -7.352  -5.057
  543   HG12  ILE  69          HG12      ILE  69 101.956  -8.533  -5.856
  544   HG13  ILE  69          HG11      ILE  69 100.631  -9.166  -6.828
  545   HG21  ILE  69          HG21      ILE  69 100.927  -9.167  -3.264
  546   HG22  ILE  69          HG22      ILE  69 100.342  -7.534  -2.971
  547   HG23  ILE  69          HG23      ILE  69 101.820  -7.786  -3.902
  548   HD11  ILE  69          HD11      ILE  69 101.373  -6.258  -6.425
  549   HD12  ILE  69          HD12      ILE  69  99.885  -6.784  -7.211
  550   HD13  ILE  69          HD13      ILE  69 101.445  -7.183  -7.925
  551    H    ARG  70           HN       ARG  70  99.851 -10.793  -2.927
  552    HA   ARG  70           HA       ARG  70  97.666  -9.829  -1.184
  553    HB2  ARG  70           HB2      ARG  70  98.105 -12.313  -0.175
  554    HB3  ARG  70           HB1      ARG  70  96.846 -11.951  -1.353
  555    HG2  ARG  70           HG2      ARG  70  98.367 -12.560  -3.188
  556    HG3  ARG  70           HG1      ARG  70  99.648 -12.897  -2.024
  557    HD2  ARG  70           HD2      ARG  70  96.980 -14.327  -2.197
  558    HD3  ARG  70           HD1      ARG  70  98.535 -14.977  -2.703
  559    HE   ARG  70           HE       ARG  70  99.173 -15.155  -0.415
  560   HH11  ARG  70          HH21      ARG  70  95.973 -13.902  -0.890
  561   HH12  ARG  70          HH22      ARG  70  95.475 -14.191   0.742
  562   HH21  ARG  70          HH11      ARG  70  98.521 -15.524   1.723
  563   HH22  ARG  70          HH12      ARG  70  96.915 -15.107   2.221
  564    H    MET  71           HN       MET  71  98.219  -9.180   0.772
  565    HA   MET  71           HA       MET  71 100.806  -9.941   1.927
  566    HB2  MET  71           HB2      MET  71 100.272  -7.082   2.284
  567    HB3  MET  71           HB1      MET  71 101.760  -7.886   1.801
  568    HG2  MET  71           HG2      MET  71 101.206  -7.814  -0.481
  569    HG3  MET  71           HG1      MET  71  99.487  -7.607  -0.158
  570    HE1  MET  71           HE1      MET  71 102.069  -5.558   2.027
  571    HE2  MET  71           HE2      MET  71 102.674  -4.433   0.811
  572    HE3  MET  71           HE3      MET  71 102.929  -6.166   0.605
  573    H    GLU  72           HN       GLU  72 100.859  -9.768   4.178
  574    HA   GLU  72           HA       GLU  72  98.231  -9.285   5.427
  575    HB2  GLU  72           HB2      GLU  72  99.049 -11.623   5.666
  576    HB3  GLU  72           HB1      GLU  72 100.511 -11.013   6.443
  577    HG2  GLU  72           HG2      GLU  72  99.316 -10.233   8.335
  578    HG3  GLU  72           HG1      GLU  72  97.765 -10.348   7.505
  579    H    ILE  73           HN       ILE  73  98.154  -7.459   6.638
  580    HA   ILE  73           HA       ILE  73 100.712  -6.476   7.756
  581    HB   ILE  73           HB       ILE  73 100.180  -4.266   7.068
  582   HG12  ILE  73          HG12      ILE  73  97.523  -5.507   6.312
  583   HG13  ILE  73          HG11      ILE  73  97.811  -4.140   7.384
  584   HG21  ILE  73          HG21      ILE  73 100.646  -4.566   4.826
  585   HG22  ILE  73          HG22      ILE  73  99.388  -5.784   4.618
  586   HG23  ILE  73          HG23      ILE  73 100.918  -6.218   5.376
  587   HD11  ILE  73          HD11      ILE  73  97.710  -4.236   4.425
  588   HD12  ILE  73          HD12      ILE  73  98.936  -3.183   5.112
  589   HD13  ILE  73          HD13      ILE  73  97.237  -2.940   5.518
  590    H    SER  74           HN       SER  74 100.467  -4.818   9.417
  591    HA   SER  74           HA       SER  74  98.024  -5.124  11.085
  592    HB2  SER  74           HB2      SER  74  99.305  -5.337  12.992
  593    HB3  SER  74           HB1      SER  74 100.402  -6.091  11.840
  594    HG   SER  74           HG       SER  74 100.670  -3.787  13.252
  595    H    LEU  75           HN       LEU  75  97.280  -3.293  12.163
  596    HA   LEU  75           HA       LEU  75  97.610  -0.844  10.755
  597    HB2  LEU  75           HB2      LEU  75  95.561  -1.613  12.088
  598    HB3  LEU  75           HB1      LEU  75  96.444  -1.105  13.527
  599    HG   LEU  75           HG       LEU  75  96.755   1.153  12.344
  600   HD11  LEU  75          HD11      LEU  75  94.641  -0.116  10.591
  601   HD12  LEU  75          HD12      LEU  75  96.185   0.572  10.081
  602   HD13  LEU  75          HD13      LEU  75  94.903   1.624  10.677
  603   HD21  LEU  75          HD21      LEU  75  95.084   0.596  14.196
  604   HD22  LEU  75          HD22      LEU  75  93.882   0.413  12.918
  605   HD23  LEU  75          HD23      LEU  75  94.665   1.971  13.174
  606    H    ALA  76           HN       ALA  76  99.037   0.680  10.920
  607    HA   ALA  76           HA       ALA  76 100.880   0.654  13.203
  608    HB1  ALA  76           HB1      ALA  76 101.183   1.893  10.463
  609    HB2  ALA  76           HB2      ALA  76 101.994   0.448  11.060
  610    HB3  ALA  76           HB3      ALA  76 102.374   2.018  11.761
  611    H    TRP  77           HN       TRP  77  98.877   2.852  11.277
  612    HA   TRP  77           HA       TRP  77  98.298   4.514  13.587
  613    HB2  TRP  77           HB2      TRP  77  99.287   6.589  12.638
  614    HB3  TRP  77           HB1      TRP  77 100.538   5.383  12.972
  615    HD1  TRP  77           HD1      TRP  77 101.763   4.284  10.963
  616    HE1  TRP  77           HE1      TRP  77 101.630   4.560   8.393
  617    HE3  TRP  77           HE3      TRP  77  97.810   7.492  10.600
  618    HZ2  TRP  77           HZ2      TRP  77 100.241   6.126   6.498
  619    HZ3  TRP  77           HZ3      TRP  77  97.099   8.369   8.394
  620    HH2  TRP  77           HH2      TRP  77  98.298   7.680   6.332
  621    H    ALA  78           HN       ALA  78  97.010   6.517  12.848
  622    HA   ALA  78           HA       ALA  78  95.680   6.270  10.245
  623    HB1  ALA  78           HB1      ALA  78  94.214   6.014  12.878
  624    HB2  ALA  78           HB2      ALA  78  94.315   4.804  11.600
  625    HB3  ALA  78           HB3      ALA  78  93.431   6.305  11.324
  626    H    ARG  79           HN       ARG  79  95.534   8.367   9.476
  627    HA   ARG  79           HA       ARG  79  94.700  10.462  11.303
  628    HB2  ARG  79           HB2      ARG  79  96.912  10.863  11.813
  629    HB3  ARG  79           HB1      ARG  79  97.492  10.205  10.288
  630    HG2  ARG  79           HG2      ARG  79  96.915  12.215   9.105
  631    HG3  ARG  79           HG1      ARG  79  96.028  12.850  10.487
  632    HD2  ARG  79           HD2      ARG  79  98.855  12.138  11.009
  633    HD3  ARG  79           HD1      ARG  79  98.605  13.507   9.934
  634    HE   ARG  79           HE       ARG  79  97.191  14.479  11.758
  635   HH11  ARG  79          HH21      ARG  79  99.565  12.041  12.465
  636   HH12  ARG  79          HH22      ARG  79  99.756  12.526  14.115
  637   HH21  ARG  79          HH11      ARG  79  97.450  15.104  13.913
  638   HH22  ARG  79          HH12      ARG  79  98.563  14.256  14.933
  639    H    ASP  80           HN       ASP  80  93.467  11.950  10.388
  640    HA   ASP  80           HA       ASP  80  92.230  13.039   8.815
  641    HB2  ASP  80           HB2      ASP  80  93.455  14.352   7.357
  642    HB3  ASP  80           HB1      ASP  80  94.655  13.929   8.572
  643    H    GLY  81           HN       GLY  81  91.639  10.349   8.594
  644    HA2  GLY  81           HA2      GLY  81  90.499   8.995   7.128
  645    HA3  GLY  81           HA1      GLY  81  90.675  10.258   5.918
  646    H    LEU  82           HN       LEU  82  93.634   9.329   7.276
  647    HA   LEU  82           HA       LEU  82  94.190   7.540   4.982
  648    HB2  LEU  82           HB2      LEU  82  96.139   9.371   6.413
  649    HB3  LEU  82           HB1      LEU  82  96.493   8.348   5.024
  650    HG   LEU  82           HG       LEU  82  94.578  10.696   5.094
  651   HD11  LEU  82          HD11      LEU  82  96.774  11.547   4.879
  652   HD12  LEU  82          HD12      LEU  82  96.202  11.430   3.214
  653   HD13  LEU  82          HD13      LEU  82  97.290  10.202   3.861
  654   HD21  LEU  82          HD21      LEU  82  94.624  10.129   2.516
  655   HD22  LEU  82          HD22      LEU  82  93.526   9.256   3.583
  656   HD23  LEU  82          HD23      LEU  82  95.045   8.511   3.078
  657    H    LEU  83           HN       LEU  83  95.200   5.613   5.413
  658    HA   LEU  83           HA       LEU  83  95.758   5.012   8.286
  659    HB2  LEU  83           HB2      LEU  83  94.594   3.120   6.260
  660    HB3  LEU  83           HB1      LEU  83  94.811   2.851   7.985
  661    HG   LEU  83           HG       LEU  83  93.040   5.017   6.825
  662   HD11  LEU  83          HD11      LEU  83  91.196   3.443   7.606
  663   HD12  LEU  83          HD12      LEU  83  92.435   2.201   7.760
  664   HD13  LEU  83          HD13      LEU  83  92.088   2.905   6.182
  665   HD21  LEU  83          HD21      LEU  83  92.079   4.816   9.206
  666   HD22  LEU  83          HD22      LEU  83  93.658   5.585   9.059
  667   HD23  LEU  83          HD23      LEU  83  93.538   3.909   9.598
  668    H    GLY  84           HN       GLY  84  97.685   4.038   8.664
  669    HA2  GLY  84           HA2      GLY  84  99.214   3.088   6.324
  670    HA3  GLY  84           HA1      GLY  84  99.922   3.697   7.811
  671    H    PHE  85           HN       PHE  85 100.465   1.188   6.630
  672    HA   PHE  85           HA       PHE  85  99.732  -0.538   8.884
  673    HB2  PHE  85           HB2      PHE  85  99.222  -1.135   5.970
  674    HB3  PHE  85           HB1      PHE  85  99.311  -2.389   7.201
  675    HD1  PHE  85           HD2      PHE  85  97.622  -2.562   8.959
  676    HD2  PHE  85           HD1      PHE  85  97.361   0.443   5.907
  677    HE1  PHE  85           HE2      PHE  85  95.265  -2.142   9.581
  678    HE2  PHE  85           HE1      PHE  85  94.996   0.857   6.529
  679    HZ   PHE  85           HZ       PHE  85  93.955  -0.426   8.367
  680    H    GLU  86           HN       GLU  86 101.311  -2.056   9.380
  681    HA   GLU  86           HA       GLU  86 103.823  -1.787   7.847
  682    HB2  GLU  86           HB2      GLU  86 103.821  -1.288  10.325
  683    HB3  GLU  86           HB1      GLU  86 103.409  -2.981  10.602
  684    HG2  GLU  86           HG2      GLU  86 105.451  -3.657   9.357
  685    HG3  GLU  86           HG1      GLU  86 105.879  -1.957   9.171
  686    H    CYS  87           HN       CYS  87 104.544  -3.485   6.695
  687    HA   CYS  87           HA       CYS  87 102.890  -5.752   6.309
  688    HB2  CYS  87           HB2      CYS  87 104.569  -4.611   4.692
  689    HB3  CYS  87           HB1      CYS  87 105.764  -5.660   5.455
  690    HG   CYS  87           HG       CYS  87 104.708  -7.677   4.402
  691    H    GLN  88           HN       GLN  88 102.696  -7.476   7.530
  692    HA   GLN  88           HA       GLN  88 104.819  -8.219   9.408
  693    HB2  GLN  88           HB2      GLN  88 102.122  -9.535   9.049
  694    HB3  GLN  88           HB1      GLN  88 103.196  -9.642  10.441
  695    HG2  GLN  88           HG2      GLN  88 102.053  -7.006   9.519
  696    HG3  GLN  88           HG1      GLN  88 101.187  -8.053  10.637
  697   HE21  GLN  88          HE21      GLN  88 102.993  -5.366  10.753
  698   HE22  GLN  88          HE22      GLN  88 103.843  -5.613  12.201
  699    H    HIS  89           HN       HIS  89 103.093  -9.417   6.574
  700    HA   HIS  89           HA       HIS  89 105.267 -11.143   5.861
  701    HB2  HIS  89           HB2      HIS  89 104.576 -13.084   6.765
  702    HB3  HIS  89           HB1      HIS  89 103.240 -12.235   7.540
  703    HD2  HIS  89           HD2      HIS  89 100.835 -13.272   6.714
  704    HE1  HIS  89           HE1      HIS  89 102.005 -14.550   2.855
  705    HE2  HIS  89           HE2      HIS  89 100.070 -14.443   4.504
  706    H    ILE  90           HN       ILE  90 105.173 -11.724   3.722
  707    HA   ILE  90           HA       ILE  90 102.737 -11.248   2.152
  708    HB   ILE  90           HB       ILE  90 103.811  -9.063   2.130
  709   HG12  ILE  90          HG12      ILE  90 104.385 -10.583  -0.435
  710   HG13  ILE  90          HG11      ILE  90 102.817  -9.927   0.023
  711   HG21  ILE  90          HG21      ILE  90 106.047  -9.560   2.771
  712   HG22  ILE  90          HG22      ILE  90 106.162  -8.946   1.125
  713   HG23  ILE  90          HG23      ILE  90 106.266 -10.679   1.430
  714   HD11  ILE  90          HD11      ILE  90 103.440  -8.011  -0.988
  715   HD12  ILE  90          HD12      ILE  90 105.101  -8.571  -1.158
  716   HD13  ILE  90          HD13      ILE  90 104.588  -7.777   0.329
  717    H    ASP  91           HN       ASP  91 102.549 -12.423   0.384
  718    HA   ASP  91           HA       ASP  91 103.930 -14.852   0.255
  719    HB2  ASP  91           HB2      ASP  91 101.994 -13.425  -1.492
  720    HB3  ASP  91           HB1      ASP  91 102.887 -14.764  -2.205
  721    H    LEU  92           HN       LEU  92 105.517 -15.661  -0.912
  722    HA   LEU  92           HA       LEU  92 107.710 -14.117  -1.678
  723    HB2  LEU  92           HB2      LEU  92 107.723 -16.596  -1.232
  724    HB3  LEU  92           HB1      LEU  92 107.036 -16.827  -2.839
  725    HG   LEU  92           HG       LEU  92 109.087 -15.277  -3.560
  726   HD11  LEU  92          HD11      LEU  92 111.061 -15.676  -2.194
  727   HD12  LEU  92          HD12      LEU  92 110.132 -16.687  -1.087
  728   HD13  LEU  92          HD13      LEU  92 109.808 -14.957  -1.184
  729   HD21  LEU  92          HD21      LEU  92 109.370 -18.214  -2.848
  730   HD22  LEU  92          HD22      LEU  92 110.380 -17.333  -3.995
  731   HD23  LEU  92          HD23      LEU  92 108.669 -17.585  -4.339
  732    H    ASP  93           HN       ASP  93 105.083 -15.392  -3.702
  733    HA   ASP  93           HA       ASP  93 106.148 -14.449  -6.170
  734    HB2  ASP  93           HB2      ASP  93 103.925 -14.902  -7.070
  735    HB3  ASP  93           HB1      ASP  93 104.421 -16.226  -6.018
  736    H    SER  94           HN       SER  94 103.993 -13.127  -3.729
  737    HA   SER  94           HA       SER  94 103.196 -10.799  -5.156
  738    HB2  SER  94           HB2      SER  94 101.820 -11.208  -3.336
  739    HB3  SER  94           HB1      SER  94 103.160 -11.703  -2.308
  740    HG   SER  94           HG       SER  94 103.791  -9.552  -2.156
  741    H    ILE  95           HN       ILE  95 105.848 -11.562  -2.970
  742    HA   ILE  95           HA       ILE  95 106.872  -8.985  -2.573
  743    HB   ILE  95           HB       ILE  95 108.181 -11.706  -2.612
  744   HG12  ILE  95          HG12      ILE  95 107.709  -9.753  -0.347
  745   HG13  ILE  95          HG11      ILE  95 106.560 -11.014  -0.786
  746   HG21  ILE  95          HG21      ILE  95 110.084 -10.409  -1.426
  747   HG22  ILE  95          HG22      ILE  95 109.391  -8.972  -2.178
  748   HG23  ILE  95          HG23      ILE  95 109.993 -10.291  -3.183
  749   HD11  ILE  95          HD11      ILE  95 108.590 -11.351   1.018
  750   HD12  ILE  95          HD12      ILE  95 109.344 -11.954  -0.457
  751   HD13  ILE  95          HD13      ILE  95 107.839 -12.667   0.118
  752    H    SER  96           HN       SER  96 107.351 -11.305  -5.193
  753    HA   SER  96           HA       SER  96 109.417  -9.789  -6.402
  754    HB2  SER  96           HB2      SER  96 108.444 -12.332  -6.783
  755    HB3  SER  96           HB1      SER  96 107.803 -11.502  -8.200
  756    HG   SER  96           HG       SER  96 110.121 -12.470  -8.091
  757    H    HIS  97           HN       HIS  97 105.908  -9.894  -6.924
  758    HA   HIS  97           HA       HIS  97 105.967  -8.232  -9.209
  759    HB2  HIS  97           HB2      HIS  97 103.853  -8.815  -7.139
  760    HB3  HIS  97           HB1      HIS  97 103.591  -7.600  -8.373
  761    HD2  HIS  97           HD2      HIS  97 103.562 -11.447  -8.030
  762    HE1  HIS  97           HE1      HIS  97 102.976 -10.532 -12.106
  763    HE2  HIS  97           HE2      HIS  97 102.934 -12.396 -10.382
  764    H    LEU  98           HN       LEU  98 106.023  -7.529  -5.763
  765    HA   LEU  98           HA       LEU  98 105.771  -4.669  -6.051
  766    HB2  LEU  98           HB2      LEU  98 106.845  -6.457  -3.860
  767    HB3  LEU  98           HB1      LEU  98 106.912  -4.699  -3.752
  768    HG   LEU  98           HG       LEU  98 104.385  -6.335  -4.142
  769   HD11  LEU  98          HD11      LEU  98 105.574  -6.429  -1.874
  770   HD12  LEU  98          HD12      LEU  98 103.896  -5.885  -1.854
  771   HD13  LEU  98          HD13      LEU  98 105.207  -4.712  -1.729
  772   HD21  LEU  98          HD21      LEU  98 103.741  -4.317  -5.044
  773   HD22  LEU  98          HD22      LEU  98 105.018  -3.421  -4.224
  774   HD23  LEU  98          HD23      LEU  98 103.559  -3.879  -3.347
  775    H    ARG  99           HN       ARG  99 108.449  -6.937  -6.207
  776    HA   ARG  99           HA       ARG  99 110.496  -4.948  -6.191
  777    HB2  ARG  99           HB2      ARG  99 110.311  -7.813  -6.631
  778    HB3  ARG  99           HB1      ARG  99 111.384  -7.079  -7.818
  779    HG2  ARG  99           HG2      ARG  99 112.734  -7.652  -5.915
  780    HG3  ARG  99           HG1      ARG  99 112.538  -5.900  -5.885
  781    HD2  ARG  99           HD2      ARG  99 110.446  -6.441  -4.386
  782    HD3  ARG  99           HD1      ARG  99 111.267  -7.976  -4.124
  783    HE   ARG  99           HE       ARG  99 111.981  -5.470  -2.970
  784   HH11  ARG  99          HH21      ARG  99 113.272  -8.379  -4.332
  785   HH12  ARG  99          HH22      ARG  99 114.746  -8.312  -3.425
  786   HH21  ARG  99          HH11      ARG  99 113.910  -5.377  -1.779
  787   HH22  ARG  99          HH12      ARG  99 115.109  -6.612  -1.981
  788    H    ARG 100           HN       ARG 100 108.547  -6.484  -8.684
  789    HA   ARG 100           HA       ARG 100 109.718  -5.363 -10.998
  790    HB2  ARG 100           HB2      ARG 100 107.011  -6.449 -10.302
  791    HB3  ARG 100           HB1      ARG 100 107.270  -5.671 -11.858
  792    HG2  ARG 100           HG2      ARG 100 109.328  -7.667 -11.053
  793    HG3  ARG 100           HG1      ARG 100 107.731  -8.320 -11.401
  794    HD2  ARG 100           HD2      ARG 100 108.377  -8.294 -13.573
  795    HD3  ARG 100           HD1      ARG 100 108.130  -6.555 -13.507
  796    HE   ARG 100           HE       ARG 100 110.457  -6.263 -13.403
  797   HH11  ARG 100          HH21      ARG 100 109.529  -9.586 -13.124
  798   HH12  ARG 100          HH22      ARG 100 111.129 -10.197 -13.378
  799   HH21  ARG 100          HH11      ARG 100 112.558  -7.058 -13.737
  800   HH22  ARG 100          HH12      ARG 100 112.843  -8.768 -13.724
  801    H    LEU 101           HN       LEU 101 107.057  -4.252  -8.925
  802    HA   LEU 101           HA       LEU 101 106.427  -1.939 -10.418
  803    HB2  LEU 101           HB2      LEU 101 105.849  -2.947  -7.678
  804    HB3  LEU 101           HB1      LEU 101 105.666  -1.214  -7.922
  805    HG   LEU 101           HG       LEU 101 104.032  -1.519  -9.633
  806   HD11  LEU 101          HD11      LEU 101 104.692  -3.223 -11.050
  807   HD12  LEU 101          HD12      LEU 101 103.444  -4.074 -10.146
  808   HD13  LEU 101          HD13      LEU 101 105.140  -4.296  -9.727
  809   HD21  LEU 101          HD21      LEU 101 103.682  -3.355  -7.263
  810   HD22  LEU 101          HD22      LEU 101 102.416  -3.211  -8.479
  811   HD23  LEU 101          HD23      LEU 101 102.929  -1.790  -7.572
  812    H    VAL 102           HN       VAL 102 108.748  -2.573  -7.861
  813    HA   VAL 102           HA       VAL 102 109.507   0.130  -7.390
  814    HB   VAL 102           HB       VAL 102 110.971  -2.480  -6.938
  815   HG11  VAL 102          HG11      VAL 102 111.638   0.372  -6.184
  816   HG12  VAL 102          HG12      VAL 102 112.661  -0.808  -7.006
  817   HG13  VAL 102          HG13      VAL 102 112.288  -1.005  -5.293
  818   HG21  VAL 102          HG21      VAL 102 109.986  -2.541  -4.857
  819   HG22  VAL 102          HG22      VAL 102 108.719  -1.647  -5.694
  820   HG23  VAL 102          HG23      VAL 102 109.911  -0.786  -4.720
  821    H    GLU 103           HN       GLU 103 110.902  -2.468  -9.375
  822    HA   GLU 103           HA       GLU 103 113.073  -0.960 -10.380
  823    HB2  GLU 103           HB2      GLU 103 113.046  -3.401 -10.459
  824    HB3  GLU 103           HB1      GLU 103 111.675  -3.364 -11.570
  825    HG2  GLU 103           HG2      GLU 103 112.973  -2.352 -13.296
  826    HG3  GLU 103           HG1      GLU 103 114.288  -1.974 -12.183
  827    H    LEU 104           HN       LEU 104 109.792  -1.514 -11.630
  828    HA   LEU 104           HA       LEU 104 110.300  -0.120 -14.086
  829    HB2  LEU 104           HB2      LEU 104 107.669  -0.856 -12.778
  830    HB3  LEU 104           HB1      LEU 104 107.869  -0.308 -14.442
  831    HG   LEU 104           HG       LEU 104 109.454  -2.675 -13.479
  832   HD11  LEU 104          HD11      LEU 104 106.598  -2.799 -14.495
  833   HD12  LEU 104          HD12      LEU 104 107.086  -3.099 -12.826
  834   HD13  LEU 104          HD13      LEU 104 107.630  -4.177 -14.111
  835   HD21  LEU 104          HD21      LEU 104 109.265  -3.310 -15.847
  836   HD22  LEU 104          HD22      LEU 104 109.876  -1.663 -15.713
  837   HD23  LEU 104          HD23      LEU 104 108.190  -1.944 -16.143
  838    H    ASN 105           HN       ASN 105 108.707   0.734 -11.017
  839    HA   ASN 105           HA       ASN 105 107.789   3.273 -11.806
  840    HB2  ASN 105           HB2      ASN 105 108.531   2.126  -9.116
  841    HB3  ASN 105           HB1      ASN 105 107.900   3.761  -9.304
  842   HD21  ASN 105          HD21      ASN 105 105.989   3.343 -11.358
  843   HD22  ASN 105          HD22      ASN 105 104.772   2.313 -10.772
  844    H    LEU 106           HN       LEU 106 110.922   2.173 -10.642
  845    HA   LEU 106           HA       LEU 106 112.075   4.666 -10.059
  846    HB2  LEU 106           HB2      LEU 106 113.033   2.348  -9.591
  847    HB3  LEU 106           HB1      LEU 106 113.562   2.338 -11.272
  848    HG   LEU 106           HG       LEU 106 114.718   4.547 -10.824
  849   HD11  LEU 106          HD11      LEU 106 113.650   3.925  -8.098
  850   HD12  LEU 106          HD12      LEU 106 113.864   5.485  -8.893
  851   HD13  LEU 106          HD13      LEU 106 115.255   4.649  -8.204
  852   HD21  LEU 106          HD21      LEU 106 115.912   2.367 -10.876
  853   HD22  LEU 106          HD22      LEU 106 115.617   2.183  -9.147
  854   HD23  LEU 106          HD23      LEU 106 116.644   3.490  -9.731
  855    H    GLY 107           HN       GLY 107 111.772   2.887 -13.099
  856    HA2  GLY 107           HA2      GLY 107 111.700   3.754 -15.259
  857    HA3  GLY 107           HA1      GLY 107 112.104   5.341 -14.611
  858    H    ASP 108           HN       ASP 108 113.951   2.453 -13.888
  859    HA   ASP 108           HA       ASP 108 115.937   2.855 -15.914
  860    HB2  ASP 108           HB2      ASP 108 116.333   4.763 -14.262
  861    HB3  ASP 108           HB1      ASP 108 116.816   3.523 -13.106
  862    H    GLU 109           HN       GLU 109 118.099   1.668 -14.920
  863    HA   GLU 109           HA       GLU 109 117.455  -0.618 -13.277
  864    HB2  GLU 109           HB2      GLU 109 118.116  -2.260 -15.083
  865    HB3  GLU 109           HB1      GLU 109 116.541  -1.502 -15.298
  866    HG2  GLU 109           HG2      GLU 109 117.316  -1.079 -17.406
  867    HG3  GLU 109           HG1      GLU 109 118.120   0.282 -16.630
  868    H    GLU 110           HN       GLU 110 119.519  -2.291 -13.932
  869    HA   GLU 110           HA       GLU 110 121.752  -2.610 -13.501
  870    HB2  GLU 110           HB2      GLU 110 121.712  -0.151 -15.219
  871    HB3  GLU 110           HB1      GLU 110 123.234  -0.655 -14.487
  872    HG2  GLU 110           HG2      GLU 110 123.173  -2.775 -15.571
  873    HG3  GLU 110           HG1      GLU 110 121.485  -2.571 -16.038
  874    H    LEU 111           HN       LEU 111 120.258  -1.573 -11.403
  875    HA   LEU 111           HA       LEU 111 122.329  -0.065  -9.967
  876    HB2  LEU 111           HB2      LEU 111 120.057   1.196 -10.905
  877    HB3  LEU 111           HB1      LEU 111 119.580   0.747  -9.271
  878    HG   LEU 111           HG       LEU 111 120.610   2.995  -9.340
  879   HD11  LEU 111          HD11      LEU 111 120.857   1.869  -7.261
  880   HD12  LEU 111          HD12      LEU 111 122.452   2.519  -7.635
  881   HD13  LEU 111          HD13      LEU 111 122.116   0.809  -7.892
  882   HD21  LEU 111          HD21      LEU 111 123.341   1.947  -9.816
  883   HD22  LEU 111          HD22      LEU 111 122.602   3.456 -10.348
  884   HD23  LEU 111          HD23      LEU 111 122.295   1.965 -11.236
  885    H    LEU 112           HN       LEU 112 122.910  -1.558  -8.509
  886    HA   LEU 112           HA       LEU 112 121.024  -3.415  -7.367
  887    HB2  LEU 112           HB2      LEU 112 123.952  -2.852  -6.908
  888    HB3  LEU 112           HB1      LEU 112 123.062  -4.009  -5.920
  889    HG   LEU 112           HG       LEU 112 124.241  -5.059  -7.870
  890   HD11  LEU 112          HD11      LEU 112 122.572  -6.614  -8.164
  891   HD12  LEU 112          HD12      LEU 112 121.336  -5.395  -8.471
  892   HD13  LEU 112          HD13      LEU 112 121.857  -5.727  -6.820
  893   HD21  LEU 112          HD21      LEU 112 122.152  -3.732  -9.601
  894   HD22  LEU 112          HD22      LEU 112 123.612  -4.584 -10.101
  895   HD23  LEU 112          HD23      LEU 112 123.734  -2.996  -9.346
  896    H    GLU 113           HN       GLU 113 123.174  -2.481  -4.985
  897    HA   GLU 113           HA       GLU 113 121.009  -1.296  -3.416
  898    HB2  GLU 113           HB2      GLU 113 123.805  -2.168  -2.646
  899    HB3  GLU 113           HB1      GLU 113 122.594  -1.548  -1.523
  900    HG2  GLU 113           HG2      GLU 113 121.059  -3.410  -2.425
  901    HG3  GLU 113           HG1      GLU 113 122.521  -4.108  -3.122
  902    H    ARG 114           HN       ARG 114 123.847  -0.265  -2.110
  903    HA   ARG 114           HA       ARG 114 124.778   1.818  -1.835
  904    HB2  ARG 114           HB2      ARG 114 124.268   1.872  -4.818
  905    HB3  ARG 114           HB1      ARG 114 125.219   3.082  -3.956
  906    HG2  ARG 114           HG2      ARG 114 126.762   1.331  -3.173
  907    HG3  ARG 114           HG1      ARG 114 125.806   0.107  -4.006
  908    HD2  ARG 114           HD2      ARG 114 126.414   2.179  -5.889
  909    HD3  ARG 114           HD1      ARG 114 127.908   1.722  -5.076
  910    HE   ARG 114           HE       ARG 114 127.764  -0.382  -6.075
  911   HH11  ARG 114          HH21      ARG 114 124.841   1.429  -6.466
  912   HH12  ARG 114          HH22      ARG 114 124.148   0.325  -7.606
  913   HH21  ARG 114          HH11      ARG 114 126.860  -1.833  -7.569
  914   HH22  ARG 114          HH12      ARG 114 125.290  -1.520  -8.230
  915    H    GLU 115           HN       GLU 115 123.601   3.194  -0.643
  916    HA   GLU 115           HA       GLU 115 121.086   4.265  -1.721
  917    HB2  GLU 115           HB2      GLU 115 122.104   4.868   1.034
  918    HB3  GLU 115           HB1      GLU 115 120.443   4.692   0.468
  919    HG2  GLU 115           HG2      GLU 115 122.478   2.479   0.838
  920    HG3  GLU 115           HG1      GLU 115 121.015   2.738   1.786
  921    H    LEU 116           HN       LEU 116 124.301   5.243  -0.742
  922    HA   LEU 116           HA       LEU 116 123.860   8.048  -0.683
  923    HB2  LEU 116           HB2      LEU 116 125.972   6.336  -0.115
  924    HB3  LEU 116           HB1      LEU 116 126.548   7.234  -1.516
  925    HG   LEU 116           HG       LEU 116 125.349   8.550   0.940
  926   HD11  LEU 116          HD11      LEU 116 127.487   7.303   1.406
  927   HD12  LEU 116          HD12      LEU 116 127.615   9.046   1.636
  928   HD13  LEU 116          HD13      LEU 116 128.274   8.298   0.181
  929   HD21  LEU 116          HD21      LEU 116 125.287   9.801  -1.241
  930   HD22  LEU 116          HD22      LEU 116 127.043   9.668  -1.318
  931   HD23  LEU 116          HD23      LEU 116 126.284  10.585  -0.017
  932    H    ALA 117           HN       ALA 117 124.785   5.800  -3.260
  933    HA   ALA 117           HA       ALA 117 125.315   7.837  -5.178
  934    HB1  ALA 117           HB1      ALA 117 124.552   5.003  -5.876
  935    HB2  ALA 117           HB2      ALA 117 126.137   5.379  -5.198
  936    HB3  ALA 117           HB3      ALA 117 125.644   6.090  -6.736
  937    H    LEU 118           HN       LEU 118 122.410   6.351  -4.057
  938    HA   LEU 118           HA       LEU 118 120.772   6.568  -6.294
  939    HB2  LEU 118           HB2      LEU 118 120.141   6.974  -3.369
  940    HB3  LEU 118           HB1      LEU 118 118.901   6.952  -4.620
  941    HG   LEU 118           HG       LEU 118 120.881   4.712  -4.129
  942   HD11  LEU 118          HD11      LEU 118 119.089   5.195  -2.322
  943   HD12  LEU 118          HD12      LEU 118 119.186   3.554  -2.958
  944   HD13  LEU 118          HD13      LEU 118 117.925   4.648  -3.528
  945   HD21  LEU 118          HD21      LEU 118 120.229   4.382  -6.329
  946   HD22  LEU 118          HD22      LEU 118 118.684   5.205  -6.107
  947   HD23  LEU 118          HD23      LEU 118 118.901   3.560  -5.511
  948    H    LEU 119           HN       LEU 119 121.720   9.134  -3.998
  949    HA   LEU 119           HA       LEU 119 119.939  11.089  -4.840
  950    HB2  LEU 119           HB2      LEU 119 122.705  11.173  -3.679
  951    HB3  LEU 119           HB1      LEU 119 121.967  12.671  -4.241
  952    HG   LEU 119           HG       LEU 119 121.608  12.051  -1.766
  953   HD11  LEU 119          HD11      LEU 119 119.070  12.436  -3.369
  954   HD12  LEU 119          HD12      LEU 119 120.255  13.717  -3.124
  955   HD13  LEU 119          HD13      LEU 119 119.420  13.014  -1.742
  956   HD21  LEU 119          HD21      LEU 119 121.034   9.615  -2.477
  957   HD22  LEU 119          HD22      LEU 119 119.426  10.261  -2.814
  958   HD23  LEU 119          HD23      LEU 119 120.103  10.369  -1.191
  959    H    VAL 120           HN       VAL 120 122.489   9.638  -6.577
  960    HA   VAL 120           HA       VAL 120 123.367  11.599  -8.351
  961    HB   VAL 120           HB       VAL 120 122.844   8.656  -8.754
  962   HG11  VAL 120          HG11      VAL 120 122.922   9.421 -10.962
  963   HG12  VAL 120          HG12      VAL 120 124.626   9.116 -10.632
  964   HG13  VAL 120          HG13      VAL 120 123.998  10.762 -10.565
  965   HG21  VAL 120          HG21      VAL 120 124.600   9.696  -7.067
  966   HG22  VAL 120          HG22      VAL 120 125.523  10.005  -8.538
  967   HG23  VAL 120          HG23      VAL 120 125.070   8.355  -8.111
  968    H    SER 121           HN       SER 121 120.222  10.752  -7.795
  969    HA   SER 121           HA       SER 121 119.321  11.131 -10.580
  970    HB2  SER 121           HB2      SER 121 117.316  10.093  -9.984
  971    HB3  SER 121           HB1      SER 121 118.493   9.218  -9.009
  972    HG   SER 121           HG       SER 121 117.832  11.316  -7.608
  973    H    ALA 122           HN       ALA 122 119.204  12.505  -7.355
  974    HA   ALA 122           HA       ALA 122 118.577  15.112  -8.362
  975    HB1  ALA 122           HB1      ALA 122 116.323  13.953  -8.363
  976    HB2  ALA 122           HB2      ALA 122 116.412  15.423  -7.392
  977    HB3  ALA 122           HB3      ALA 122 116.468  13.843  -6.609
  978    H    HIS 123           HN       HIS 123 119.981  16.230  -7.163
  979    HA   HIS 123           HA       HIS 123 120.889  15.401  -4.606
  980    HB2  HIS 123           HB2      HIS 123 122.219  17.358  -4.606
  981    HB3  HIS 123           HB1      HIS 123 122.103  16.888  -6.301
  982    HD2  HIS 123           HD2      HIS 123 120.091  18.477  -7.778
  983    HE1  HIS 123           HE1      HIS 123 120.249  21.669  -5.020
  984    HE2  HIS 123           HE2      HIS 123 119.446  20.966  -7.325
  985    H    ASP 124           HN       ASP 124 118.885  18.209  -5.537
  986    HA   ASP 124           HA       ASP 124 117.366  19.456  -4.350
  987    HB2  ASP 124           HB2      ASP 124 115.690  18.260  -3.286
  988    HB3  ASP 124           HB1      ASP 124 116.412  17.007  -4.291
  989    H    ASP 125           HN       ASP 125 120.149  18.320  -3.008
  990    HA   ASP 125           HA       ASP 125 120.067  18.679  -0.293
  991    HB2  ASP 125           HB2      ASP 125 122.189  19.463  -2.289
  992    HB3  ASP 125           HB1      ASP 125 122.430  19.598  -0.548
  993   H5'1  C2E 501          H5'1      C2E 501 105.279   3.361  10.499
  994   H5'2  C2E 501          H5'2      C2E 501 104.625   1.942  11.336
  995    H4'  C2E 501           H4'      C2E 501 106.938   0.854  10.637
  996    H3'  C2E 501           H3'      C2E 501 106.772   3.271   8.865
  997    H2'  C2E 501           H2'      C2E 501 106.966   2.097   6.868
  998   HO2'  C2E 501          HO2'      C2E 501 108.747   0.766   7.662
  999    H1'  C2E 501           H1'      C2E 501 105.393  -0.030   7.408
 1000    H8   C2E 501           H8       C2E 501 103.513   2.474   9.338
 1001    HN1  C2E 501           HN1      C2E 501 103.041   3.579   3.051
 1002   HN21  C2E 501          HN21      C2E 501 104.564   2.394   1.956
 1003   HN22  C2E 501          HN22      C2E 501 105.691   1.333   2.773
 1004   H511  C2E 501          H511      C2E 501 108.016   4.680  10.197
 1005   H512  C2E 501          H512      C2E 501 109.698   4.746  10.764
 1006    H4A  C2E 501           H4A      C2E 501 108.824   5.507  13.008
 1007    H3A  C2E 501           H3A      C2E 501 106.145   5.467  11.590
 1008    H2A  C2E 501           H2A      C2E 501 105.553   7.458  12.589
 1009   HO2A  C2E 501          HO2A      C2E 501 106.712   6.611  14.667
 1010    H1A  C2E 501           H1A      C2E 501 107.934   8.778  12.330
 1011    H81  C2E 501           H81      C2E 501 107.779   6.741   9.225
 1012   HN11  C2E 501          HN11      C2E 501 103.873  11.805   8.899
 1013   HN24  C2E 501          HN24      C2E 501 104.476  12.121  12.322
 1014   HN23  C2E 501          HN23      C2E 501 103.661  12.739  10.900
 1015   H5'1  C2E 502          H5'1      C2E 502 102.705  10.822   5.241
 1016   H5'2  C2E 502          H5'2      C2E 502 101.646   9.604   4.499
 1017    H4'  C2E 502           H4'      C2E 502  99.835  11.128   5.804
 1018    H3'  C2E 502           H3'      C2E 502 102.324  11.798   7.168
 1019    H2'  C2E 502           H2'      C2E 502 102.082  10.584   9.101
 1020   HO2'  C2E 502          HO2'      C2E 502 100.043  10.438  10.140
 1021    H1'  C2E 502           H1'      C2E 502 100.110   8.725   8.554
 1022    H8   C2E 502           H8       C2E 502 102.710   8.144   5.965
 1023    HN1  C2E 502           HN1      C2E 502 104.158   5.796  11.741
 1024   HN21  C2E 502          HN21      C2E 502 102.782   6.605  13.260
 1025   HN22  C2E 502          HN22      C2E 502 101.502   7.732  12.863
 1026   H511  C2E 502          H511      C2E 502 103.728  14.982   7.098
 1027   H512  C2E 502          H512      C2E 502 102.690  16.136   6.241
 1028    H4A  C2E 502           H4A      C2E 502 103.686  15.722   4.239
 1029    H3A  C2E 502           H3A      C2E 502 103.778  12.803   5.064
 1030    H2A  C2E 502           H2A      C2E 502 105.428  12.463   3.382
 1031   HO2A  C2E 502          HO2A      C2E 502 105.940  14.654   2.189
 1032    H1A  C2E 502           H1A      C2E 502 106.905  14.673   4.007
 1033    H81  C2E 502           H81      C2E 502 105.790  13.657   7.367
 1034   HN11  C2E 502          HN11      C2E 502 109.664   9.267   4.797
 1035   HN24  C2E 502          HN24      C2E 502 109.962   9.684   2.636
 1036   HN23  C2E 502          HN23      C2E 502 109.216  11.049   1.836
  Start of MODEL    4
    1    H    MET   1           H        MET   1 114.498  24.301   1.152
    2    HA   MET   1           HA       MET   1 112.049  25.354   0.055
    3    HB2  MET   1           HB2      MET   1 113.457  22.968  -1.149
    4    HB3  MET   1           HB1      MET   1 111.700  23.115  -1.180
    5    HG2  MET   1           HG2      MET   1 113.486  25.346  -2.154
    6    HG3  MET   1           HG1      MET   1 112.984  24.032  -3.217
    7    HE1  MET   1           HE1      MET   1 111.931  27.645  -2.976
    8    HE2  MET   1           HE2      MET   1 110.988  27.052  -4.341
    9    HE3  MET   1           HE3      MET   1 112.643  26.490  -4.113
   10    H    SER   2           HN       SER   2 110.288  23.822   0.701
   11    HA   SER   2           HA       SER   2 110.766  22.885   3.388
   12    HB2  SER   2           HB2      SER   2 108.281  22.673   1.673
   13    HB3  SER   2           HB1      SER   2 108.370  22.399   3.411
   14    HG   SER   2           HG       SER   2 109.166  24.603   3.543
   15    H    ASP   3           HN       ASP   3 112.262  21.491   1.359
   16    HA   ASP   3           HA       ASP   3 111.001  18.925   0.920
   17    HB2  ASP   3           HB2      ASP   3 113.915  19.630   0.566
   18    HB3  ASP   3           HB1      ASP   3 113.013  18.335  -0.217
   19    H    GLN   4           HN       GLN   4 111.583  20.062   3.688
   20    HA   GLN   4           HA       GLN   4 113.220  17.826   4.727
   21    HB2  GLN   4           HB2      GLN   4 114.071  20.091   5.215
   22    HB3  GLN   4           HB1      GLN   4 112.559  20.479   6.030
   23    HG2  GLN   4           HG2      GLN   4 114.100  18.036   6.866
   24    HG3  GLN   4           HG1      GLN   4 114.623  19.622   7.430
   25   HE21  GLN   4          HE21      GLN   4 113.033  17.147   8.658
   26   HE22  GLN   4          HE22      GLN   4 111.789  17.924   9.515
   27    H    HIS   5           HN       HIS   5 110.107  19.050   4.433
   28    HA   HIS   5           HA       HIS   5 108.453  18.828   6.372
   29    HB2  HIS   5           HB2      HIS   5 107.200  16.899   5.102
   30    HB3  HIS   5           HB1      HIS   5 107.379  18.488   4.361
   31    HD2  HIS   5           HD2      HIS   5 110.554  16.224   4.337
   32    HE1  HIS   5           HE1      HIS   5 108.935  16.190   0.437
   33    HE2  HIS   5           HE2      HIS   5 110.929  15.507   1.853
   34    H    ASP   6           HN       ASP   6 109.928  18.056   8.121
   35    HA   ASP   6           HA       ASP   6 110.904  16.295   9.393
   36    HB2  ASP   6           HB2      ASP   6 107.920  15.878   9.629
   37    HB3  ASP   6           HB1      ASP   6 109.142  15.510  10.846
   38    H    GLU   7           HN       GLU   7 111.930  14.793   8.026
   39    HA   GLU   7           HA       GLU   7 110.284  12.621   6.952
   40    HB2  GLU   7           HB2      GLU   7 111.743  13.202   5.265
   41    HB3  GLU   7           HB1      GLU   7 113.022  13.653   6.390
   42    HG2  GLU   7           HG2      GLU   7 113.675  11.416   6.748
   43    HG3  GLU   7           HG1      GLU   7 112.156  10.780   6.128
   44    H    ARG   8           HN       ARG   8 110.085  10.736   7.949
   45    HA   ARG   8           HA       ARG   8 112.066  10.026  10.033
   46    HB2  ARG   8           HB2      ARG   8 109.067   9.825  10.080
   47    HB3  ARG   8           HB1      ARG   8 110.091   8.857  11.128
   48    HG2  ARG   8           HG2      ARG   8 109.606  10.743  12.445
   49    HG3  ARG   8           HG1      ARG   8 111.212  11.077  11.808
   50    HD2  ARG   8           HD2      ARG   8 109.345  12.928  11.721
   51    HD3  ARG   8           HD1      ARG   8 110.444  12.734  10.369
   52    HE   ARG   8           HE       ARG   8 108.525  11.251   9.443
   53   HH11  ARG   8          HH21      ARG   8 108.145  14.036  11.477
   54   HH12  ARG   8          HH22      ARG   8 106.637  14.509  10.771
   55   HH21  ARG   8          HH11      ARG   8 106.557  11.890   8.512
   56   HH22  ARG   8          HH12      ARG   8 105.741  13.300   9.099
   57    H    ARG   9           HN       ARG   9 110.715   9.113   7.098
   58    HA   ARG   9           HA       ARG   9 111.216   6.243   7.648
   59    HB2  ARG   9           HB2      ARG   9 109.914   6.108   5.300
   60    HB3  ARG   9           HB1      ARG   9 109.081   6.093   6.850
   61    HG2  ARG   9           HG2      ARG   9 108.909   8.615   6.661
   62    HG3  ARG   9           HG1      ARG   9 109.489   8.447   5.007
   63    HD2  ARG   9           HD2      ARG   9 107.581   7.213   4.346
   64    HD3  ARG   9           HD1      ARG   9 107.120   6.879   6.009
   65    HE   ARG   9           HE       ARG   9 106.474   9.229   6.220
   66   HH11  ARG   9          HH21      ARG   9 107.104   8.043   3.012
   67   HH12  ARG   9          HH22      ARG   9 106.152   9.264   2.239
   68   HH21  ARG   9          HH11      ARG   9 105.230  10.813   5.196
   69   HH22  ARG   9          HH12      ARG   9 105.095  10.827   3.470
   70    H    ARG  10           HN       ARG  10 113.412   6.497   7.405
   71    HA   ARG  10           HA       ARG  10 115.376   7.129   6.200
   72    HB2  ARG  10           HB2      ARG  10 115.487   5.091   4.437
   73    HB3  ARG  10           HB1      ARG  10 115.716   4.880   6.168
   74    HG2  ARG  10           HG2      ARG  10 112.907   4.780   5.134
   75    HG3  ARG  10           HG1      ARG  10 113.952   3.403   4.805
   76    HD2  ARG  10           HD2      ARG  10 114.311   2.970   7.098
   77    HD3  ARG  10           HD1      ARG  10 113.728   4.560   7.580
   78    HE   ARG  10           HE       ARG  10 111.502   3.575   6.523
   79   HH11  ARG  10          HH21      ARG  10 113.883   2.076   8.549
   80   HH12  ARG  10          HH22      ARG  10 112.773   0.940   9.239
   81   HH21  ARG  10          HH11      ARG  10 110.053   2.085   7.418
   82   HH22  ARG  10          HH12      ARG  10 110.605   0.944   8.598
   83    H    PHE  11           HN       PHE  11 113.824   5.697   3.387
   84    HA   PHE  11           HA       PHE  11 114.153   8.283   1.978
   85    HB2  PHE  11           HB2      PHE  11 114.783   5.470   1.211
   86    HB3  PHE  11           HB1      PHE  11 114.173   6.534  -0.055
   87    HD1  PHE  11           HD1      PHE  11 116.532   6.856   2.859
   88    HD2  PHE  11           HD2      PHE  11 115.838   7.562  -1.324
   89    HE1  PHE  11           HE1      PHE  11 118.772   7.904   2.662
   90    HE2  PHE  11           HE2      PHE  11 118.080   8.610  -1.516
   91    HZ   PHE  11           HZ       PHE  11 119.544   8.779   0.475
   92    H    HIS  12           HN       HIS  12 112.719   8.423  -0.013
   93    HA   HIS  12           HA       HIS  12 110.010   8.306   0.787
   94    HB2  HIS  12           HB2      HIS  12 111.074   8.543  -2.037
   95    HB3  HIS  12           HB1      HIS  12 109.488   9.051  -1.455
   96    HD2  HIS  12           HD2      HIS  12 113.238  10.022  -0.451
   97    HE1  HIS  12           HE1      HIS  12 110.780  13.444  -0.201
   98    HE2  HIS  12           HE2      HIS  12 113.150  12.578   0.073
   99    H    ARG  13           HN       ARG  13 108.356   6.917   0.262
  100    HA   ARG  13           HA       ARG  13 109.161   4.217  -0.480
  101    HB2  ARG  13           HB2      ARG  13 106.310   5.019   0.039
  102    HB3  ARG  13           HB1      ARG  13 107.129   3.504   0.402
  103    HG2  ARG  13           HG2      ARG  13 108.208   4.382   2.297
  104    HG3  ARG  13           HG1      ARG  13 107.988   6.050   1.771
  105    HD2  ARG  13           HD2      ARG  13 105.667   4.251   2.466
  106    HD3  ARG  13           HD1      ARG  13 106.460   5.276   3.656
  107    HE   ARG  13           HE       ARG  13 105.681   6.755   1.325
  108   HH11  ARG  13          HH21      ARG  13 104.584   5.322   4.274
  109   HH12  ARG  13          HH22      ARG  13 103.240   6.398   4.460
  110   HH21  ARG  13          HH11      ARG  13 103.916   8.171   1.559
  111   HH22  ARG  13          HH12      ARG  13 102.861   8.011   2.924
  112    H    ILE  14           HN       ILE  14 107.797   2.998  -2.054
  113    HA   ILE  14           HA       ILE  14 107.719   4.403  -4.553
  114    HB   ILE  14           HB       ILE  14 106.856   1.624  -3.754
  115   HG12  ILE  14          HG12      ILE  14 108.884   1.002  -5.073
  116   HG13  ILE  14          HG11      ILE  14 109.235   2.715  -5.291
  117   HG21  ILE  14          HG21      ILE  14 107.007   1.360  -6.368
  118   HG22  ILE  14          HG22      ILE  14 106.695   3.096  -6.370
  119   HG23  ILE  14          HG23      ILE  14 105.529   1.991  -5.643
  120   HD11  ILE  14          HD11      ILE  14 108.829   1.630  -2.516
  121   HD12  ILE  14          HD12      ILE  14 109.769   3.028  -3.040
  122   HD13  ILE  14          HD13      ILE  14 110.378   1.399  -3.324
  123    H    ALA  15           HN       ALA  15 106.192   6.000  -4.543
  124    HA   ALA  15           HA       ALA  15 103.452   5.330  -3.746
  125    HB1  ALA  15           HB1      ALA  15 103.069   7.794  -4.161
  126    HB2  ALA  15           HB2      ALA  15 104.803   7.934  -4.449
  127    HB3  ALA  15           HB3      ALA  15 104.212   7.416  -2.871
  128    H    PHE  16           HN       PHE  16 102.056   4.660  -5.129
  129    HA   PHE  16           HA       PHE  16 101.842   5.839  -7.767
  130    HB2  PHE  16           HB2      PHE  16 101.929   3.804  -9.006
  131    HB3  PHE  16           HB1      PHE  16 103.383   3.840  -8.014
  132    HD1  PHE  16           HD2      PHE  16 102.609   2.950  -5.399
  133    HD2  PHE  16           HD1      PHE  16 101.142   1.627  -9.215
  134    HE1  PHE  16           HE2      PHE  16 101.989   0.771  -4.408
  135    HE2  PHE  16           HE1      PHE  16 100.534  -0.559  -8.219
  136    HZ   PHE  16           HZ       PHE  16 100.965  -0.988  -5.817
  137    H    ASP  17           HN       ASP  17  99.701   5.405  -8.708
  138    HA   ASP  17           HA       ASP  17  97.768   4.934  -6.562
  139    HB2  ASP  17           HB2      ASP  17  97.480   6.973  -7.852
  140    HB3  ASP  17           HB1      ASP  17  97.427   6.050  -9.353
  141    H    ALA  18           HN       ALA  18  96.096   3.439  -6.703
  142    HA   ALA  18           HA       ALA  18  95.474   1.835  -8.897
  143    HB1  ALA  18           HB1      ALA  18  96.485  -0.342  -8.019
  144    HB2  ALA  18           HB2      ALA  18  97.538   0.665  -7.022
  145    HB3  ALA  18           HB3      ALA  18  97.614   0.781  -8.781
  146    H    ASP  19           HN       ASP  19  94.388  -0.309  -8.053
  147    HA   ASP  19           HA       ASP  19  92.616   0.556  -5.864
  148    HB2  ASP  19           HB2      ASP  19  91.645  -0.183  -8.052
  149    HB3  ASP  19           HB1      ASP  19  92.298  -1.790  -7.751
  150    H    SER  20           HN       SER  20  92.531  -0.431  -3.929
  151    HA   SER  20           HA       SER  20  93.904  -3.022  -3.610
  152    HB2  SER  20           HB2      SER  20  95.526  -1.505  -2.765
  153    HB3  SER  20           HB1      SER  20  94.300  -0.527  -1.958
  154    HG   SER  20           HG       SER  20  95.599  -2.745  -1.100
  155    H    GLU  21           HN       GLU  21  93.148  -4.283  -1.884
  156    HA   GLU  21           HA       GLU  21  90.564  -3.424  -0.692
  157    HB2  GLU  21           HB2      GLU  21  91.239  -6.133  -1.886
  158    HB3  GLU  21           HB1      GLU  21  89.796  -5.791  -0.931
  159    HG2  GLU  21           HG2      GLU  21  89.143  -4.051  -2.569
  160    HG3  GLU  21           HG1      GLU  21  90.560  -4.447  -3.538
  161    H    ILE  22           HN       ILE  22  90.091  -4.443   1.356
  162    HA   ILE  22           HA       ILE  22  92.394  -5.793   2.596
  163    HB   ILE  22           HB       ILE  22  91.009  -3.342   3.690
  164   HG12  ILE  22          HG12      ILE  22  93.836  -3.940   2.766
  165   HG13  ILE  22          HG11      ILE  22  92.689  -2.840   2.005
  166   HG21  ILE  22          HG21      ILE  22  93.191  -5.052   4.934
  167   HG22  ILE  22          HG22      ILE  22  91.506  -5.050   5.453
  168   HG23  ILE  22          HG23      ILE  22  92.484  -3.596   5.630
  169   HD11  ILE  22          HD11      ILE  22  94.043  -2.534   4.689
  170   HD12  ILE  22          HD12      ILE  22  92.660  -1.553   4.206
  171   HD13  ILE  22          HD13      ILE  22  94.162  -1.470   3.289
  172    H    LEU  23           HN       LEU  23  91.912  -7.359   3.968
  173    HA   LEU  23           HA       LEU  23  89.067  -7.781   4.739
  174    HB2  LEU  23           HB2      LEU  23  90.849 -10.125   4.379
  175    HB3  LEU  23           HB1      LEU  23  89.126  -9.941   4.044
  176    HG   LEU  23           HG       LEU  23  90.035  -8.254   2.197
  177   HD11  LEU  23          HD11      LEU  23  92.166  -8.742   1.360
  178   HD12  LEU  23          HD12      LEU  23  92.245 -10.294   2.194
  179   HD13  LEU  23          HD13      LEU  23  92.418  -8.796   3.101
  180   HD21  LEU  23          HD21      LEU  23  88.672 -10.272   1.767
  181   HD22  LEU  23          HD22      LEU  23  90.117 -11.274   1.903
  182   HD23  LEU  23          HD23      LEU  23  89.966 -10.120   0.578
  183    H    GLN  24           HN       GLN  24  88.720  -7.975   6.770
  184    HA   GLN  24           HA       GLN  24  90.881  -8.960   8.550
  185    HB2  GLN  24           HB2      GLN  24  90.632  -6.451   8.672
  186    HB3  GLN  24           HB1      GLN  24  88.994  -6.703   9.270
  187    HG2  GLN  24           HG2      GLN  24  91.070  -8.282  10.675
  188    HG3  GLN  24           HG1      GLN  24  91.217  -6.538  10.876
  189   HE21  GLN  24          HE21      GLN  24  90.324  -6.160  12.926
  190   HE22  GLN  24          HE22      GLN  24  88.788  -6.693  13.412
  191    H    GLY  25           HN       GLY  25  90.003 -10.973   8.970
  192    HA2  GLY  25           HA2      GLY  25  88.654 -12.408  10.198
  193    HA3  GLY  25           HA1      GLY  25  87.595 -11.050  10.582
  194    H    GLU  26           HN       GLU  26  85.620 -11.434   9.831
  195    HA   GLU  26           HA       GLU  26  85.253 -12.891   7.293
  196    HB2  GLU  26           HB2      GLU  26  82.825 -12.885   8.099
  197    HB3  GLU  26           HB1      GLU  26  83.963 -13.860   9.026
  198    HG2  GLU  26           HG2      GLU  26  83.562 -11.008   9.846
  199    HG3  GLU  26           HG1      GLU  26  82.294 -12.167  10.235
  200    H    ARG  27           HN       ARG  27  85.892  -9.876   7.972
  201    HA   ARG  27           HA       ARG  27  83.693  -8.673   6.393
  202    HB2  ARG  27           HB2      ARG  27  85.582  -7.479   8.396
  203    HB3  ARG  27           HB1      ARG  27  84.448  -6.558   7.409
  204    HG2  ARG  27           HG2      ARG  27  82.620  -7.273   8.587
  205    HG3  ARG  27           HG1      ARG  27  83.290  -8.886   8.843
  206    HD2  ARG  27           HD2      ARG  27  84.608  -8.184  10.654
  207    HD3  ARG  27           HD1      ARG  27  84.477  -6.487  10.207
  208    HE   ARG  27           HE       ARG  27  81.893  -7.292  10.762
  209   HH11  ARG  27          HH21      ARG  27  84.949  -7.239  12.382
  210   HH12  ARG  27          HH22      ARG  27  84.266  -7.037  13.961
  211   HH21  ARG  27          HH11      ARG  27  80.988  -7.025  12.833
  212   HH22  ARG  27          HH12      ARG  27  82.025  -6.916  14.216
  213    H    ARG  28           HN       ARG  28  84.149  -7.671   4.506
  214    HA   ARG  28           HA       ARG  28  86.976  -7.100   3.803
  215    HB2  ARG  28           HB2      ARG  28  86.042  -9.162   2.651
  216    HB3  ARG  28           HB1      ARG  28  84.885  -8.097   1.853
  217    HG2  ARG  28           HG2      ARG  28  86.899  -6.717   1.082
  218    HG3  ARG  28           HG1      ARG  28  87.900  -8.059   1.626
  219    HD2  ARG  28           HD2      ARG  28  86.379  -9.542   0.163
  220    HD3  ARG  28           HD1      ARG  28  85.834  -8.036  -0.569
  221    HE   ARG  28           HE       ARG  28  88.503  -7.791  -0.799
  222   HH11  ARG  28          HH21      ARG  28  86.336 -10.420  -1.413
  223   HH12  ARG  28          HH22      ARG  28  87.310 -11.109  -2.668
  224   HH21  ARG  28          HH11      ARG  28  89.782  -8.690  -2.443
  225   HH22  ARG  28          HH12      ARG  28  89.259 -10.130  -3.253
  226    H    TRP  29           HN       TRP  29  87.333  -5.310   2.525
  227    HA   TRP  29           HA       TRP  29  85.070  -3.588   1.828
  228    HB2  TRP  29           HB2      TRP  29  87.402  -2.729   3.539
  229    HB3  TRP  29           HB1      TRP  29  86.095  -1.689   2.973
  230    HD1  TRP  29           HD1      TRP  29  83.553  -2.576   3.821
  231    HE1  TRP  29           HE1      TRP  29  82.916  -3.394   6.194
  232    HE3  TRP  29           HE3      TRP  29  88.165  -3.829   5.564
  233    HZ2  TRP  29           HZ2      TRP  29  84.227  -4.447   8.523
  234    HZ3  TRP  29           HZ3      TRP  29  88.461  -4.730   7.849
  235    HH2  TRP  29           HH2      TRP  29  86.496  -5.047   9.331
  236    H    GLU  30           HN       GLU  30  85.670  -1.911   0.351
  237    HA   GLU  30           HA       GLU  30  88.065  -2.561  -1.215
  238    HB2  GLU  30           HB2      GLU  30  85.818  -0.702  -2.006
  239    HB3  GLU  30           HB1      GLU  30  87.011  -1.472  -3.054
  240    HG2  GLU  30           HG2      GLU  30  86.075  -3.706  -2.262
  241    HG3  GLU  30           HG1      GLU  30  84.746  -2.794  -1.549
  242    H    VAL  31           HN       VAL  31  89.718  -1.025  -1.487
  243    HA   VAL  31           HA       VAL  31  89.283   1.723  -0.547
  244    HB   VAL  31           HB       VAL  31  91.414   1.549   0.817
  245   HG11  VAL  31          HG11      VAL  31  89.113   1.607   1.792
  246   HG12  VAL  31          HG12      VAL  31  90.251   0.681   2.770
  247   HG13  VAL  31          HG13      VAL  31  89.085  -0.156   1.746
  248   HG21  VAL  31          HG21      VAL  31  90.797  -1.416   0.678
  249   HG22  VAL  31          HG22      VAL  31  92.137  -0.644   1.525
  250   HG23  VAL  31          HG23      VAL  31  92.093  -0.646  -0.238
  251    H    LEU  32           HN       LEU  32  90.974   3.170  -1.135
  252    HA   LEU  32           HA       LEU  32  92.371   2.339  -3.595
  253    HB2  LEU  32           HB2      LEU  32  91.127   4.293  -4.030
  254    HB3  LEU  32           HB1      LEU  32  91.468   4.981  -2.446
  255    HG   LEU  32           HG       LEU  32  93.804   5.373  -3.085
  256   HD11  LEU  32          HD11      LEU  32  94.578   3.850  -4.604
  257   HD12  LEU  32          HD12      LEU  32  94.044   5.051  -5.775
  258   HD13  LEU  32          HD13      LEU  32  93.009   3.676  -5.389
  259   HD21  LEU  32          HD21      LEU  32  93.418   7.127  -4.716
  260   HD22  LEU  32          HD22      LEU  32  92.018   7.047  -3.648
  261   HD23  LEU  32          HD23      LEU  32  91.935   6.346  -5.264
  262    H    LEU  33           HN       LEU  33  94.559   2.114  -3.578
  263    HA   LEU  33           HA       LEU  33  95.933   2.664  -1.049
  264    HB2  LEU  33           HB2      LEU  33  96.394   0.480  -1.881
  265    HB3  LEU  33           HB1      LEU  33  96.677   1.074  -3.513
  266    HG   LEU  33           HG       LEU  33  98.456   2.360  -1.558
  267   HD11  LEU  33          HD11      LEU  33  99.818   0.435  -1.029
  268   HD12  LEU  33          HD12      LEU  33  98.770  -0.623  -1.970
  269   HD13  LEU  33          HD13      LEU  33  98.174   0.110  -0.482
  270   HD21  LEU  33          HD21      LEU  33  98.628   2.305  -4.095
  271   HD22  LEU  33          HD22      LEU  33  99.091   0.610  -3.950
  272   HD23  LEU  33          HD23      LEU  33 100.107   1.864  -3.240
  273    H    HIS  34           HN       HIS  34  97.146   4.361  -0.760
  274    HA   HIS  34           HA       HIS  34  97.666   6.145  -3.010
  275    HB2  HIS  34           HB2      HIS  34  97.823   6.397  -0.009
  276    HB3  HIS  34           HB1      HIS  34  98.452   7.660  -1.079
  277    HD2  HIS  34           HD2      HIS  34  94.978   6.068  -0.092
  278    HE1  HIS  34           HE1      HIS  34  94.239   9.541  -2.371
  279    HE2  HIS  34           HE2      HIS  34  93.159   7.717  -0.977
  280    H    ASP  35           HN       ASP  35  99.497   4.009  -0.900
  281    HA   ASP  35           HA       ASP  35 101.631   4.074  -2.718
  282    HB2  ASP  35           HB2      ASP  35 103.378   5.265  -1.526
  283    HB3  ASP  35           HB1      ASP  35 101.975   6.333  -1.619
  284    H    VAL  36           HN       VAL  36 103.543   2.821  -2.009
  285    HA   VAL  36           HA       VAL  36 103.084   1.086   0.303
  286    HB   VAL  36           HB       VAL  36 101.957   0.132  -1.804
  287   HG11  VAL  36          HG11      VAL  36 103.965   0.808  -3.247
  288   HG12  VAL  36          HG12      VAL  36 103.339  -0.824  -3.491
  289   HG13  VAL  36          HG13      VAL  36 104.801  -0.574  -2.541
  290   HG21  VAL  36          HG21      VAL  36 102.531  -2.104  -1.207
  291   HG22  VAL  36          HG22      VAL  36 102.699  -1.167   0.273
  292   HG23  VAL  36          HG23      VAL  36 104.131  -1.623  -0.647
  293    H    SER  37           HN       SER  37 104.905  -0.484   0.568
  294    HA   SER  37           HA       SER  37 107.469   0.421  -0.507
  295    HB2  SER  37           HB2      SER  37 107.096   1.619   1.681
  296    HB3  SER  37           HB1      SER  37 106.979   0.046   2.464
  297    HG   SER  37           HG       SER  37 109.179   1.318   1.270
  298    H    LEU  38           HN       LEU  38 109.187  -1.280   0.177
  299    HA   LEU  38           HA       LEU  38 108.163  -3.811  -0.542
  300    HB2  LEU  38           HB2      LEU  38 110.594  -2.874  -0.759
  301    HB3  LEU  38           HB1      LEU  38 110.804  -3.505   0.875
  302    HG   LEU  38           HG       LEU  38 109.700  -5.682  -0.190
  303   HD11  LEU  38          HD11      LEU  38 110.113  -5.994  -2.498
  304   HD12  LEU  38          HD12      LEU  38 111.184  -4.596  -2.584
  305   HD13  LEU  38          HD13      LEU  38 109.446  -4.364  -2.402
  306   HD21  LEU  38          HD21      LEU  38 112.572  -4.774  -0.526
  307   HD22  LEU  38          HD22      LEU  38 112.043  -6.434  -0.795
  308   HD23  LEU  38          HD23      LEU  38 111.896  -5.710   0.806
  309    H    HIS  39           HN       HIS  39 107.732  -2.242   2.302
  310    HA   HIS  39           HA       HIS  39 106.901  -4.657   3.635
  311    HB2  HIS  39           HB2      HIS  39 108.338  -4.482   5.573
  312    HB3  HIS  39           HB1      HIS  39 109.345  -4.599   4.131
  313    HD2  HIS  39           HD2      HIS  39 109.640  -1.568   3.166
  314    HE1  HIS  39           HE1      HIS  39 110.501  -0.569   7.177
  315    HE2  HIS  39           HE2      HIS  39 110.645   0.231   4.771
  316    H    GLY  40           HN       GLY  40 105.457  -2.403   2.812
  317    HA2  GLY  40           HA2      GLY  40 104.014  -1.756   5.142
  318    HA3  GLY  40           HA1      GLY  40 105.097  -0.419   4.777
  319    H    ILE  41           HN       ILE  41 102.211  -0.310   4.716
  320    HA   ILE  41           HA       ILE  41 101.825   0.616   1.952
  321    HB   ILE  41           HB       ILE  41 100.758  -1.295   1.406
  322   HG12  ILE  41          HG12      ILE  41  98.660  -0.399   3.407
  323   HG13  ILE  41          HG11      ILE  41  98.866   0.329   1.812
  324   HG21  ILE  41          HG21      ILE  41  99.971  -2.938   3.115
  325   HG22  ILE  41          HG22      ILE  41 100.495  -1.820   4.373
  326   HG23  ILE  41          HG23      ILE  41 101.677  -2.526   3.273
  327   HD11  ILE  41          HD11      ILE  41  98.466  -1.844   0.747
  328   HD12  ILE  41          HD12      ILE  41  97.112  -1.421   1.796
  329   HD13  ILE  41          HD13      ILE  41  98.306  -2.605   2.329
  330    H    LEU  42           HN       LEU  42 100.274   2.133   1.669
  331    HA   LEU  42           HA       LEU  42  99.011   3.258   4.107
  332    HB2  LEU  42           HB2      LEU  42 100.961   4.506   2.630
  333    HB3  LEU  42           HB1      LEU  42  99.508   5.080   1.823
  334    HG   LEU  42           HG       LEU  42  99.905   5.221   4.819
  335   HD11  LEU  42          HD11      LEU  42 100.243   7.421   2.761
  336   HD12  LEU  42          HD12      LEU  42 101.583   6.592   3.550
  337   HD13  LEU  42          HD13      LEU  42 100.466   7.568   4.504
  338   HD21  LEU  42          HD21      LEU  42  97.942   6.515   2.909
  339   HD22  LEU  42          HD22      LEU  42  98.068   6.885   4.628
  340   HD23  LEU  42          HD23      LEU  42  97.572   5.276   4.108
  341    H    VAL  43           HN       VAL  43  96.813   3.514   3.948
  342    HA   VAL  43           HA       VAL  43  95.613   3.452   1.247
  343    HB   VAL  43           HB       VAL  43  93.896   1.876   2.020
  344   HG11  VAL  43          HG11      VAL  43  96.202   1.192   1.031
  345   HG12  VAL  43          HG12      VAL  43  95.224  -0.056   1.800
  346   HG13  VAL  43          HG13      VAL  43  96.579   0.663   2.670
  347   HG21  VAL  43          HG21      VAL  43  94.347   0.670   4.195
  348   HG22  VAL  43          HG22      VAL  43  93.871   2.357   4.390
  349   HG23  VAL  43          HG23      VAL  43  95.564   1.894   4.553
  350    H    GLY  44           HN       GLY  44  93.168   3.791   1.444
  351    HA2  GLY  44           HA2      GLY  44  92.726   6.204   3.107
  352    HA3  GLY  44           HA1      GLY  44  91.800   5.762   1.672
  353    H    GLN  45           HN       GLN  45  90.926   6.291   4.595
  354    HA   GLN  45           HA       GLN  45  90.060   3.692   5.460
  355    HB2  GLN  45           HB2      GLN  45  89.261   4.796   7.412
  356    HB3  GLN  45           HB1      GLN  45  90.807   5.525   6.989
  357    HG2  GLN  45           HG2      GLN  45  89.583   7.447   7.326
  358    HG3  GLN  45           HG1      GLN  45  89.233   7.198   5.619
  359   HE21  GLN  45          HE21      GLN  45  87.895   5.455   8.476
  360   HE22  GLN  45          HE22      GLN  45  86.280   5.866   8.153
  361    HA   PRO  46           HA       PRO  46  86.158   4.520   3.312
  362    HB2  PRO  46           HB2      PRO  46  85.197   1.992   3.158
  363    HB3  PRO  46           HB1      PRO  46  86.590   2.503   2.180
  364    HG2  PRO  46           HG2      PRO  46  86.536   0.923   4.710
  365    HG3  PRO  46           HG1      PRO  46  87.556   0.717   3.277
  366    HD2  PRO  46           HD2      PRO  46  88.345   2.041   5.624
  367    HD3  PRO  46           HD1      PRO  46  89.126   2.218   4.042
  368    H    GLN  47           HN       GLN  47  83.844   4.373   3.850
  369    HA   GLN  47           HA       GLN  47  83.318   4.864   6.583
  370    HB2  GLN  47           HB2      GLN  47  81.230   4.158   4.530
  371    HB3  GLN  47           HB1      GLN  47  81.075   5.222   5.928
  372    HG2  GLN  47           HG2      GLN  47  82.640   5.715   3.386
  373    HG3  GLN  47           HG1      GLN  47  81.301   6.662   4.033
  374   HE21  GLN  47          HE21      GLN  47  84.756   6.190   4.157
  375   HE22  GLN  47          HE22      GLN  47  85.077   7.387   5.317
  376    H    ASP  48           HN       ASP  48  83.212   1.922   4.714
  377    HA   ASP  48           HA       ASP  48  81.565   0.526   6.668
  378    HB2  ASP  48           HB2      ASP  48  82.946  -0.353   4.134
  379    HB3  ASP  48           HB1      ASP  48  82.059  -1.458   5.182
  380    H    TRP  49           HN       TRP  49  84.575   1.556   6.935
  381    HA   TRP  49           HA       TRP  49  86.185  -0.682   7.456
  382    HB2  TRP  49           HB2      TRP  49  86.937   1.708   7.281
  383    HB3  TRP  49           HB1      TRP  49  86.314   1.955   8.909
  384    HD1  TRP  49           HD1      TRP  49  87.623   0.952  10.886
  385    HE1  TRP  49           HE1      TRP  49  90.003  -0.119  11.106
  386    HE3  TRP  49           HE3      TRP  49  88.539   0.052   6.005
  387    HZ2  TRP  49           HZ2      TRP  49  92.046  -1.235   9.270
  388    HZ3  TRP  49           HZ3      TRP  49  90.634  -1.008   5.249
  389    HH2  TRP  49           HH2      TRP  49  92.358  -1.659   6.890
  390    H    ASN  50           HN       ASN  50  84.263  -1.927   8.557
  391    HA   ASN  50           HA       ASN  50  84.126  -1.274  11.419
  392    HB2  ASN  50           HB2      ASN  50  82.005  -1.860  10.313
  393    HB3  ASN  50           HB1      ASN  50  82.679  -3.412   9.824
  394   HD21  ASN  50          HD21      ASN  50  83.870  -4.437  12.049
  395   HD22  ASN  50          HD22      ASN  50  82.781  -4.538  13.346
  396    H    GLY  51           HN       GLY  51  86.408  -1.743  11.719
  397    HA2  GLY  51           HA2      GLY  51  86.840  -4.602  12.262
  398    HA3  GLY  51           HA1      GLY  51  87.996  -3.775  11.224
  399    H    ASP  52           HN       ASP  52  88.252  -5.033  13.895
  400    HA   ASP  52           HA       ASP  52  88.720  -2.923  15.784
  401    HB2  ASP  52           HB2      ASP  52  89.137  -5.886  15.722
  402    HB3  ASP  52           HB1      ASP  52  89.938  -4.931  16.969
  403    HA   PRO  53           HA       PRO  53  92.730  -1.865  14.064
  404    HB2  PRO  53           HB2      PRO  53  93.522  -0.254  16.171
  405    HB3  PRO  53           HB1      PRO  53  92.498   0.282  14.827
  406    HG2  PRO  53           HG2      PRO  53  91.733  -0.529  17.580
  407    HG3  PRO  53           HG1      PRO  53  91.058   0.741  16.545
  408    HD2  PRO  53           HD2      PRO  53  89.816  -1.646  16.923
  409    HD3  PRO  53           HD1      PRO  53  89.680  -0.736  15.401
  410    H    GLN  54           HN       GLN  54  92.139  -3.331  17.155
  411    HA   GLN  54           HA       GLN  54  94.908  -3.786  17.757
  412    HB2  GLN  54           HB2      GLN  54  92.484  -5.171  18.920
  413    HB3  GLN  54           HB1      GLN  54  94.100  -5.098  19.623
  414    HG2  GLN  54           HG2      GLN  54  93.927  -2.680  19.875
  415    HG3  GLN  54           HG1      GLN  54  92.362  -2.679  19.061
  416   HE21  GLN  54          HE21      GLN  54  91.413  -5.153  20.398
  417   HE22  GLN  54          HE22      GLN  54  91.100  -4.726  22.010
  418    H    ARG  55           HN       ARG  55  92.485  -5.447  15.900
  419    HA   ARG  55           HA       ARG  55  94.057  -7.921  15.869
  420    HB2  ARG  55           HB2      ARG  55  91.282  -7.152  15.140
  421    HB3  ARG  55           HB1      ARG  55  92.017  -8.391  14.125
  422    HG2  ARG  55           HG2      ARG  55  92.638  -9.633  16.240
  423    HG3  ARG  55           HG1      ARG  55  91.671  -8.462  17.135
  424    HD2  ARG  55           HD2      ARG  55  90.440 -10.580  16.540
  425    HD3  ARG  55           HD1      ARG  55  89.668  -9.105  15.966
  426    HE   ARG  55           HE       ARG  55  89.958  -9.909  13.821
  427   HH11  ARG  55          HH21      ARG  55  92.282 -11.332  15.957
  428   HH12  ARG  55          HH22      ARG  55  92.970 -12.360  14.744
  429   HH21  ARG  55          HH11      ARG  55  90.852 -11.258  12.231
  430   HH22  ARG  55          HH12      ARG  55  92.159 -12.319  12.637
  431    HA   PRO  56           HA       PRO  56  96.155  -7.077  12.138
  432    HB2  PRO  56           HB2      PRO  56  96.245  -9.552  10.950
  433    HB3  PRO  56           HB1      PRO  56  97.224  -9.106  12.361
  434    HG2  PRO  56           HG2      PRO  56  94.678 -10.652  12.236
  435    HG3  PRO  56           HG1      PRO  56  96.121 -10.930  13.230
  436    HD2  PRO  56           HD2      PRO  56  93.866  -9.751  14.220
  437    HD3  PRO  56           HD1      PRO  56  95.494  -9.362  14.821
  438    H    PHE  57           HN       PHE  57  96.047  -7.017   9.812
  439    HA   PHE  57           HA       PHE  57  93.332  -7.370   8.674
  440    HB2  PHE  57           HB2      PHE  57  95.201  -5.018   8.259
  441    HB3  PHE  57           HB1      PHE  57  93.665  -5.265   7.434
  442    HD1  PHE  57           HD2      PHE  57  95.169  -4.897  10.845
  443    HD2  PHE  57           HD1      PHE  57  91.654  -4.518   8.407
  444    HE1  PHE  57           HE2      PHE  57  93.980  -3.791  12.721
  445    HE2  PHE  57           HE1      PHE  57  90.465  -3.423  10.283
  446    HZ   PHE  57           HZ       PHE  57  91.627  -3.063  12.441
  447    H    GLU  58           HN       GLU  58  93.399  -7.677   6.285
  448    HA   GLU  58           HA       GLU  58  96.082  -8.432   5.311
  449    HB2  GLU  58           HB2      GLU  58  93.450  -9.867   4.906
  450    HB3  GLU  58           HB1      GLU  58  94.828 -10.138   3.841
  451    HG2  GLU  58           HG2      GLU  58  96.204 -10.677   5.880
  452    HG3  GLU  58           HG1      GLU  58  94.723 -10.591   6.834
  453    H    ALA  59           HN       ALA  59  96.626  -7.682   3.232
  454    HA   ALA  59           HA       ALA  59  94.586  -6.002   1.861
  455    HB1  ALA  59           HB1      ALA  59  97.491  -5.552   2.451
  456    HB2  ALA  59           HB2      ALA  59  96.107  -4.535   2.854
  457    HB3  ALA  59           HB3      ALA  59  96.634  -4.677   1.181
  458    H    ARG  60           HN       ARG  60  94.440  -6.094  -0.274
  459    HA   ARG  60           HA       ARG  60  96.327  -7.816  -1.769
  460    HB2  ARG  60           HB2      ARG  60  93.329  -7.711  -1.884
  461    HB3  ARG  60           HB1      ARG  60  94.253  -8.162  -3.314
  462    HG2  ARG  60           HG2      ARG  60  93.706 -10.194  -2.148
  463    HG3  ARG  60           HG1      ARG  60  95.426  -9.903  -1.909
  464    HD2  ARG  60           HD2      ARG  60  95.147  -9.824   0.325
  465    HD3  ARG  60           HD1      ARG  60  93.898  -8.594   0.170
  466    HE   ARG  60           HE       ARG  60  92.309 -10.263   0.427
  467   HH11  ARG  60          HH21      ARG  60  95.378 -11.602  -0.450
  468   HH12  ARG  60          HH22      ARG  60  94.873 -13.246  -0.243
  469   HH21  ARG  60          HH11      ARG  60  91.641 -12.415   0.698
  470   HH22  ARG  60          HH12      ARG  60  92.760 -13.706   0.407
  471    H    LEU  61           HN       LEU  61  97.302  -6.732  -3.434
  472    HA   LEU  61           HA       LEU  61  96.109  -4.144  -4.232
  473    HB2  LEU  61           HB2      LEU  61  98.934  -4.950  -4.857
  474    HB3  LEU  61           HB1      LEU  61  98.256  -3.337  -4.662
  475    HG   LEU  61           HG       LEU  61  98.595  -5.361  -2.428
  476   HD11  LEU  61          HD11      LEU  61 100.773  -4.606  -2.996
  477   HD12  LEU  61          HD12      LEU  61 100.277  -3.569  -1.658
  478   HD13  LEU  61          HD13      LEU  61 100.208  -2.965  -3.313
  479   HD21  LEU  61          HD21      LEU  61  97.588  -2.511  -2.553
  480   HD22  LEU  61          HD22      LEU  61  98.122  -3.260  -1.050
  481   HD23  LEU  61          HD23      LEU  61  96.745  -3.926  -1.925
  482    H    TYR  62           HN       TYR  62  95.371  -3.895  -6.243
  483    HA   TYR  62           HA       TYR  62  95.966  -6.023  -8.209
  484    HB2  TYR  62           HB2      TYR  62  93.604  -4.133  -8.222
  485    HB3  TYR  62           HB1      TYR  62  93.831  -5.574  -9.213
  486    HD1  TYR  62           HD1      TYR  62  93.408  -4.405  -5.693
  487    HD2  TYR  62           HD2      TYR  62  93.214  -7.720  -8.419
  488    HE1  TYR  62           HE1      TYR  62  92.351  -5.802  -3.927
  489    HE2  TYR  62           HE2      TYR  62  92.156  -9.108  -6.657
  490    HH   TYR  62           HH       TYR  62  90.734  -7.946  -4.009
  491    H    LEU  63           HN       LEU  63  97.510  -5.392  -9.549
  492    HA   LEU  63           HA       LEU  63  97.584  -2.587 -10.471
  493    HB2  LEU  63           HB2      LEU  63  99.624  -3.813  -9.403
  494    HB3  LEU  63           HB1      LEU  63  99.763  -4.604 -10.969
  495    HG   LEU  63           HG       LEU  63  99.690  -1.600 -10.548
  496   HD11  LEU  63          HD11      LEU  63 101.752  -2.734  -9.684
  497   HD12  LEU  63          HD12      LEU  63 102.071  -1.648 -11.036
  498   HD13  LEU  63          HD13      LEU  63 102.019  -3.392 -11.299
  499   HD21  LEU  63          HD21      LEU  63  99.917  -3.394 -12.963
  500   HD22  LEU  63          HD22      LEU  63 100.625  -1.779 -12.982
  501   HD23  LEU  63          HD23      LEU  63  98.892  -1.978 -12.731
  502    H    GLY  64           HN       GLY  64  98.892  -5.434 -12.098
  503    HA2  GLY  64           HA2      GLY  64  97.688  -4.650 -14.600
  504    HA3  GLY  64           HA1      GLY  64  98.680  -6.082 -14.316
  505    H    LEU  65           HN       LEU  65  96.596  -6.616 -15.876
  506    HA   LEU  65           HA       LEU  65  94.207  -7.159 -14.431
  507    HB2  LEU  65           HB2      LEU  65  94.161  -6.789 -16.858
  508    HB3  LEU  65           HB1      LEU  65  95.175  -8.200 -17.117
  509    HG   LEU  65           HG       LEU  65  92.672  -8.510 -17.519
  510   HD11  LEU  65          HD11      LEU  65  92.959 -10.719 -17.149
  511   HD12  LEU  65          HD12      LEU  65  93.273 -10.496 -15.432
  512   HD13  LEU  65          HD13      LEU  65  94.574 -10.281 -16.601
  513   HD21  LEU  65          HD21      LEU  65  92.118  -7.190 -15.376
  514   HD22  LEU  65          HD22      LEU  65  92.492  -8.680 -14.510
  515   HD23  LEU  65          HD23      LEU  65  91.182  -8.650 -15.688
  516    H    ASP  66           HN       ASP  66  97.081  -9.031 -15.321
  517    HA   ASP  66           HA       ASP  66  96.087 -11.486 -14.036
  518    HB2  ASP  66           HB2      ASP  66  97.186 -11.454 -16.300
  519    HB3  ASP  66           HB1      ASP  66  98.670 -10.961 -15.487
  520    H    VAL  67           HN       VAL  67  97.355  -8.713 -12.902
  521    HA   VAL  67           HA       VAL  67  99.387 -10.027 -11.201
  522    HB   VAL  67           HB       VAL  67  99.008  -7.184 -12.102
  523   HG11  VAL  67          HG11      VAL  67 101.012  -6.806 -10.424
  524   HG12  VAL  67          HG12      VAL  67 100.296  -8.171  -9.568
  525   HG13  VAL  67          HG13      VAL  67  99.353  -6.706  -9.840
  526   HG21  VAL  67          HG21      VAL  67 101.195  -7.429 -12.938
  527   HG22  VAL  67          HG22      VAL  67 100.497  -9.024 -13.213
  528   HG23  VAL  67          HG23      VAL  67 101.568  -8.757 -11.836
  529    H    LEU  68           HN       LEU  68  98.222 -10.927  -9.631
  530    HA   LEU  68           HA       LEU  68  96.609  -9.132  -7.919
  531    HB2  LEU  68           HB2      LEU  68  95.126 -10.822  -8.579
  532    HB3  LEU  68           HB1      LEU  68  96.386 -12.054  -8.606
  533    HG   LEU  68           HG       LEU  68  96.521 -11.985  -6.151
  534   HD11  LEU  68          HD11      LEU  68  94.724 -10.699  -4.928
  535   HD12  LEU  68          HD12      LEU  68  94.329  -9.913  -6.456
  536   HD13  LEU  68          HD13      LEU  68  95.916  -9.675  -5.728
  537   HD21  LEU  68          HD21      LEU  68  93.742 -12.343  -7.305
  538   HD22  LEU  68          HD22      LEU  68  94.207 -12.870  -5.687
  539   HD23  LEU  68          HD23      LEU  68  94.977 -13.586  -7.104
  540    H    ILE  69           HN       ILE  69  97.705  -8.541  -6.144
  541    HA   ILE  69           HA       ILE  69  99.780 -10.372  -5.096
  542    HB   ILE  69           HB       ILE  69  99.542  -7.361  -5.037
  543   HG12  ILE  69          HG12      ILE  69 102.084  -8.546  -5.854
  544   HG13  ILE  69          HG11      ILE  69 100.758  -9.170  -6.831
  545   HG21  ILE  69          HG21      ILE  69 101.971  -7.913  -3.897
  546   HG22  ILE  69          HG22      ILE  69 100.982  -9.214  -3.235
  547   HG23  ILE  69          HG23      ILE  69 100.512  -7.537  -2.979
  548   HD11  ILE  69          HD11      ILE  69 101.587  -7.176  -7.907
  549   HD12  ILE  69          HD12      ILE  69 101.494  -6.263  -6.400
  550   HD13  ILE  69          HD13      ILE  69 100.016  -6.789  -7.205
  551    H    ARG  70           HN       ARG  70  99.887 -10.811  -2.922
  552    HA   ARG  70           HA       ARG  70  97.675  -9.803  -1.245
  553    HB2  ARG  70           HB2      ARG  70  97.906 -12.225  -0.183
  554    HB3  ARG  70           HB1      ARG  70  96.886 -11.955  -1.595
  555    HG2  ARG  70           HG2      ARG  70  98.614 -12.729  -3.087
  556    HG3  ARG  70           HG1      ARG  70  99.792 -12.788  -1.776
  557    HD2  ARG  70           HD2      ARG  70  98.674 -14.617  -0.725
  558    HD3  ARG  70           HD1      ARG  70  97.248 -14.421  -1.743
  559    HE   ARG  70           HE       ARG  70  99.137 -14.950  -3.580
  560   HH11  ARG  70          HH21      ARG  70  98.395 -16.387  -0.521
  561   HH12  ARG  70          HH22      ARG  70  98.940 -17.967  -0.975
  562   HH21  ARG  70          HH11      ARG  70  99.854 -17.021  -4.182
  563   HH22  ARG  70          HH12      ARG  70  99.765 -18.325  -3.047
  564    H    MET  71           HN       MET  71  98.252  -9.044   0.674
  565    HA   MET  71           HA       MET  71 100.810  -9.863   1.874
  566    HB2  MET  71           HB2      MET  71 100.092  -6.956   1.975
  567    HB3  MET  71           HB1      MET  71 101.680  -7.715   2.030
  568    HG2  MET  71           HG2      MET  71 101.748  -8.005  -0.315
  569    HG3  MET  71           HG1      MET  71 100.008  -7.801  -0.482
  570    HE1  MET  71           HE1      MET  71 101.702  -5.354   2.056
  571    HE2  MET  71           HE2      MET  71 102.675  -4.349   0.987
  572    HE3  MET  71           HE3      MET  71 103.035  -6.066   1.140
  573    H    GLU  72           HN       GLU  72 100.866  -9.672   4.123
  574    HA   GLU  72           HA       GLU  72  98.225  -9.267   5.363
  575    HB2  GLU  72           HB2      GLU  72  99.162 -11.471   5.825
  576    HB3  GLU  72           HB1      GLU  72 100.675 -10.748   6.373
  577    HG2  GLU  72           HG2      GLU  72  99.649  -9.802   8.298
  578    HG3  GLU  72           HG1      GLU  72  98.028 -10.088   7.669
  579    H    ILE  73           HN       ILE  73  97.982  -7.416   6.618
  580    HA   ILE  73           HA       ILE  73 100.466  -6.119   7.562
  581    HB   ILE  73           HB       ILE  73  99.512  -3.956   6.909
  582   HG12  ILE  73          HG12      ILE  73  97.315  -5.728   5.798
  583   HG13  ILE  73          HG11      ILE  73  97.151  -4.468   7.019
  584   HG21  ILE  73          HG21      ILE  73 100.567  -4.191   4.920
  585   HG22  ILE  73          HG22      ILE  73  99.303  -5.253   4.305
  586   HG23  ILE  73          HG23      ILE  73 100.639  -5.920   5.236
  587   HD11  ILE  73          HD11      ILE  73  96.356  -3.630   4.871
  588   HD12  ILE  73          HD12      ILE  73  97.888  -4.052   4.108
  589   HD13  ILE  73          HD13      ILE  73  97.827  -2.780   5.317
  590    H    SER  74           HN       SER  74 100.221  -4.629   9.272
  591    HA   SER  74           HA       SER  74  97.758  -4.959  10.889
  592    HB2  SER  74           HB2      SER  74  99.810  -4.336  12.677
  593    HB3  SER  74           HB1      SER  74  99.079  -5.922  12.445
  594    HG   SER  74           HG       SER  74 101.077  -6.395  11.912
  595    H    LEU  75           HN       LEU  75  97.188  -3.128  12.200
  596    HA   LEU  75           HA       LEU  75  97.542  -0.625  10.892
  597    HB2  LEU  75           HB2      LEU  75  95.705  -1.642  12.649
  598    HB3  LEU  75           HB1      LEU  75  96.636  -0.587  13.709
  599    HG   LEU  75           HG       LEU  75  96.303   1.278  12.091
  600   HD11  LEU  75          HD11      LEU  75  94.915  -0.914  10.596
  601   HD12  LEU  75          HD12      LEU  75  95.906   0.409   9.979
  602   HD13  LEU  75          HD13      LEU  75  94.247   0.714  10.487
  603   HD21  LEU  75          HD21      LEU  75  93.669   0.015  12.870
  604   HD22  LEU  75          HD22      LEU  75  94.038   1.734  12.735
  605   HD23  LEU  75          HD23      LEU  75  94.746   0.780  14.039
  606    H    ALA  76           HN       ALA  76  99.132   0.720  10.968
  607    HA   ALA  76           HA       ALA  76 101.066   0.551  13.167
  608    HB1  ALA  76           HB1      ALA  76 102.040   0.330  10.943
  609    HB2  ALA  76           HB2      ALA  76 102.573   1.836  11.684
  610    HB3  ALA  76           HB3      ALA  76 101.310   1.856  10.450
  611    H    TRP  77           HN       TRP  77  99.045   2.800  11.398
  612    HA   TRP  77           HA       TRP  77  98.566   4.465  13.688
  613    HB2  TRP  77           HB2      TRP  77  99.686   6.507  12.879
  614    HB3  TRP  77           HB1      TRP  77 100.877   5.221  13.115
  615    HD1  TRP  77           HD1      TRP  77 102.071   4.239  11.006
  616    HE1  TRP  77           HE1      TRP  77 101.944   4.731   8.485
  617    HE3  TRP  77           HE3      TRP  77  98.243   7.628  10.931
  618    HZ2  TRP  77           HZ2      TRP  77 100.625   6.506   6.720
  619    HZ3  TRP  77           HZ3      TRP  77  97.588   8.723   8.805
  620    HH2  TRP  77           HH2      TRP  77  98.759   8.157   6.690
  621    H    ALA  78           HN       ALA  78  97.284   6.468  13.012
  622    HA   ALA  78           HA       ALA  78  96.029   6.284  10.354
  623    HB1  ALA  78           HB1      ALA  78  94.756   4.830  12.023
  624    HB2  ALA  78           HB2      ALA  78  93.820   6.064  11.182
  625    HB3  ALA  78           HB3      ALA  78  94.333   6.331  12.846
  626    H    ARG  79           HN       ARG  79  95.927   8.374   9.586
  627    HA   ARG  79           HA       ARG  79  95.094  10.478  11.406
  628    HB2  ARG  79           HB2      ARG  79  97.679  10.163  11.498
  629    HB3  ARG  79           HB1      ARG  79  97.667  10.941   9.918
  630    HG2  ARG  79           HG2      ARG  79  96.561  12.904  10.840
  631    HG3  ARG  79           HG1      ARG  79  96.412  12.121  12.415
  632    HD2  ARG  79           HD2      ARG  79  98.827  12.060  12.665
  633    HD3  ARG  79           HD1      ARG  79  99.047  12.675  11.030
  634    HE   ARG  79           HE       ARG  79  98.407  14.819  11.779
  635   HH11  ARG  79          HH21      ARG  79  98.138  12.393  14.240
  636   HH12  ARG  79          HH22      ARG  79  97.981  13.531  15.534
  637   HH21  ARG  79          HH11      ARG  79  98.201  16.311  13.475
  638   HH22  ARG  79          HH12      ARG  79  98.016  15.749  15.102
  639    H    ASP  80           HN       ASP  80  93.927  12.030  10.474
  640    HA   ASP  80           HA       ASP  80  92.830  13.235   8.880
  641    HB2  ASP  80           HB2      ASP  80  95.221  13.979   8.585
  642    HB3  ASP  80           HB1      ASP  80  95.309  12.875   7.213
  643    H    GLY  81           HN       GLY  81  91.962  10.590   8.719
  644    HA2  GLY  81           HA2      GLY  81  90.566   9.509   7.240
  645    HA3  GLY  81           HA1      GLY  81  91.141  10.560   5.958
  646    H    LEU  82           HN       LEU  82  94.013   9.799   6.539
  647    HA   LEU  82           HA       LEU  82  93.953   7.369   4.927
  648    HB2  LEU  82           HB2      LEU  82  96.482   8.713   5.817
  649    HB3  LEU  82           HB1      LEU  82  96.127   7.876   4.305
  650    HG   LEU  82           HG       LEU  82  95.055  10.580   5.156
  651   HD11  LEU  82          HD11      LEU  82  96.853   9.765   2.850
  652   HD12  LEU  82          HD12      LEU  82  97.416  10.520   4.342
  653   HD13  LEU  82          HD13      LEU  82  96.349  11.407   3.253
  654   HD21  LEU  82          HD21      LEU  82  93.293   9.556   3.932
  655   HD22  LEU  82          HD22      LEU  82  94.413   8.759   2.828
  656   HD23  LEU  82          HD23      LEU  82  94.166  10.502   2.727
  657    H    LEU  83           HN       LEU  83  95.302   5.533   5.455
  658    HA   LEU  83           HA       LEU  83  95.672   5.134   8.393
  659    HB2  LEU  83           HB2      LEU  83  94.724   3.090   6.399
  660    HB3  LEU  83           HB1      LEU  83  94.833   2.917   8.147
  661    HG   LEU  83           HG       LEU  83  93.079   4.966   6.762
  662   HD11  LEU  83          HD11      LEU  83  91.243   3.358   7.613
  663   HD12  LEU  83          HD12      LEU  83  92.530   2.158   7.727
  664   HD13  LEU  83          HD13      LEU  83  92.133   2.879   6.166
  665   HD21  LEU  83          HD21      LEU  83  93.499   4.075   9.618
  666   HD22  LEU  83          HD22      LEU  83  91.979   4.816   9.116
  667   HD23  LEU  83          HD23      LEU  83  93.488   5.712   8.965
  668    H    GLY  84           HN       GLY  84  97.689   4.273   8.926
  669    HA2  GLY  84           HA2      GLY  84  99.440   3.496   6.715
  670    HA3  GLY  84           HA1      GLY  84  99.927   3.840   8.370
  671    H    PHE  85           HN       PHE  85 100.576   1.526   6.756
  672    HA   PHE  85           HA       PHE  85  99.649  -0.530   8.636
  673    HB2  PHE  85           HB2      PHE  85  99.173  -0.452   5.681
  674    HB3  PHE  85           HB1      PHE  85  99.449  -1.999   6.469
  675    HD1  PHE  85           HD2      PHE  85  97.978  -2.668   8.420
  676    HD2  PHE  85           HD1      PHE  85  97.104   0.685   5.884
  677    HE1  PHE  85           HE2      PHE  85  95.631  -2.675   9.217
  678    HE2  PHE  85           HE1      PHE  85  94.756   0.675   6.678
  679    HZ   PHE  85           HZ       PHE  85  94.025  -1.003   8.347
  680    H    GLU  86           HN       GLU  86 101.278  -1.887   9.213
  681    HA   GLU  86           HA       GLU  86 103.774  -1.695   7.664
  682    HB2  GLU  86           HB2      GLU  86 103.842  -1.144  10.110
  683    HB3  GLU  86           HB1      GLU  86 103.345  -2.800  10.454
  684    HG2  GLU  86           HG2      GLU  86 105.342  -3.647   9.273
  685    HG3  GLU  86           HG1      GLU  86 105.845  -1.990   8.941
  686    H    CYS  87           HN       CYS  87 104.365  -3.417   6.458
  687    HA   CYS  87           HA       CYS  87 102.683  -5.691   6.238
  688    HB2  CYS  87           HB2      CYS  87 104.238  -4.615   4.475
  689    HB3  CYS  87           HB1      CYS  87 105.504  -5.599   5.209
  690    HG   CYS  87           HG       CYS  87 104.531  -7.201   3.491
  691    H    GLN  88           HN       GLN  88 102.604  -7.446   7.435
  692    HA   GLN  88           HA       GLN  88 104.823  -8.087   9.249
  693    HB2  GLN  88           HB2      GLN  88 102.157  -9.494   9.105
  694    HB3  GLN  88           HB1      GLN  88 103.276  -9.400  10.466
  695    HG2  GLN  88           HG2      GLN  88 101.690  -7.099   9.294
  696    HG3  GLN  88           HG1      GLN  88 101.391  -7.888  10.841
  697   HE21  GLN  88          HE21      GLN  88 103.473  -5.594   9.166
  698   HE22  GLN  88          HE22      GLN  88 104.348  -5.112  10.538
  699    H    HIS  89           HN       HIS  89 103.036  -9.356   6.494
  700    HA   HIS  89           HA       HIS  89 105.196 -11.140   5.844
  701    HB2  HIS  89           HB2      HIS  89 104.421 -13.053   6.737
  702    HB3  HIS  89           HB1      HIS  89 103.115 -12.149   7.496
  703    HD2  HIS  89           HD2      HIS  89 100.666 -13.068   6.645
  704    HE1  HIS  89           HE1      HIS  89 101.826 -14.499   2.843
  705    HE2  HIS  89           HE2      HIS  89  99.878 -14.261   4.459
  706    H    ILE  90           HN       ILE  90 105.182 -11.677   3.706
  707    HA   ILE  90           HA       ILE  90 102.800 -11.139   2.044
  708    HB   ILE  90           HB       ILE  90 103.967  -9.022   2.038
  709   HG12  ILE  90          HG12      ILE  90 104.739 -10.579  -0.451
  710   HG13  ILE  90          HG11      ILE  90 103.134  -9.922  -0.144
  711   HG21  ILE  90          HG21      ILE  90 106.115  -9.654   2.890
  712   HG22  ILE  90          HG22      ILE  90 106.391  -8.991   1.281
  713   HG23  ILE  90          HG23      ILE  90 106.408 -10.735   1.530
  714   HD11  ILE  90          HD11      ILE  90 104.614  -8.440  -1.563
  715   HD12  ILE  90          HD12      ILE  90 105.648  -8.235  -0.154
  716   HD13  ILE  90          HD13      ILE  90 103.981  -7.669  -0.112
  717    H    ASP  91           HN       ASP  91 102.594 -12.402   0.343
  718    HA   ASP  91           HA       ASP  91 103.922 -14.854   0.269
  719    HB2  ASP  91           HB2      ASP  91 102.249 -13.407  -1.773
  720    HB3  ASP  91           HB1      ASP  91 102.921 -15.005  -2.085
  721    H    LEU  92           HN       LEU  92 105.513 -15.727  -0.902
  722    HA   LEU  92           HA       LEU  92 107.759 -14.220  -1.576
  723    HB2  LEU  92           HB2      LEU  92 107.460 -16.808  -1.251
  724    HB3  LEU  92           HB1      LEU  92 107.216 -16.811  -2.997
  725    HG   LEU  92           HG       LEU  92 109.414 -15.303  -2.962
  726   HD11  LEU  92          HD11      LEU  92 110.930 -15.844  -1.182
  727   HD12  LEU  92          HD12      LEU  92 109.835 -17.068  -0.538
  728   HD13  LEU  92          HD13      LEU  92 109.416 -15.359  -0.417
  729   HD21  LEU  92          HD21      LEU  92 109.437 -17.324  -4.193
  730   HD22  LEU  92          HD22      LEU  92 109.174 -18.307  -2.753
  731   HD23  LEU  92          HD23      LEU  92 110.737 -17.533  -3.020
  732    H    ASP  93           HN       ASP  93 105.161 -15.405  -3.677
  733    HA   ASP  93           HA       ASP  93 106.267 -14.443  -6.110
  734    HB2  ASP  93           HB2      ASP  93 103.856 -14.617  -6.906
  735    HB3  ASP  93           HB1      ASP  93 104.558 -16.101  -6.264
  736    H    SER  94           HN       SER  94 104.093 -13.099  -3.688
  737    HA   SER  94           HA       SER  94 103.432 -10.707  -5.068
  738    HB2  SER  94           HB2      SER  94 102.024 -11.257  -3.257
  739    HB3  SER  94           HB1      SER  94 103.386 -11.551  -2.180
  740    HG   SER  94           HG       SER  94 103.272  -9.029  -3.287
  741    H    ILE  95           HN       ILE  95 106.028 -11.636  -2.881
  742    HA   ILE  95           HA       ILE  95 107.119  -9.105  -2.368
  743    HB   ILE  95           HB       ILE  95 108.341 -11.864  -2.509
  744   HG12  ILE  95          HG12      ILE  95 107.851  -9.936  -0.219
  745   HG13  ILE  95          HG11      ILE  95 106.800 -11.284  -0.641
  746   HG21  ILE  95          HG21      ILE  95 110.313 -10.675  -1.317
  747   HG22  ILE  95          HG22      ILE  95 109.663  -9.194  -2.018
  748   HG23  ILE  95          HG23      ILE  95 110.196 -10.507  -3.067
  749   HD11  ILE  95          HD11      ILE  95 109.521 -11.323   0.596
  750   HD12  ILE  95          HD12      ILE  95 109.069 -12.665  -0.454
  751   HD13  ILE  95          HD13      ILE  95 108.104 -12.301   0.976
  752    H    SER  96           HN       SER  96 107.558 -11.335  -5.073
  753    HA   SER  96           HA       SER  96 109.644  -9.798  -6.239
  754    HB2  SER  96           HB2      SER  96 108.558 -12.325  -6.706
  755    HB3  SER  96           HB1      SER  96 108.095 -11.414  -8.143
  756    HG   SER  96           HG       SER  96 110.294 -10.851  -8.394
  757    H    HIS  97           HN       HIS  97 106.134  -9.897  -6.783
  758    HA   HIS  97           HA       HIS  97 106.195  -8.160  -9.009
  759    HB2  HIS  97           HB2      HIS  97 104.081  -8.836  -6.973
  760    HB3  HIS  97           HB1      HIS  97 103.809  -7.575  -8.162
  761    HD2  HIS  97           HD2      HIS  97 103.890 -11.448  -7.980
  762    HE1  HIS  97           HE1      HIS  97 103.266 -10.374 -12.015
  763    HE2  HIS  97           HE2      HIS  97 103.296 -12.314 -10.373
  764    H    LEU  98           HN       LEU  98 106.250  -7.588  -5.551
  765    HA   LEU  98           HA       LEU  98 105.980  -4.717  -5.707
  766    HB2  LEU  98           HB2      LEU  98 106.612  -6.735  -3.624
  767    HB3  LEU  98           HB1      LEU  98 107.377  -5.163  -3.397
  768    HG   LEU  98           HG       LEU  98 105.150  -4.076  -3.642
  769   HD11  LEU  98          HD11      LEU  98 103.158  -5.662  -3.412
  770   HD12  LEU  98          HD12      LEU  98 104.265  -6.962  -3.856
  771   HD13  LEU  98          HD13      LEU  98 103.951  -5.647  -4.987
  772   HD21  LEU  98          HD21      LEU  98 105.469  -6.222  -1.527
  773   HD22  LEU  98          HD22      LEU  98 104.195  -5.004  -1.473
  774   HD23  LEU  98          HD23      LEU  98 105.888  -4.515  -1.394
  775    H    ARG  99           HN       ARG  99 108.681  -6.963  -5.950
  776    HA   ARG  99           HA       ARG  99 110.722  -4.989  -5.766
  777    HB2  ARG  99           HB2      ARG  99 110.539  -7.779  -6.824
  778    HB3  ARG  99           HB1      ARG  99 111.925  -6.804  -7.303
  779    HG2  ARG  99           HG2      ARG  99 112.714  -6.598  -5.111
  780    HG3  ARG  99           HG1      ARG  99 111.134  -6.926  -4.403
  781    HD2  ARG  99           HD2      ARG  99 111.594  -9.130  -4.273
  782    HD3  ARG  99           HD1      ARG  99 111.999  -9.199  -5.984
  783    HE   ARG  99           HE       ARG  99 113.876  -8.740  -3.768
  784   HH11  ARG  99          HH21      ARG  99 113.235  -9.058  -7.161
  785   HH12  ARG  99          HH22      ARG  99 114.892  -9.328  -7.584
  786   HH21  ARG  99          HH11      ARG  99 116.045  -9.090  -4.324
  787   HH22  ARG  99          HH12      ARG  99 116.481  -9.346  -5.982
  788    H    ARG 100           HN       ARG 100 108.776  -6.259  -8.413
  789    HA   ARG 100           HA       ARG 100 110.047  -5.061 -10.618
  790    HB2  ARG 100           HB2      ARG 100 107.167  -5.783 -10.104
  791    HB3  ARG 100           HB1      ARG 100 107.749  -5.169 -11.649
  792    HG2  ARG 100           HG2      ARG 100 109.413  -7.024 -11.722
  793    HG3  ARG 100           HG1      ARG 100 108.719  -7.668 -10.234
  794    HD2  ARG 100           HD2      ARG 100 107.852  -8.710 -12.390
  795    HD3  ARG 100           HD1      ARG 100 106.621  -8.104 -11.287
  796    HE   ARG 100           HE       ARG 100 106.026  -6.569 -12.914
  797   HH11  ARG 100          HH21      ARG 100 109.227  -7.757 -13.468
  798   HH12  ARG 100          HH22      ARG 100 109.412  -6.951 -14.990
  799   HH21  ARG 100          HH11      ARG 100 106.260  -5.506 -14.907
  800   HH22  ARG 100          HH12      ARG 100 107.731  -5.676 -15.805
  801    H    LEU 101           HN       LEU 101 107.649  -3.802  -8.346
  802    HA   LEU 101           HA       LEU 101 107.190  -1.369  -9.774
  803    HB2  LEU 101           HB2      LEU 101 106.475  -2.442  -7.081
  804    HB3  LEU 101           HB1      LEU 101 106.427  -0.693  -7.283
  805    HG   LEU 101           HG       LEU 101 104.839  -0.852  -9.070
  806   HD11  LEU 101          HD11      LEU 101 104.042  -3.304  -9.639
  807   HD12  LEU 101          HD12      LEU 101 105.647  -3.747  -9.058
  808   HD13  LEU 101          HD13      LEU 101 105.475  -2.644 -10.423
  809   HD21  LEU 101          HD21      LEU 101 102.964  -1.768  -7.927
  810   HD22  LEU 101          HD22      LEU 101 104.079  -1.283  -6.649
  811   HD23  LEU 101          HD23      LEU 101 103.955  -2.980  -7.114
  812    H    VAL 102           HN       VAL 102 109.418  -2.358  -7.239
  813    HA   VAL 102           HA       VAL 102 110.407   0.245  -6.647
  814    HB   VAL 102           HB       VAL 102 111.694  -2.471  -6.292
  815   HG11  VAL 102          HG11      VAL 102 112.990  -1.198  -4.507
  816   HG12  VAL 102          HG12      VAL 102 112.380   0.286  -5.240
  817   HG13  VAL 102          HG13      VAL 102 113.414  -0.797  -6.172
  818   HG21  VAL 102          HG21      VAL 102 110.306  -0.737  -4.238
  819   HG22  VAL 102          HG22      VAL 102 110.788  -2.426  -4.080
  820   HG23  VAL 102          HG23      VAL 102 109.456  -1.983  -5.149
  821    H    GLU 103           HN       GLU 103 111.436  -2.308  -8.882
  822    HA   GLU 103           HA       GLU 103 113.841  -1.077  -9.711
  823    HB2  GLU 103           HB2      GLU 103 112.887  -3.509 -10.091
  824    HB3  GLU 103           HB1      GLU 103 112.275  -2.806 -11.586
  825    HG2  GLU 103           HG2      GLU 103 114.546  -2.049 -12.170
  826    HG3  GLU 103           HG1      GLU 103 115.164  -2.737 -10.670
  827    H    LEU 104           HN       LEU 104 110.580  -1.045 -11.166
  828    HA   LEU 104           HA       LEU 104 111.319   0.644 -13.342
  829    HB2  LEU 104           HB2      LEU 104 108.710  -0.239 -12.153
  830    HB3  LEU 104           HB1      LEU 104 108.742   1.018 -13.387
  831    HG   LEU 104           HG       LEU 104 109.712  -0.434 -14.998
  832   HD11  LEU 104          HD11      LEU 104 110.316  -2.223 -12.642
  833   HD12  LEU 104          HD12      LEU 104 111.447  -1.539 -13.806
  834   HD13  LEU 104          HD13      LEU 104 110.347  -2.824 -14.295
  835   HD21  LEU 104          HD21      LEU 104 107.801  -2.152 -13.390
  836   HD22  LEU 104          HD22      LEU 104 108.125  -2.274 -15.118
  837   HD23  LEU 104          HD23      LEU 104 107.299  -0.855 -14.475
  838    H    ASN 105           HN       ASN 105 109.800   1.305 -10.174
  839    HA   ASN 105           HA       ASN 105 109.336   4.046 -10.624
  840    HB2  ASN 105           HB2      ASN 105 109.668   2.352  -8.167
  841    HB3  ASN 105           HB1      ASN 105 109.555   4.105  -8.019
  842   HD21  ASN 105          HD21      ASN 105 107.772   1.214  -9.103
  843   HD22  ASN 105          HD22      ASN 105 106.249   1.962  -9.116
  844    H    LEU 106           HN       LEU 106 112.232   2.282  -9.845
  845    HA   LEU 106           HA       LEU 106 113.796   4.297  -8.711
  846    HB2  LEU 106           HB2      LEU 106 114.283   1.739  -9.263
  847    HB3  LEU 106           HB1      LEU 106 115.046   2.436 -10.691
  848    HG   LEU 106           HG       LEU 106 116.150   4.071  -8.914
  849   HD11  LEU 106          HD11      LEU 106 115.591   1.576  -7.278
  850   HD12  LEU 106          HD12      LEU 106 114.844   3.150  -7.009
  851   HD13  LEU 106          HD13      LEU 106 116.579   2.946  -6.774
  852   HD21  LEU 106          HD21      LEU 106 117.532   2.683 -10.273
  853   HD22  LEU 106          HD22      LEU 106 116.933   1.211  -9.510
  854   HD23  LEU 106          HD23      LEU 106 117.989   2.301  -8.613
  855    H    GLY 107           HN       GLY 107 112.522   4.005 -11.873
  856    HA2  GLY 107           HA2      GLY 107 114.103   6.351 -12.741
  857    HA3  GLY 107           HA1      GLY 107 113.833   4.989 -13.823
  858    H    ASP 108           HN       ASP 108 113.023   7.391 -14.716
  859    HA   ASP 108           HA       ASP 108 110.081   7.181 -14.585
  860    HB2  ASP 108           HB2      ASP 108 109.852   9.587 -14.505
  861    HB3  ASP 108           HB1      ASP 108 110.861   9.073 -13.154
  862    H    GLU 109           HN       GLU 109 112.753   8.846 -16.290
  863    HA   GLU 109           HA       GLU 109 112.031   7.737 -18.815
  864    HB2  GLU 109           HB2      GLU 109 110.193   9.455 -18.406
  865    HB3  GLU 109           HB1      GLU 109 111.446  10.686 -18.554
  866    HG2  GLU 109           HG2      GLU 109 110.668  10.534 -20.752
  867    HG3  GLU 109           HG1      GLU 109 112.044   9.434 -20.782
  868    H    GLU 110           HN       GLU 110 113.691  10.263 -16.999
  869    HA   GLU 110           HA       GLU 110 116.051   9.861 -18.698
  870    HB2  GLU 110           HB2      GLU 110 116.411  12.270 -18.957
  871    HB3  GLU 110           HB1      GLU 110 114.880  11.787 -19.682
  872    HG2  GLU 110           HG2      GLU 110 114.367  12.416 -16.937
  873    HG3  GLU 110           HG1      GLU 110 115.328  13.729 -17.613
  874    H    LEU 111           HN       LEU 111 116.968  12.485 -17.276
  875    HA   LEU 111           HA       LEU 111 117.962  11.084 -14.890
  876    HB2  LEU 111           HB2      LEU 111 118.897  13.731 -16.011
  877    HB3  LEU 111           HB1      LEU 111 119.723  12.708 -14.836
  878    HG   LEU 111           HG       LEU 111 119.359  10.943 -16.906
  879   HD11  LEU 111          HD11      LEU 111 119.717  11.992 -18.999
  880   HD12  LEU 111          HD12      LEU 111 120.162  13.525 -18.250
  881   HD13  LEU 111          HD13      LEU 111 118.484  12.987 -18.225
  882   HD21  LEU 111          HD21      LEU 111 121.629  12.829 -16.251
  883   HD22  LEU 111          HD22      LEU 111 121.782  11.602 -17.508
  884   HD23  LEU 111          HD23      LEU 111 121.473  11.123 -15.839
  885    H    LEU 112           HN       LEU 112 117.855  14.563 -15.045
  886    HA   LEU 112           HA       LEU 112 116.765  16.140 -13.776
  887    HB2  LEU 112           HB2      LEU 112 114.740  14.737 -14.640
  888    HB3  LEU 112           HB1      LEU 112 114.699  14.098 -12.997
  889    HG   LEU 112           HG       LEU 112 114.893  16.714 -12.399
  890   HD11  LEU 112          HD11      LEU 112 114.964  17.314 -14.839
  891   HD12  LEU 112          HD12      LEU 112 113.634  18.076 -13.968
  892   HD13  LEU 112          HD13      LEU 112 113.328  16.676 -14.997
  893   HD21  LEU 112          HD21      LEU 112 112.307  16.699 -12.436
  894   HD22  LEU 112          HD22      LEU 112 113.107  15.434 -11.504
  895   HD23  LEU 112          HD23      LEU 112 112.452  15.073 -13.101
  896    H    GLU 113           HN       GLU 113 117.279  16.845 -11.788
  897    HA   GLU 113           HA       GLU 113 118.559  15.144  -9.916
  898    HB2  GLU 113           HB2      GLU 113 118.718  17.084  -8.503
  899    HB3  GLU 113           HB1      GLU 113 118.967  17.612 -10.167
  900    HG2  GLU 113           HG2      GLU 113 116.415  18.071 -10.186
  901    HG3  GLU 113           HG1      GLU 113 116.527  17.964  -8.430
  902    H    ARG 114           HN       ARG 114 117.694  13.800  -8.489
  903    HA   ARG 114           HA       ARG 114 115.508  14.438  -6.808
  904    HB2  ARG 114           HB2      ARG 114 114.456  13.931  -9.172
  905    HB3  ARG 114           HB1      ARG 114 114.741  12.253  -8.716
  906    HG2  ARG 114           HG2      ARG 114 113.520  12.713  -6.557
  907    HG3  ARG 114           HG1      ARG 114 113.105  14.303  -7.196
  908    HD2  ARG 114           HD2      ARG 114 112.493  11.835  -8.806
  909    HD3  ARG 114           HD1      ARG 114 111.417  12.325  -7.502
  910    HE   ARG 114           HE       ARG 114 112.067  14.446  -9.371
  911   HH11  ARG 114          HH21      ARG 114 109.989  11.807  -8.546
  912   HH12  ARG 114          HH22      ARG 114 108.647  12.391  -9.472
  913   HH21  ARG 114          HH11      ARG 114 110.313  15.219 -10.594
  914   HH22  ARG 114          HH12      ARG 114 108.831  14.322 -10.632
  915    H    GLU 115           HN       GLU 115 118.055  13.488  -6.353
  916    HA   GLU 115           HA       GLU 115 117.465  10.966  -5.011
  917    HB2  GLU 115           HB2      GLU 115 118.457  10.546  -7.375
  918    HB3  GLU 115           HB1      GLU 115 119.971  11.111  -6.668
  919    HG2  GLU 115           HG2      GLU 115 118.275   8.865  -5.536
  920    HG3  GLU 115           HG1      GLU 115 119.710   8.632  -6.532
  921    H    LEU 116           HN       LEU 116 120.164  13.162  -5.820
  922    HA   LEU 116           HA       LEU 116 121.529  12.761  -3.362
  923    HB2  LEU 116           HB2      LEU 116 122.643  13.593  -5.396
  924    HB3  LEU 116           HB1      LEU 116 121.713  15.087  -5.288
  925    HG   LEU 116           HG       LEU 116 122.977  14.516  -2.739
  926   HD11  LEU 116          HD11      LEU 116 124.676  13.327  -4.011
  927   HD12  LEU 116          HD12      LEU 116 125.330  14.882  -3.496
  928   HD13  LEU 116          HD13      LEU 116 124.794  14.661  -5.162
  929   HD21  LEU 116          HD21      LEU 116 123.441  16.745  -4.743
  930   HD22  LEU 116          HD22      LEU 116 123.813  16.791  -3.019
  931   HD23  LEU 116          HD23      LEU 116 122.135  16.721  -3.558
  932    H    ALA 117           HN       ALA 117 119.136  15.149  -4.444
  933    HA   ALA 117           HA       ALA 117 119.433  16.853  -2.267
  934    HB1  ALA 117           HB1      ALA 117 118.166  17.322  -4.443
  935    HB2  ALA 117           HB2      ALA 117 117.417  17.932  -2.967
  936    HB3  ALA 117           HB3      ALA 117 116.809  16.459  -3.720
  937    H    LEU 118           HN       LEU 118 118.004  13.817  -2.581
  938    HA   LEU 118           HA       LEU 118 116.017  13.825  -0.539
  939    HB2  LEU 118           HB2      LEU 118 117.825  11.504  -1.272
  940    HB3  LEU 118           HB1      LEU 118 116.248  11.415  -0.491
  941    HG   LEU 118           HG       LEU 118 116.802  12.398  -3.305
  942   HD11  LEU 118          HD11      LEU 118 115.462  10.429  -3.952
  943   HD12  LEU 118          HD12      LEU 118 115.290   9.985  -2.254
  944   HD13  LEU 118          HD13      LEU 118 116.877   9.942  -3.018
  945   HD21  LEU 118          HD21      LEU 118 114.353  12.454  -1.552
  946   HD22  LEU 118          HD22      LEU 118 114.179  12.303  -3.300
  947   HD23  LEU 118          HD23      LEU 118 114.985  13.713  -2.614
  948    H    LEU 119           HN       LEU 119 119.463  13.470  -0.582
  949    HA   LEU 119           HA       LEU 119 119.930  12.699   2.093
  950    HB2  LEU 119           HB2      LEU 119 121.686  14.567   0.480
  951    HB3  LEU 119           HB1      LEU 119 122.184  13.480   1.778
  952    HG   LEU 119           HG       LEU 119 121.049  12.638  -0.907
  953   HD11  LEU 119          HD11      LEU 119 123.248  11.804  -1.384
  954   HD12  LEU 119          HD12      LEU 119 123.794  12.135   0.260
  955   HD13  LEU 119          HD13      LEU 119 123.442  13.470  -0.836
  956   HD21  LEU 119          HD21      LEU 119 121.854  10.343   0.033
  957   HD22  LEU 119          HD22      LEU 119 120.310  10.986   0.590
  958   HD23  LEU 119          HD23      LEU 119 121.743  11.132   1.608
  959    H    VAL 120           HN       VAL 120 119.750  15.936   0.608
  960    HA   VAL 120           HA       VAL 120 119.965  17.494   2.974
  961    HB   VAL 120           HB       VAL 120 118.309  18.151   0.533
  962   HG11  VAL 120          HG11      VAL 120 119.702  19.741   2.693
  963   HG12  VAL 120          HG12      VAL 120 118.006  19.799   2.216
  964   HG13  VAL 120          HG13      VAL 120 119.244  20.469   1.156
  965   HG21  VAL 120          HG21      VAL 120 120.542  17.363  -0.173
  966   HG22  VAL 120          HG22      VAL 120 121.297  18.484   0.958
  967   HG23  VAL 120          HG23      VAL 120 120.385  19.102  -0.419
  968    H    SER 121           HN       SER 121 117.724  15.180   2.323
  969    HA   SER 121           HA       SER 121 115.660  16.564   3.949
  970    HB2  SER 121           HB2      SER 121 113.999  15.373   2.859
  971    HB3  SER 121           HB1      SER 121 115.169  15.519   1.551
  972    HG   SER 121           HG       SER 121 114.204  13.326   2.372
  973    H    ALA 122           HN       ALA 122 117.424  13.576   3.385
  974    HA   ALA 122           HA       ALA 122 117.053  12.824   6.229
  975    HB1  ALA 122           HB1      ALA 122 115.898  11.056   5.415
  976    HB2  ALA 122           HB2      ALA 122 117.473  10.432   4.925
  977    HB3  ALA 122           HB3      ALA 122 116.475  11.321   3.772
  978    H    HIS 123           HN       HIS 123 119.123  13.872   6.634
  979    HA   HIS 123           HA       HIS 123 121.440  12.874   5.211
  980    HB2  HIS 123           HB2      HIS 123 122.524  14.704   6.009
  981    HB3  HIS 123           HB1      HIS 123 120.903  15.266   6.398
  982    HD2  HIS 123           HD2      HIS 123 120.549  13.333   9.156
  983    HE1  HIS 123           HE1      HIS 123 123.910  15.499  10.503
  984    HE2  HIS 123           HE2      HIS 123 121.973  14.029  11.230
  985    H    ASP 124           HN       ASP 124 123.280  12.919   7.378
  986    HA   ASP 124           HA       ASP 124 122.957  11.435   9.596
  987    HB2  ASP 124           HB2      ASP 124 123.553   9.056   8.657
  988    HB3  ASP 124           HB1      ASP 124 121.872   9.578   8.681
  989    H    ASP 125           HN       ASP 125 124.769  11.751   6.627
  990    HA   ASP 125           HA       ASP 125 127.291  11.007   7.895
  991    HB2  ASP 125           HB2      ASP 125 128.174  11.763   5.585
  992    HB3  ASP 125           HB1      ASP 125 127.187  10.303   5.657
  993   H5'1  C2E 501          H5'1      C2E 501 105.526   3.335  10.402
  994   H5'2  C2E 501          H5'2      C2E 501 104.785   1.940  11.203
  995    H4'  C2E 501           H4'      C2E 501 107.078   0.768  10.493
  996    H3'  C2E 501           H3'      C2E 501 106.904   3.166   8.684
  997    H2'  C2E 501           H2'      C2E 501 107.025   1.939   6.704
  998   HO2'  C2E 501          HO2'      C2E 501 107.578  -0.337   6.758
  999    H1'  C2E 501           H1'      C2E 501 105.359  -0.071   7.318
 1000    H8   C2E 501           H8       C2E 501 103.676   2.523   9.320
 1001    HN1  C2E 501           HN1      C2E 501 103.221   3.833   3.075
 1002   HN21  C2E 501          HN21      C2E 501 104.584   2.507   1.919
 1003   HN22  C2E 501          HN22      C2E 501 105.595   1.306   2.691
 1004   H511  C2E 501          H511      C2E 501 108.229   4.560  10.025
 1005   H512  C2E 501          H512      C2E 501 109.922   4.568  10.566
 1006    H4A  C2E 501           H4A      C2E 501 109.072   5.256  12.859
 1007    H3A  C2E 501           H3A      C2E 501 106.403   5.337  11.437
 1008    H2A  C2E 501           H2A      C2E 501 105.874   7.358  12.410
 1009   HO2A  C2E 501          HO2A      C2E 501 107.468   8.190  14.087
 1010    H1A  C2E 501           H1A      C2E 501 108.296   8.599  12.210
 1011    H81  C2E 501           H81      C2E 501 108.363   6.695   9.039
 1012   HN11  C2E 501          HN11      C2E 501 104.283  11.624   8.751
 1013   HN24  C2E 501          HN24      C2E 501 104.549  11.649  12.234
 1014   HN23  C2E 501          HN23      C2E 501 103.827  12.353  10.804
 1015   H5'1  C2E 502          H5'1      C2E 502 101.215  10.345   4.331
 1016   H5'2  C2E 502          H5'2      C2E 502  99.956  11.566   4.051
 1017    H4'  C2E 502           H4'      C2E 502  99.765  12.059   6.274
 1018    H3'  C2E 502           H3'      C2E 502 102.739  11.572   6.458
 1019    H2'  C2E 502           H2'      C2E 502 102.460  11.276   8.825
 1020   HO2'  C2E 502          HO2'      C2E 502  99.968  11.517   9.393
 1021    H1'  C2E 502           H1'      C2E 502 100.296   9.675   8.652
 1022    H8   C2E 502           H8       C2E 502 102.479   8.856   5.634
 1023    HN1  C2E 502           HN1      C2E 502 104.263   5.903  11.017
 1024   HN21  C2E 502          HN21      C2E 502 103.154   6.702  12.748
 1025   HN22  C2E 502          HN22      C2E 502 101.969   7.984  12.598
 1026   H511  C2E 502          H511      C2E 502 103.721  16.635   6.020
 1027   H512  C2E 502          H512      C2E 502 102.451  15.524   5.466
 1028    H4A  C2E 502           H4A      C2E 502 103.999  16.206   3.645
 1029    H3A  C2E 502           H3A      C2E 502 103.894  13.279   4.435
 1030    H2A  C2E 502           H2A      C2E 502 105.509  12.776   2.805
 1031   HO2A  C2E 502          HO2A      C2E 502 105.539  13.815   0.956
 1032    H1A  C2E 502           H1A      C2E 502 107.110  14.992   3.134
 1033    H81  C2E 502           H81      C2E 502 106.433  14.167   6.641
 1034   HN11  C2E 502          HN11      C2E 502 110.365   9.984   3.816
 1035   HN24  C2E 502          HN24      C2E 502 110.214  10.173   1.610
 1036   HN23  C2E 502          HN23      C2E 502 109.166  11.343   0.840
  Start of MODEL    5
    1    H    MET   1           H        MET   1 105.791  25.016   1.850
    2    HA   MET   1           HA       MET   1 105.671  23.136   3.000
    3    HB2  MET   1           HB2      MET   1 108.669  23.369   3.347
    4    HB3  MET   1           HB1      MET   1 107.711  21.903   3.125
    5    HG2  MET   1           HG2      MET   1 108.511  22.180   0.969
    6    HG3  MET   1           HG1      MET   1 107.023  23.118   0.854
    7    HE1  MET   1           HE1      MET   1 109.601  23.398  -1.066
    8    HE2  MET   1           HE2      MET   1 109.500  25.141  -1.310
    9    HE3  MET   1           HE3      MET   1 108.024  24.182  -1.236
   10    H    SER   2           HN       SER   2 107.942  22.495   5.024
   11    HA   SER   2           HA       SER   2 107.470  24.298   7.216
   12    HB2  SER   2           HB2      SER   2 105.408  23.265   7.574
   13    HB3  SER   2           HB1      SER   2 105.988  21.692   7.033
   14    HG   SER   2           HG       SER   2 106.744  21.311   8.971
   15    H    ASP   3           HN       ASP   3 108.575  23.581   9.182
   16    HA   ASP   3           HA       ASP   3 110.900  21.907   8.490
   17    HB2  ASP   3           HB2      ASP   3 112.023  22.952  10.433
   18    HB3  ASP   3           HB1      ASP   3 111.459  24.171   9.292
   19    H    GLN   4           HN       GLN   4 108.163  21.066   9.304
   20    HA   GLN   4           HA       GLN   4 108.959  19.405  11.616
   21    HB2  GLN   4           HB2      GLN   4 106.374  20.763  10.998
   22    HB3  GLN   4           HB1      GLN   4 106.263  19.141  11.682
   23    HG2  GLN   4           HG2      GLN   4 107.965  21.331  12.897
   24    HG3  GLN   4           HG1      GLN   4 106.299  21.021  13.385
   25   HE21  GLN   4          HE21      GLN   4 107.523  18.050  12.505
   26   HE22  GLN   4          HE22      GLN   4 108.067  17.518  14.022
   27    H    HIS   5           HN       HIS   5 108.113  19.476   8.353
   28    HA   HIS   5           HA       HIS   5 107.051  16.809   8.146
   29    HB2  HIS   5           HB2      HIS   5 108.249  18.634   6.052
   30    HB3  HIS   5           HB1      HIS   5 107.404  17.127   5.718
   31    HD2  HIS   5           HD2      HIS   5 105.264  18.301   8.403
   32    HE1  HIS   5           HE1      HIS   5 103.882  20.571   5.123
   33    HE2  HIS   5           HE2      HIS   5 103.341  19.807   7.484
   34    H    ASP   6           HN       ASP   6 109.599  17.130   9.606
   35    HA   ASP   6           HA       ASP   6 111.850  16.390   8.197
   36    HB2  ASP   6           HB2      ASP   6 111.139  15.167  10.866
   37    HB3  ASP   6           HB1      ASP   6 112.741  15.561  10.243
   38    H    GLU   7           HN       GLU   7 112.870  14.236   7.969
   39    HA   GLU   7           HA       GLU   7 110.854  12.273   7.149
   40    HB2  GLU   7           HB2      GLU   7 112.221  12.494   5.330
   41    HB3  GLU   7           HB1      GLU   7 113.630  12.905   6.305
   42    HG2  GLU   7           HG2      GLU   7 112.484  10.121   6.418
   43    HG3  GLU   7           HG1      GLU   7 113.563  10.583   5.107
   44    H    ARG   8           HN       ARG   8 110.593  10.369   8.086
   45    HA   ARG   8           HA       ARG   8 112.439   9.583  10.269
   46    HB2  ARG   8           HB2      ARG   8 109.447   9.283  10.167
   47    HB3  ARG   8           HB1      ARG   8 110.500   8.743  11.474
   48    HG2  ARG   8           HG2      ARG   8 110.734  10.845  12.322
   49    HG3  ARG   8           HG1      ARG   8 110.891  11.573  10.728
   50    HD2  ARG   8           HD2      ARG   8 108.211  10.523  11.472
   51    HD3  ARG   8           HD1      ARG   8 108.746  11.988  12.275
   52    HE   ARG   8           HE       ARG   8 108.746  11.771   9.325
   53   HH11  ARG   8          HH21      ARG   8 107.804  13.315  12.293
   54   HH12  ARG   8          HH22      ARG   8 107.118  14.697  11.512
   55   HH21  ARG   8          HH11      ARG   8 107.839  13.592   8.314
   56   HH22  ARG   8          HH12      ARG   8 107.133  14.853   9.268
   57    H    ARG   9           HN       ARG   9 110.855   8.721   7.384
   58    HA   ARG   9           HA       ARG   9 111.278   5.828   7.864
   59    HB2  ARG   9           HB2      ARG   9 109.950   5.761   5.552
   60    HB3  ARG   9           HB1      ARG   9 109.111   5.871   7.093
   61    HG2  ARG   9           HG2      ARG   9 109.085   8.351   6.855
   62    HG3  ARG   9           HG1      ARG   9 109.803   8.162   5.258
   63    HD2  ARG   9           HD2      ARG   9 107.888   7.096   4.393
   64    HD3  ARG   9           HD1      ARG   9 107.259   6.731   5.994
   65    HE   ARG   9           HE       ARG   9 106.876   9.190   6.238
   66   HH11  ARG   9          HH21      ARG   9 107.176   7.752   3.089
   67   HH12  ARG   9          HH22      ARG   9 106.313   9.021   2.290
   68   HH21  ARG   9          HH11      ARG   9 105.748  10.838   5.180
   69   HH22  ARG   9          HH12      ARG   9 105.507  10.760   3.467
   70    H    ARG  10           HN       ARG  10 113.412   5.675   7.504
   71    HA   ARG  10           HA       ARG  10 115.442   6.190   6.331
   72    HB2  ARG  10           HB2      ARG  10 115.266   4.358   4.370
   73    HB3  ARG  10           HB1      ARG  10 115.452   3.928   6.067
   74    HG2  ARG  10           HG2      ARG  10 112.661   4.342   5.069
   75    HG3  ARG  10           HG1      ARG  10 113.501   2.884   4.550
   76    HD2  ARG  10           HD2      ARG  10 113.792   2.123   6.765
   77    HD3  ARG  10           HD1      ARG  10 113.434   3.704   7.452
   78    HE   ARG  10           HE       ARG  10 111.094   3.234   6.383
   79   HH11  ARG  10          HH21      ARG  10 113.242   0.961   7.884
   80   HH12  ARG  10          HH22      ARG  10 111.977  -0.121   8.359
   81   HH21  ARG  10          HH11      ARG  10 109.444   1.815   7.005
   82   HH22  ARG  10          HH12      ARG  10 109.832   0.362   7.865
   83    H    PHE  11           HN       PHE  11 113.625   5.299   3.449
   84    HA   PHE  11           HA       PHE  11 114.193   7.975   2.320
   85    HB2  PHE  11           HB2      PHE  11 115.151   5.393   1.469
   86    HB3  PHE  11           HB1      PHE  11 114.129   6.079   0.209
   87    HD1  PHE  11           HD1      PHE  11 117.166   6.608   2.261
   88    HD2  PHE  11           HD2      PHE  11 114.771   8.083  -0.988
   89    HE1  PHE  11           HE1      PHE  11 119.003   8.139   1.600
   90    HE2  PHE  11           HE2      PHE  11 116.608   9.614  -1.646
   91    HZ   PHE  11           HZ       PHE  11 118.725   9.642  -0.352
   92    H    HIS  12           HN       HIS  12 112.891   8.319   0.255
   93    HA   HIS  12           HA       HIS  12 110.137   8.238   0.893
   94    HB2  HIS  12           HB2      HIS  12 111.343   8.695  -1.841
   95    HB3  HIS  12           HB1      HIS  12 109.781   9.261  -1.251
   96    HD2  HIS  12           HD2      HIS  12 113.548   9.832  -0.012
   97    HE1  HIS  12           HE1      HIS  12 111.360  13.416   0.414
   98    HE2  HIS  12           HE2      HIS  12 113.637  12.335   0.720
   99    H    ARG  13           HN       ARG  13 108.574   6.792   0.429
  100    HA   ARG  13           HA       ARG  13 109.346   4.252  -0.727
  101    HB2  ARG  13           HB2      ARG  13 106.527   5.016   0.019
  102    HB3  ARG  13           HB1      ARG  13 107.290   3.426   0.044
  103    HG2  ARG  13           HG2      ARG  13 108.644   4.001   1.941
  104    HG3  ARG  13           HG1      ARG  13 108.186   5.701   1.831
  105    HD2  ARG  13           HD2      ARG  13 105.881   3.896   2.051
  106    HD3  ARG  13           HD1      ARG  13 106.957   3.831   3.443
  107    HE   ARG  13           HE       ARG  13 106.159   6.489   2.506
  108   HH11  ARG  13          HH21      ARG  13 105.754   3.867   4.750
  109   HH12  ARG  13          HH22      ARG  13 104.951   4.836   5.937
  110   HH21  ARG  13          HH11      ARG  13 105.094   7.745   4.063
  111   HH22  ARG  13          HH12      ARG  13 104.575   7.023   5.549
  112    H    ILE  14           HN       ILE  14 107.391   3.296  -2.174
  113    HA   ILE  14           HA       ILE  14 107.447   4.949  -4.581
  114    HB   ILE  14           HB       ILE  14 106.750   2.074  -4.035
  115   HG12  ILE  14          HG12      ILE  14 108.583   1.822  -5.809
  116   HG13  ILE  14          HG11      ILE  14 108.896   3.540  -5.585
  117   HG21  ILE  14          HG21      ILE  14 106.582   2.092  -6.670
  118   HG22  ILE  14          HG22      ILE  14 106.138   3.781  -6.425
  119   HG23  ILE  14          HG23      ILE  14 105.173   2.501  -5.691
  120   HD11  ILE  14          HD11      ILE  14 110.310   1.918  -4.179
  121   HD12  ILE  14          HD12      ILE  14 108.840   1.618  -3.254
  122   HD13  ILE  14          HD13      ILE  14 109.528   3.240  -3.315
  123    H    ALA  15           HN       ALA  15 105.890   6.449  -4.600
  124    HA   ALA  15           HA       ALA  15 103.171   5.756  -3.715
  125    HB1  ALA  15           HB1      ALA  15 104.070   7.881  -2.928
  126    HB2  ALA  15           HB2      ALA  15 102.723   8.162  -4.033
  127    HB3  ALA  15           HB3      ALA  15 104.382   8.385  -4.590
  128    H    PHE  16           HN       PHE  16 101.771   5.028  -5.112
  129    HA   PHE  16           HA       PHE  16 101.550   6.200  -7.751
  130    HB2  PHE  16           HB2      PHE  16 101.704   4.177  -8.997
  131    HB3  PHE  16           HB1      PHE  16 103.142   4.233  -7.982
  132    HD1  PHE  16           HD2      PHE  16 102.594   3.234  -5.461
  133    HD2  PHE  16           HD1      PHE  16 100.709   2.087  -9.147
  134    HE1  PHE  16           HE2      PHE  16 101.989   1.044  -4.474
  135    HE2  PHE  16           HE1      PHE  16 100.113  -0.105  -8.160
  136    HZ   PHE  16           HZ       PHE  16 100.758  -0.628  -5.826
  137    H    ASP  17           HN       ASP  17  99.438   5.645  -8.735
  138    HA   ASP  17           HA       ASP  17  97.492   5.158  -6.603
  139    HB2  ASP  17           HB2      ASP  17  96.826   5.956  -9.429
  140    HB3  ASP  17           HB1      ASP  17  95.904   6.250  -7.955
  141    H    ALA  18           HN       ALA  18  95.959   3.531  -6.669
  142    HA   ALA  18           HA       ALA  18  95.389   1.895  -8.860
  143    HB1  ALA  18           HB1      ALA  18  97.560   0.891  -7.025
  144    HB2  ALA  18           HB2      ALA  18  97.509   0.859  -8.788
  145    HB3  ALA  18           HB3      ALA  18  96.489  -0.239  -7.855
  146    H    ASP  19           HN       ASP  19  94.341  -0.261  -8.016
  147    HA   ASP  19           HA       ASP  19  92.558   0.593  -5.825
  148    HB2  ASP  19           HB2      ASP  19  91.477  -0.103  -7.897
  149    HB3  ASP  19           HB1      ASP  19  92.304  -1.657  -7.837
  150    H    SER  20           HN       SER  20  92.475  -0.387  -3.891
  151    HA   SER  20           HA       SER  20  93.868  -2.965  -3.559
  152    HB2  SER  20           HB2      SER  20  94.639  -2.069  -1.297
  153    HB3  SER  20           HB1      SER  20  95.472  -1.437  -2.714
  154    HG   SER  20           HG       SER  20  93.227  -0.027  -2.104
  155    H    GLU  21           HN       GLU  21  93.097  -4.236  -1.846
  156    HA   GLU  21           HA       GLU  21  90.511  -3.398  -0.651
  157    HB2  GLU  21           HB2      GLU  21  91.158  -6.104  -1.872
  158    HB3  GLU  21           HB1      GLU  21  89.687  -5.716  -0.985
  159    HG2  GLU  21           HG2      GLU  21  90.237  -3.803  -3.145
  160    HG3  GLU  21           HG1      GLU  21  90.051  -5.451  -3.734
  161    H    ILE  22           HN       ILE  22  90.293  -3.889   1.464
  162    HA   ILE  22           HA       ILE  22  92.464  -5.524   2.656
  163    HB   ILE  22           HB       ILE  22  90.977  -3.154   3.800
  164   HG12  ILE  22          HG12      ILE  22  93.217  -3.228   2.123
  165   HG13  ILE  22          HG11      ILE  22  92.724  -1.873   3.130
  166   HG21  ILE  22          HG21      ILE  22  92.585  -3.482   5.734
  167   HG22  ILE  22          HG22      ILE  22  93.013  -5.038   5.028
  168   HG23  ILE  22          HG23      ILE  22  91.362  -4.740   5.572
  169   HD11  ILE  22          HD11      ILE  22  94.145  -2.652   4.951
  170   HD12  ILE  22          HD12      ILE  22  95.102  -2.521   3.480
  171   HD13  ILE  22          HD13      ILE  22  94.565  -4.105   4.042
  172    H    LEU  23           HN       LEU  23  91.962  -7.145   3.917
  173    HA   LEU  23           HA       LEU  23  89.122  -7.588   4.705
  174    HB2  LEU  23           HB2      LEU  23  90.157 -10.103   4.320
  175    HB3  LEU  23           HB1      LEU  23  89.083  -9.254   3.210
  176    HG   LEU  23           HG       LEU  23  91.993  -8.659   3.056
  177   HD11  LEU  23          HD11      LEU  23  92.139 -11.041   3.106
  178   HD12  LEU  23          HD12      LEU  23  92.173 -10.600   1.398
  179   HD13  LEU  23          HD13      LEU  23  90.687 -11.216   2.120
  180   HD21  LEU  23          HD21      LEU  23  90.006  -7.648   1.676
  181   HD22  LEU  23          HD22      LEU  23  90.086  -9.165   0.782
  182   HD23  LEU  23          HD23      LEU  23  91.487  -8.096   0.831
  183    H    GLN  24           HN       GLN  24  88.940  -7.782   6.731
  184    HA   GLN  24           HA       GLN  24  91.137  -8.996   8.327
  185    HB2  GLN  24           HB2      GLN  24  91.110  -6.678   8.903
  186    HB3  GLN  24           HB1      GLN  24  89.349  -6.650   8.996
  187    HG2  GLN  24           HG2      GLN  24  89.329  -7.963  10.982
  188    HG3  GLN  24           HG1      GLN  24  91.020  -8.421  10.785
  189   HE21  GLN  24          HE21      GLN  24  88.873  -5.960  12.031
  190   HE22  GLN  24          HE22      GLN  24  90.084  -4.932  12.631
  191    H    GLY  25           HN       GLY  25  90.319 -11.059   8.590
  192    HA2  GLY  25           HA2      GLY  25  89.061 -12.617   9.771
  193    HA3  GLY  25           HA1      GLY  25  87.976 -11.326  10.280
  194    H    GLU  26           HN       GLU  26  85.991 -11.653   9.536
  195    HA   GLU  26           HA       GLU  26  85.593 -12.987   6.933
  196    HB2  GLU  26           HB2      GLU  26  83.277 -13.281   7.692
  197    HB3  GLU  26           HB1      GLU  26  84.414 -13.944   8.865
  198    HG2  GLU  26           HG2      GLU  26  84.272 -11.609   9.996
  199    HG3  GLU  26           HG1      GLU  26  82.814 -11.395   9.029
  200    H    ARG  27           HN       ARG  27  86.170  -9.980   7.816
  201    HA   ARG  27           HA       ARG  27  83.955  -8.758   6.275
  202    HB2  ARG  27           HB2      ARG  27  85.861  -7.438   8.189
  203    HB3  ARG  27           HB1      ARG  27  84.445  -6.723   7.421
  204    HG2  ARG  27           HG2      ARG  27  83.003  -7.688   8.890
  205    HG3  ARG  27           HG1      ARG  27  83.858  -9.230   8.856
  206    HD2  ARG  27           HD2      ARG  27  85.513  -8.438  10.393
  207    HD3  ARG  27           HD1      ARG  27  84.908  -6.791  10.281
  208    HE   ARG  27           HE       ARG  27  82.776  -8.320  11.184
  209   HH11  ARG  27          HH21      ARG  27  86.005  -7.561  12.172
  210   HH12  ARG  27          HH22      ARG  27  85.674  -7.723  13.865
  211   HH21  ARG  27          HH11      ARG  27  82.333  -8.536  13.404
  212   HH22  ARG  27          HH12      ARG  27  83.594  -8.275  14.562
  213    H    ARG  28           HN       ARG  28  84.380  -7.735   4.426
  214    HA   ARG  28           HA       ARG  28  87.180  -7.039   3.733
  215    HB2  ARG  28           HB2      ARG  28  86.679  -9.002   2.458
  216    HB3  ARG  28           HB1      ARG  28  85.104  -8.359   1.976
  217    HG2  ARG  28           HG2      ARG  28  86.070  -6.719   0.570
  218    HG3  ARG  28           HG1      ARG  28  87.652  -6.872   1.332
  219    HD2  ARG  28           HD2      ARG  28  87.717  -9.256   0.442
  220    HD3  ARG  28           HD1      ARG  28  86.293  -8.851  -0.509
  221    HE   ARG  28           HE       ARG  28  88.287  -6.902  -0.969
  222   HH11  ARG  28          HH21      ARG  28  87.568 -10.241  -1.524
  223   HH12  ARG  28          HH22      ARG  28  88.494 -10.342  -2.983
  224   HH21  ARG  28          HH11      ARG  28  89.508  -7.026  -2.881
  225   HH22  ARG  28          HH12      ARG  28  89.595  -8.521  -3.752
  226    H    TRP  29           HN       TRP  29  87.436  -5.287   2.367
  227    HA   TRP  29           HA       TRP  29  85.145  -3.594   1.733
  228    HB2  TRP  29           HB2      TRP  29  87.429  -2.693   3.488
  229    HB3  TRP  29           HB1      TRP  29  86.113  -1.673   2.907
  230    HD1  TRP  29           HD1      TRP  29  83.559  -2.650   3.678
  231    HE1  TRP  29           HE1      TRP  29  82.885  -3.521   6.011
  232    HE3  TRP  29           HE3      TRP  29  88.164  -3.784   5.549
  233    HZ2  TRP  29           HZ2      TRP  29  84.146  -4.566   8.362
  234    HZ3  TRP  29           HZ3      TRP  29  88.406  -4.713   7.832
  235    HH2  TRP  29           HH2      TRP  29  86.402  -5.110   9.241
  236    H    GLU  30           HN       GLU  30  85.704  -1.847   0.304
  237    HA   GLU  30           HA       GLU  30  88.090  -2.447  -1.295
  238    HB2  GLU  30           HB2      GLU  30  85.997  -0.481  -2.158
  239    HB3  GLU  30           HB1      GLU  30  86.975  -1.579  -3.132
  240    HG2  GLU  30           HG2      GLU  30  84.844  -2.574  -3.180
  241    HG3  GLU  30           HG1      GLU  30  85.681  -3.472  -1.915
  242    H    VAL  31           HN       VAL  31  89.747  -0.934  -1.483
  243    HA   VAL  31           HA       VAL  31  89.296   1.798  -0.503
  244    HB   VAL  31           HB       VAL  31  91.365   1.661   0.881
  245   HG11  VAL  31          HG11      VAL  31  90.306   0.525   2.751
  246   HG12  VAL  31          HG12      VAL  31  89.235  -0.350   1.657
  247   HG13  VAL  31          HG13      VAL  31  89.073   1.397   1.839
  248   HG21  VAL  31          HG21      VAL  31  92.189  -0.421  -0.393
  249   HG22  VAL  31          HG22      VAL  31  91.073  -1.339   0.617
  250   HG23  VAL  31          HG23      VAL  31  92.392  -0.435   1.357
  251    H    LEU  32           HN       LEU  32  90.945   3.280  -1.120
  252    HA   LEU  32           HA       LEU  32  92.312   2.485  -3.608
  253    HB2  LEU  32           HB2      LEU  32  91.032   4.436  -3.973
  254    HB3  LEU  32           HB1      LEU  32  91.442   5.115  -2.401
  255    HG   LEU  32           HG       LEU  32  93.756   5.489  -3.141
  256   HD11  LEU  32          HD11      LEU  32  94.447   3.993  -4.722
  257   HD12  LEU  32          HD12      LEU  32  93.839   5.199  -5.851
  258   HD13  LEU  32          HD13      LEU  32  92.835   3.819  -5.414
  259   HD21  LEU  32          HD21      LEU  32  91.884   7.147  -3.611
  260   HD22  LEU  32          HD22      LEU  32  91.858   6.521  -5.259
  261   HD23  LEU  32          HD23      LEU  32  93.310   7.306  -4.638
  262    H    LEU  33           HN       LEU  33  94.490   2.257  -3.635
  263    HA   LEU  33           HA       LEU  33  95.925   2.739  -1.134
  264    HB2  LEU  33           HB2      LEU  33  96.327   0.593  -2.142
  265    HB3  LEU  33           HB1      LEU  33  96.687   1.323  -3.701
  266    HG   LEU  33           HG       LEU  33  98.425   2.478  -1.688
  267   HD11  LEU  33          HD11      LEU  33  97.976   0.327  -0.499
  268   HD12  LEU  33          HD12      LEU  33  99.657   0.498  -1.003
  269   HD13  LEU  33          HD13      LEU  33  98.565  -0.542  -1.917
  270   HD21  LEU  33          HD21      LEU  33  99.105   0.563  -3.939
  271   HD22  LEU  33          HD22      LEU  33 100.141   1.804  -3.236
  272   HD23  LEU  33          HD23      LEU  33  98.743   2.268  -4.206
  273    H    HIS  34           HN       HIS  34  97.086   4.460  -0.788
  274    HA   HIS  34           HA       HIS  34  97.597   6.320  -2.983
  275    HB2  HIS  34           HB2      HIS  34  97.682   6.481   0.027
  276    HB3  HIS  34           HB1      HIS  34  98.356   7.774  -0.975
  277    HD2  HIS  34           HD2      HIS  34  94.854   6.278  -0.016
  278    HE1  HIS  34           HE1      HIS  34  94.186   9.664  -2.445
  279    HE2  HIS  34           HE2      HIS  34  93.069   7.923  -0.973
  280    H    ASP  35           HN       ASP  35  99.436   4.212  -0.834
  281    HA   ASP  35           HA       ASP  35 101.573   4.284  -2.652
  282    HB2  ASP  35           HB2      ASP  35 103.304   5.502  -1.466
  283    HB3  ASP  35           HB1      ASP  35 101.886   6.554  -1.546
  284    H    VAL  36           HN       VAL  36 103.488   3.046  -1.935
  285    HA   VAL  36           HA       VAL  36 103.024   1.320   0.381
  286    HB   VAL  36           HB       VAL  36 101.891   0.353  -1.706
  287   HG11  VAL  36          HG11      VAL  36 103.252  -0.567  -3.425
  288   HG12  VAL  36          HG12      VAL  36 104.728  -0.337  -2.489
  289   HG13  VAL  36          HG13      VAL  36 103.889   1.058  -3.164
  290   HG21  VAL  36          HG21      VAL  36 102.658  -0.951   0.344
  291   HG22  VAL  36          HG22      VAL  36 104.102  -1.374  -0.571
  292   HG23  VAL  36          HG23      VAL  36 102.516  -1.883  -1.142
  293    H    SER  37           HN       SER  37 104.864  -0.261   0.646
  294    HA   SER  37           HA       SER  37 107.413   0.672  -0.448
  295    HB2  SER  37           HB2      SER  37 107.020   1.791   1.798
  296    HB3  SER  37           HB1      SER  37 107.004   0.182   2.515
  297    HG   SER  37           HG       SER  37 109.089   0.521   2.589
  298    H    LEU  38           HN       LEU  38 109.154  -1.020   0.289
  299    HA   LEU  38           HA       LEU  38 108.191  -3.557  -0.551
  300    HB2  LEU  38           HB2      LEU  38 110.583  -2.531  -0.752
  301    HB3  LEU  38           HB1      LEU  38 110.825  -3.211   0.857
  302    HG   LEU  38           HG       LEU  38 109.796  -5.390  -0.263
  303   HD11  LEU  38          HD11      LEU  38 109.435  -4.018  -2.424
  304   HD12  LEU  38          HD12      LEU  38 110.176  -5.609  -2.589
  305   HD13  LEU  38          HD13      LEU  38 111.177  -4.160  -2.648
  306   HD21  LEU  38          HD21      LEU  38 112.627  -4.386  -0.694
  307   HD22  LEU  38          HD22      LEU  38 112.128  -6.065  -0.894
  308   HD23  LEU  38          HD23      LEU  38 112.034  -5.300   0.692
  309    H    HIS  39           HN       HIS  39 107.702  -2.111   2.346
  310    HA   HIS  39           HA       HIS  39 107.032  -4.621   3.603
  311    HB2  HIS  39           HB2      HIS  39 108.456  -3.827   5.698
  312    HB3  HIS  39           HB1      HIS  39 109.176  -4.811   4.426
  313    HD2  HIS  39           HD2      HIS  39 108.842  -0.859   4.975
  314    HE1  HIS  39           HE1      HIS  39 112.609  -1.743   3.284
  315    HE2  HIS  39           HE2      HIS  39 111.115   0.121   4.142
  316    H    GLY  40           HN       GLY  40 105.604  -2.250   2.790
  317    HA2  GLY  40           HA2      GLY  40 104.023  -1.844   5.117
  318    HA3  GLY  40           HA1      GLY  40 105.040  -0.442   4.831
  319    H    ILE  41           HN       ILE  41 102.199  -0.370   4.716
  320    HA   ILE  41           HA       ILE  41 101.820   0.537   1.944
  321    HB   ILE  41           HB       ILE  41 100.743  -1.359   1.386
  322   HG12  ILE  41          HG12      ILE  41  98.673  -0.529   3.443
  323   HG13  ILE  41          HG11      ILE  41  98.842   0.237   1.862
  324   HG21  ILE  41          HG21      ILE  41 100.053  -3.063   3.031
  325   HG22  ILE  41          HG22      ILE  41 100.475  -1.961   4.341
  326   HG23  ILE  41          HG23      ILE  41 101.729  -2.574   3.262
  327   HD11  ILE  41          HD11      ILE  41  97.109  -1.579   1.924
  328   HD12  ILE  41          HD12      ILE  41  98.401  -2.732   2.256
  329   HD13  ILE  41          HD13      ILE  41  98.380  -1.846   0.731
  330    H    LEU  42           HN       LEU  42 100.253   2.026   1.633
  331    HA   LEU  42           HA       LEU  42  98.960   3.161   4.048
  332    HB2  LEU  42           HB2      LEU  42 100.885   4.408   2.486
  333    HB3  LEU  42           HB1      LEU  42  99.383   5.006   1.792
  334    HG   LEU  42           HG       LEU  42  99.934   5.052   4.765
  335   HD11  LEU  42          HD11      LEU  42 101.584   6.402   3.340
  336   HD12  LEU  42          HD12      LEU  42 100.688   7.306   4.557
  337   HD13  LEU  42          HD13      LEU  42 100.201   7.386   2.866
  338   HD21  LEU  42          HD21      LEU  42  98.122   6.689   4.784
  339   HD22  LEU  42          HD22      LEU  42  97.566   5.202   4.018
  340   HD23  LEU  42          HD23      LEU  42  97.992   6.597   3.027
  341    H    VAL  43           HN       VAL  43  96.776   3.474   3.869
  342    HA   VAL  43           HA       VAL  43  95.580   3.354   1.177
  343    HB   VAL  43           HB       VAL  43  93.869   1.765   1.961
  344   HG11  VAL  43          HG11      VAL  43  96.606   0.619   2.532
  345   HG12  VAL  43          HG12      VAL  43  96.103   1.065   0.902
  346   HG13  VAL  43          HG13      VAL  43  95.223  -0.182   1.785
  347   HG21  VAL  43          HG21      VAL  43  93.820   2.170   4.318
  348   HG22  VAL  43          HG22      VAL  43  95.548   1.852   4.478
  349   HG23  VAL  43          HG23      VAL  43  94.436   0.529   4.127
  350    H    GLY  44           HN       GLY  44  93.127   3.670   1.393
  351    HA2  GLY  44           HA2      GLY  44  92.676   6.070   3.078
  352    HA3  GLY  44           HA1      GLY  44  91.752   5.644   1.634
  353    H    GLN  45           HN       GLN  45  90.895   6.101   4.589
  354    HA   GLN  45           HA       GLN  45  90.065   3.468   5.371
  355    HB2  GLN  45           HB2      GLN  45  89.324   4.423   7.375
  356    HB3  GLN  45           HB1      GLN  45  90.745   5.358   6.928
  357    HG2  GLN  45           HG2      GLN  45  89.233   7.040   7.490
  358    HG3  GLN  45           HG1      GLN  45  89.014   6.936   5.746
  359   HE21  GLN  45          HE21      GLN  45  87.751   4.472   7.998
  360   HE22  GLN  45          HE22      GLN  45  86.114   4.836   7.732
  361    HA   PRO  46           HA       PRO  46  86.144   4.210   3.258
  362    HB2  PRO  46           HB2      PRO  46  85.207   1.667   3.186
  363    HB3  PRO  46           HB1      PRO  46  86.594   2.158   2.191
  364    HG2  PRO  46           HG2      PRO  46  86.555   0.650   4.764
  365    HG3  PRO  46           HG1      PRO  46  87.590   0.427   3.343
  366    HD2  PRO  46           HD2      PRO  46  88.323   1.831   5.670
  367    HD3  PRO  46           HD1      PRO  46  89.133   1.955   4.097
  368    H    GLN  47           HN       GLN  47  83.807   4.006   3.820
  369    HA   GLN  47           HA       GLN  47  83.322   4.572   6.554
  370    HB2  GLN  47           HB2      GLN  47  81.140   3.743   4.664
  371    HB3  GLN  47           HB1      GLN  47  81.107   4.962   5.938
  372    HG2  GLN  47           HG2      GLN  47  82.628   5.143   3.322
  373    HG3  GLN  47           HG1      GLN  47  81.195   6.066   3.764
  374   HE21  GLN  47          HE21      GLN  47  81.681   8.131   4.486
  375   HE22  GLN  47          HE22      GLN  47  83.113   8.575   5.282
  376    H    ASP  48           HN       ASP  48  82.791   1.653   4.617
  377    HA   ASP  48           HA       ASP  48  81.389   0.231   6.663
  378    HB2  ASP  48           HB2      ASP  48  82.705  -0.568   4.079
  379    HB3  ASP  48           HB1      ASP  48  82.009  -1.772   5.165
  380    H    TRP  49           HN       TRP  49  84.387   1.298   6.885
  381    HA   TRP  49           HA       TRP  49  86.051  -0.894   7.415
  382    HB2  TRP  49           HB2      TRP  49  86.750   1.494   7.205
  383    HB3  TRP  49           HB1      TRP  49  86.099   1.778   8.815
  384    HD1  TRP  49           HD1      TRP  49  87.448   0.932  10.837
  385    HE1  TRP  49           HE1      TRP  49  89.865  -0.037  11.106
  386    HE3  TRP  49           HE3      TRP  49  88.408  -0.169   6.001
  387    HZ2  TRP  49           HZ2      TRP  49  91.957  -1.165   9.324
  388    HZ3  TRP  49           HZ3      TRP  49  90.547  -1.178   5.300
  389    HH2  TRP  49           HH2      TRP  49  92.292  -1.675   6.973
  390    H    ASN  50           HN       ASN  50  84.160  -2.182   8.544
  391    HA   ASN  50           HA       ASN  50  84.037  -1.513  11.402
  392    HB2  ASN  50           HB2      ASN  50  81.908  -2.149  10.399
  393    HB3  ASN  50           HB1      ASN  50  82.605  -3.649   9.791
  394   HD21  ASN  50          HD21      ASN  50  83.367  -5.240  11.496
  395   HD22  ASN  50          HD22      ASN  50  82.579  -5.252  12.999
  396    H    GLY  51           HN       GLY  51  86.331  -1.928  11.684
  397    HA2  GLY  51           HA2      GLY  51  86.836  -4.776  12.224
  398    HA3  GLY  51           HA1      GLY  51  87.975  -3.905  11.201
  399    H    ASP  52           HN       ASP  52  88.202  -5.165  13.917
  400    HA   ASP  52           HA       ASP  52  88.623  -3.005  15.763
  401    HB2  ASP  52           HB2      ASP  52  88.021  -5.491  16.252
  402    HB3  ASP  52           HB1      ASP  52  89.757  -5.761  16.117
  403    HA   PRO  53           HA       PRO  53  92.673  -2.007  14.096
  404    HB2  PRO  53           HB2      PRO  53  93.461  -0.390  16.205
  405    HB3  PRO  53           HB1      PRO  53  92.485   0.151  14.827
  406    HG2  PRO  53           HG2      PRO  53  91.632  -0.608  17.570
  407    HG3  PRO  53           HG1      PRO  53  91.008   0.659  16.500
  408    HD2  PRO  53           HD2      PRO  53  89.703  -1.689  16.875
  409    HD3  PRO  53           HD1      PRO  53  89.641  -0.812  15.330
  410    H    GLN  54           HN       GLN  54  92.055  -3.424  17.205
  411    HA   GLN  54           HA       GLN  54  94.807  -3.906  17.825
  412    HB2  GLN  54           HB2      GLN  54  92.338  -5.249  18.946
  413    HB3  GLN  54           HB1      GLN  54  93.956  -5.290  19.647
  414    HG2  GLN  54           HG2      GLN  54  93.808  -2.709  19.640
  415    HG3  GLN  54           HG1      GLN  54  92.078  -2.946  19.400
  416   HE21  GLN  54          HE21      GLN  54  91.012  -4.467  21.084
  417   HE22  GLN  54          HE22      GLN  54  91.596  -4.384  22.676
  418    H    ARG  55           HN       ARG  55  92.400  -5.515  15.923
  419    HA   ARG  55           HA       ARG  55  93.964  -7.996  15.862
  420    HB2  ARG  55           HB2      ARG  55  91.204  -7.202  14.995
  421    HB3  ARG  55           HB1      ARG  55  91.969  -8.578  14.204
  422    HG2  ARG  55           HG2      ARG  55  90.601  -9.242  16.186
  423    HG3  ARG  55           HG1      ARG  55  92.301  -9.684  16.351
  424    HD2  ARG  55           HD2      ARG  55  91.424  -7.018  17.394
  425    HD3  ARG  55           HD1      ARG  55  91.007  -8.454  18.323
  426    HE   ARG  55           HE       ARG  55  93.589  -7.273  18.147
  427   HH11  ARG  55          HH21      ARG  55  91.928 -10.306  18.222
  428   HH12  ARG  55          HH22      ARG  55  93.249 -11.168  18.937
  429   HH21  ARG  55          HH11      ARG  55  95.325  -8.396  19.085
  430   HH22  ARG  55          HH12      ARG  55  95.171 -10.087  19.426
  431    HA   PRO  56           HA       PRO  56  96.122  -7.050  12.196
  432    HB2  PRO  56           HB2      PRO  56  96.183  -9.512  10.949
  433    HB3  PRO  56           HB1      PRO  56  97.209  -9.062  12.325
  434    HG2  PRO  56           HG2      PRO  56  94.686 -10.645  12.286
  435    HG3  PRO  56           HG1      PRO  56  96.161 -10.893  13.238
  436    HD2  PRO  56           HD2      PRO  56  93.928  -9.769  14.305
  437    HD3  PRO  56           HD1      PRO  56  95.562  -9.310  14.832
  438    H    PHE  57           HN       PHE  57  96.051  -6.928   9.892
  439    HA   PHE  57           HA       PHE  57  93.371  -7.248   8.681
  440    HB2  PHE  57           HB2      PHE  57  95.247  -4.886   8.384
  441    HB3  PHE  57           HB1      PHE  57  93.743  -5.114   7.496
  442    HD1  PHE  57           HD1      PHE  57  95.150  -4.754  10.937
  443    HD2  PHE  57           HD2      PHE  57  91.664  -4.482   8.447
  444    HE1  PHE  57           HE1      PHE  57  93.892  -3.711  12.804
  445    HE2  PHE  57           HE2      PHE  57  90.407  -3.448  10.310
  446    HZ   PHE  57           HZ       PHE  57  91.518  -3.063  12.489
  447    H    GLU  58           HN       GLU  58  93.499  -7.535   6.294
  448    HA   GLU  58           HA       GLU  58  96.216  -8.257   5.371
  449    HB2  GLU  58           HB2      GLU  58  93.739  -9.627   4.322
  450    HB3  GLU  58           HB1      GLU  58  95.417 -10.163   4.227
  451    HG2  GLU  58           HG2      GLU  58  95.144 -10.027   6.919
  452    HG3  GLU  58           HG1      GLU  58  93.477 -10.390   6.477
  453    H    ALA  59           HN       ALA  59  96.826  -7.416   3.360
  454    HA   ALA  59           HA       ALA  59  94.797  -5.736   2.005
  455    HB1  ALA  59           HB1      ALA  59  97.212  -4.799   1.153
  456    HB2  ALA  59           HB2      ALA  59  97.600  -5.310   2.795
  457    HB3  ALA  59           HB3      ALA  59  96.313  -4.140   2.516
  458    H    ARG  60           HN       ARG  60  94.423  -6.019  -0.097
  459    HA   ARG  60           HA       ARG  60  96.211  -7.818  -1.628
  460    HB2  ARG  60           HB2      ARG  60  93.212  -7.522  -1.954
  461    HB3  ARG  60           HB1      ARG  60  94.260  -8.634  -2.833
  462    HG2  ARG  60           HG2      ARG  60  94.413  -8.834   0.128
  463    HG3  ARG  60           HG1      ARG  60  92.874  -9.320  -0.581
  464    HD2  ARG  60           HD2      ARG  60  95.472 -10.323  -1.724
  465    HD3  ARG  60           HD1      ARG  60  94.736 -11.112  -0.332
  466    HE   ARG  60           HE       ARG  60  93.014 -10.704  -2.661
  467   HH11  ARG  60          HH21      ARG  60  95.065 -12.774  -0.795
  468   HH12  ARG  60          HH22      ARG  60  94.424 -14.239  -1.461
  469   HH21  ARG  60          HH11      ARG  60  92.175 -12.621  -3.546
  470   HH22  ARG  60          HH12      ARG  60  92.790 -14.153  -3.018
  471    H    LEU  61           HN       LEU  61  97.079  -6.828  -3.389
  472    HA   LEU  61           HA       LEU  61  95.865  -4.271  -4.242
  473    HB2  LEU  61           HB2      LEU  61  98.646  -5.200  -4.924
  474    HB3  LEU  61           HB1      LEU  61  98.004  -3.560  -4.921
  475    HG   LEU  61           HG       LEU  61  98.297  -5.267  -2.432
  476   HD11  LEU  61          HD11      LEU  61 100.077  -3.121  -3.615
  477   HD12  LEU  61          HD12      LEU  61 100.512  -4.792  -3.252
  478   HD13  LEU  61          HD13      LEU  61 100.189  -3.660  -1.939
  479   HD21  LEU  61          HD21      LEU  61  97.568  -2.377  -2.962
  480   HD22  LEU  61          HD22      LEU  61  98.065  -2.956  -1.371
  481   HD23  LEU  61          HD23      LEU  61  96.604  -3.596  -2.126
  482    H    TYR  62           HN       TYR  62  95.658  -3.790  -6.447
  483    HA   TYR  62           HA       TYR  62  95.922  -6.069  -8.302
  484    HB2  TYR  62           HB2      TYR  62  93.524  -4.231  -8.296
  485    HB3  TYR  62           HB1      TYR  62  93.743  -5.727  -9.203
  486    HD1  TYR  62           HD1      TYR  62  93.349  -4.322  -5.782
  487    HD2  TYR  62           HD2      TYR  62  93.267  -7.850  -8.229
  488    HE1  TYR  62           HE1      TYR  62  92.378  -5.608  -3.894
  489    HE2  TYR  62           HE2      TYR  62  92.292  -9.135  -6.344
  490    HH   TYR  62           HH       TYR  62  91.686  -7.589  -3.186
  491    H    LEU  63           HN       LEU  63  97.373  -5.418  -9.725
  492    HA   LEU  63           HA       LEU  63  97.358  -2.618 -10.677
  493    HB2  LEU  63           HB2      LEU  63  99.455  -3.838  -9.655
  494    HB3  LEU  63           HB1      LEU  63  99.578  -4.553 -11.260
  495    HG   LEU  63           HG       LEU  63  99.525  -1.594 -10.602
  496   HD11  LEU  63          HD11      LEU  63 101.686  -2.618 -10.163
  497   HD12  LEU  63          HD12      LEU  63 101.799  -1.679 -11.651
  498   HD13  LEU  63          HD13      LEU  63 101.657  -3.436 -11.725
  499   HD21  LEU  63          HD21      LEU  63  99.418  -3.101 -13.222
  500   HD22  LEU  63          HD22      LEU  63 100.028  -1.449 -13.130
  501   HD23  LEU  63          HD23      LEU  63  98.363  -1.801 -12.666
  502    H    GLY  64           HN       GLY  64  98.630  -5.525 -12.244
  503    HA2  GLY  64           HA2      GLY  64  97.358  -4.812 -14.749
  504    HA3  GLY  64           HA1      GLY  64  98.411  -6.200 -14.463
  505    H    LEU  65           HN       LEU  65  96.404  -6.999 -15.920
  506    HA   LEU  65           HA       LEU  65  94.037  -7.525 -14.398
  507    HB2  LEU  65           HB2      LEU  65  94.740  -9.029 -16.910
  508    HB3  LEU  65           HB1      LEU  65  93.155  -8.502 -16.342
  509    HG   LEU  65           HG       LEU  65  95.376  -6.706 -17.362
  510   HD11  LEU  65          HD11      LEU  65  93.902  -6.295 -19.236
  511   HD12  LEU  65          HD12      LEU  65  92.620  -7.254 -18.495
  512   HD13  LEU  65          HD13      LEU  65  94.092  -8.040 -19.068
  513   HD21  LEU  65          HD21      LEU  65  93.493  -4.972 -17.184
  514   HD22  LEU  65          HD22      LEU  65  94.218  -5.493 -15.662
  515   HD23  LEU  65          HD23      LEU  65  92.656  -6.141 -16.162
  516    H    ASP  66           HN       ASP  66  97.002  -9.302 -15.165
  517    HA   ASP  66           HA       ASP  66  96.050 -11.741 -13.809
  518    HB2  ASP  66           HB2      ASP  66  98.382 -11.049 -15.579
  519    HB3  ASP  66           HB1      ASP  66  98.256 -12.571 -14.698
  520    H    VAL  67           HN       VAL  67  97.272  -8.884 -12.821
  521    HA   VAL  67           HA       VAL  67  99.346 -10.059 -11.079
  522    HB   VAL  67           HB       VAL  67  98.824  -7.262 -12.050
  523   HG11  VAL  67          HG11      VAL  67 100.208  -8.136  -9.525
  524   HG12  VAL  67          HG12      VAL  67  99.198  -6.717  -9.807
  525   HG13  VAL  67          HG13      VAL  67 100.847  -6.761 -10.425
  526   HG21  VAL  67          HG21      VAL  67 100.345  -9.013 -13.193
  527   HG22  VAL  67          HG22      VAL  67 101.428  -8.780 -11.819
  528   HG23  VAL  67          HG23      VAL  67 101.042  -7.423 -12.879
  529    H    LEU  68           HN       LEU  68  98.175 -10.981  -9.499
  530    HA   LEU  68           HA       LEU  68  96.555  -9.178  -7.799
  531    HB2  LEU  68           HB2      LEU  68  95.063 -10.871  -8.400
  532    HB3  LEU  68           HB1      LEU  68  96.327 -12.094  -8.491
  533    HG   LEU  68           HG       LEU  68  96.530 -12.092  -6.043
  534   HD11  LEU  68          HD11      LEU  68  95.987  -9.866  -5.406
  535   HD12  LEU  68          HD12      LEU  68  94.647 -10.831  -4.799
  536   HD13  LEU  68          HD13      LEU  68  94.462  -9.903  -6.286
  537   HD21  LEU  68          HD21      LEU  68  94.960 -13.682  -6.881
  538   HD22  LEU  68          HD22      LEU  68  93.758 -12.432  -7.202
  539   HD23  LEU  68          HD23      LEU  68  94.142 -12.880  -5.540
  540    H    ILE  69           HN       ILE  69  97.662  -8.554  -6.047
  541    HA   ILE  69           HA       ILE  69  99.762 -10.359  -4.992
  542    HB   ILE  69           HB       ILE  69  99.497  -7.351  -4.957
  543   HG12  ILE  69          HG12      ILE  69 102.023  -8.548  -5.821
  544   HG13  ILE  69          HG11      ILE  69 100.668  -9.154  -6.770
  545   HG21  ILE  69          HG21      ILE  69 100.520  -7.490  -2.923
  546   HG22  ILE  69          HG22      ILE  69 101.957  -7.878  -3.869
  547   HG23  ILE  69          HG23      ILE  69 100.989  -9.170  -3.165
  548   HD11  ILE  69          HD11      ILE  69 101.511  -7.159  -7.849
  549   HD12  ILE  69          HD12      ILE  69 101.427  -6.253  -6.337
  550   HD13  ILE  69          HD13      ILE  69  99.944  -6.775  -7.137
  551    H    ARG  70           HN       ARG  70  99.897 -10.784  -2.822
  552    HA   ARG  70           HA       ARG  70  97.698  -9.791  -1.111
  553    HB2  ARG  70           HB2      ARG  70  98.585 -12.500  -0.431
  554    HB3  ARG  70           HB1      ARG  70  96.951 -11.878  -0.650
  555    HG2  ARG  70           HG2      ARG  70  97.165 -12.084  -3.082
  556    HG3  ARG  70           HG1      ARG  70  98.834 -12.629  -2.908
  557    HD2  ARG  70           HD2      ARG  70  98.210 -14.693  -2.020
  558    HD3  ARG  70           HD1      ARG  70  96.642 -14.103  -1.478
  559    HE   ARG  70           HE       ARG  70  96.792 -13.975  -4.312
  560   HH11  ARG  70          HH21      ARG  70  96.547 -16.181  -1.660
  561   HH12  ARG  70          HH22      ARG  70  95.705 -17.394  -2.565
  562   HH21  ARG  70          HH11      ARG  70  95.687 -15.562  -5.508
  563   HH22  ARG  70          HH12      ARG  70  95.218 -17.043  -4.742
  564    H    MET  71           HN       MET  71  98.318  -8.995   0.773
  565    HA   MET  71           HA       MET  71 100.902  -9.810   1.924
  566    HB2  MET  71           HB2      MET  71 100.269  -6.926   2.181
  567    HB3  MET  71           HB1      MET  71 101.824  -7.717   1.950
  568    HG2  MET  71           HG2      MET  71 100.668  -8.182  -0.481
  569    HG3  MET  71           HG1      MET  71  99.926  -6.642  -0.065
  570    HE1  MET  71           HE1      MET  71 101.898  -4.115   0.046
  571    HE2  MET  71           HE2      MET  71 103.033  -4.774   1.221
  572    HE3  MET  71           HE3      MET  71 101.310  -5.102   1.390
  573    H    GLU  72           HN       GLU  72 100.991  -9.671   4.167
  574    HA   GLU  72           HA       GLU  72  98.379  -9.376   5.465
  575    HB2  GLU  72           HB2      GLU  72  99.403 -11.483   5.968
  576    HB3  GLU  72           HB1      GLU  72 100.956 -10.723   6.316
  577    HG2  GLU  72           HG2      GLU  72  99.716 -11.380   8.381
  578    HG3  GLU  72           HG1      GLU  72 100.037  -9.650   8.302
  579    H    ILE  73           HN       ILE  73  98.077  -7.601   6.914
  580    HA   ILE  73           HA       ILE  73 100.512  -6.161   7.740
  581    HB   ILE  73           HB       ILE  73  99.828  -4.125   6.822
  582   HG12  ILE  73          HG12      ILE  73  97.110  -5.450   6.578
  583   HG13  ILE  73          HG11      ILE  73  97.525  -4.018   7.510
  584   HG21  ILE  73          HG21      ILE  73  98.851  -6.182   4.822
  585   HG22  ILE  73          HG22      ILE  73 100.555  -5.867   5.147
  586   HG23  ILE  73          HG23      ILE  73  99.542  -4.602   4.467
  587   HD11  ILE  73          HD11      ILE  73  96.724  -2.868   5.726
  588   HD12  ILE  73          HD12      ILE  73  96.848  -4.266   4.664
  589   HD13  ILE  73          HD13      ILE  73  98.264  -3.263   4.963
  590    H    SER  74           HN       SER  74 100.240  -4.660   9.428
  591    HA   SER  74           HA       SER  74  97.787  -5.015  11.060
  592    HB2  SER  74           HB2      SER  74 100.564  -4.569  12.165
  593    HB3  SER  74           HB1      SER  74  99.109  -5.019  13.050
  594    HG   SER  74           HG       SER  74  99.961  -6.947  12.733
  595    H    LEU  75           HN       LEU  75  97.205  -3.168  12.397
  596    HA   LEU  75           HA       LEU  75  97.372  -0.677  11.083
  597    HB2  LEU  75           HB2      LEU  75  95.689  -1.666  12.858
  598    HB3  LEU  75           HB1      LEU  75  96.761  -0.869  14.002
  599    HG   LEU  75           HG       LEU  75  95.050   0.719  13.459
  600   HD11  LEU  75          HD11      LEU  75  96.310   2.548  12.610
  601   HD12  LEU  75          HD12      LEU  75  97.347   1.490  11.659
  602   HD13  LEU  75          HD13      LEU  75  97.475   1.502  13.417
  603   HD21  LEU  75          HD21      LEU  75  94.515  -0.571  11.242
  604   HD22  LEU  75          HD22      LEU  75  95.652   0.565  10.513
  605   HD23  LEU  75          HD23      LEU  75  94.208   1.161  11.326
  606    H    ALA  76           HN       ALA  76  99.070   0.656  11.000
  607    HA   ALA  76           HA       ALA  76 101.051   0.571  13.161
  608    HB1  ALA  76           HB1      ALA  76 101.230   1.790  10.393
  609    HB2  ALA  76           HB2      ALA  76 101.986   0.289  10.920
  610    HB3  ALA  76           HB3      ALA  76 102.522   1.824  11.596
  611    H    TRP  77           HN       TRP  77  99.007   2.770  11.343
  612    HA   TRP  77           HA       TRP  77  98.503   4.463  13.602
  613    HB2  TRP  77           HB2      TRP  77  99.630   6.503  12.779
  614    HB3  TRP  77           HB1      TRP  77 100.820   5.222  13.054
  615    HD1  TRP  77           HD1      TRP  77 102.049   4.210  10.973
  616    HE1  TRP  77           HE1      TRP  77 101.935   4.642   8.444
  617    HE3  TRP  77           HE3      TRP  77  98.206   7.576  10.802
  618    HZ2  TRP  77           HZ2      TRP  77 100.624   6.378   6.634
  619    HZ3  TRP  77           HZ3      TRP  77  97.564   8.628   8.649
  620    HH2  TRP  77           HH2      TRP  77  98.755   8.025   6.558
  621    H    ALA  78           HN       ALA  78  97.211   6.442  12.905
  622    HA   ALA  78           HA       ALA  78  95.996   6.240  10.226
  623    HB1  ALA  78           HB1      ALA  78  94.626   4.796  11.690
  624    HB2  ALA  78           HB2      ALA  78  93.736   6.216  11.140
  625    HB3  ALA  78           HB3      ALA  78  94.380   6.159  12.781
  626    H    ARG  79           HN       ARG  79  95.917   8.323   9.437
  627    HA   ARG  79           HA       ARG  79  95.075  10.452  11.225
  628    HB2  ARG  79           HB2      ARG  79  97.696  10.060  11.249
  629    HB3  ARG  79           HB1      ARG  79  97.626  10.992   9.755
  630    HG2  ARG  79           HG2      ARG  79  96.518  12.835  10.907
  631    HG3  ARG  79           HG1      ARG  79  96.438  11.896  12.398
  632    HD2  ARG  79           HD2      ARG  79  98.373  13.037  12.860
  633    HD3  ARG  79           HD1      ARG  79  99.096  11.740  11.914
  634    HE   ARG  79           HE       ARG  79  98.310  13.796  10.154
  635   HH11  ARG  79          HH21      ARG  79 100.542  13.129  12.711
  636   HH12  ARG  79          HH22      ARG  79 101.744  14.236  12.138
  637   HH21  ARG  79          HH11      ARG  79  99.885  15.246   9.392
  638   HH22  ARG  79          HH12      ARG  79 101.372  15.434  10.258
  639    H    ASP  80           HN       ASP  80  93.940  12.015  10.252
  640    HA   ASP  80           HA       ASP  80  92.887  13.209   8.615
  641    HB2  ASP  80           HB2      ASP  80  95.317  12.780   6.905
  642    HB3  ASP  80           HB1      ASP  80  94.272  14.196   7.010
  643    H    GLY  81           HN       GLY  81  91.987  10.568   8.518
  644    HA2  GLY  81           HA2      GLY  81  90.609   9.436   7.056
  645    HA3  GLY  81           HA1      GLY  81  91.184  10.467   5.758
  646    H    LEU  82           HN       LEU  82  94.051   9.738   6.368
  647    HA   LEU  82           HA       LEU  82  94.033   7.290   4.790
  648    HB2  LEU  82           HB2      LEU  82  96.525   8.700   5.698
  649    HB3  LEU  82           HB1      LEU  82  96.223   7.815   4.201
  650    HG   LEU  82           HG       LEU  82  95.040  10.501   4.961
  651   HD11  LEU  82          HD11      LEU  82  97.500  10.277   4.153
  652   HD12  LEU  82          HD12      LEU  82  96.461  11.438   3.327
  653   HD13  LEU  82          HD13      LEU  82  96.794   9.871   2.588
  654   HD21  LEU  82          HD21      LEU  82  94.609   8.679   2.576
  655   HD22  LEU  82          HD22      LEU  82  94.168  10.387   2.574
  656   HD23  LEU  82          HD23      LEU  82  93.389   9.278   3.702
  657    H    LEU  83           HN       LEU  83  95.260   5.443   5.353
  658    HA   LEU  83           HA       LEU  83  95.672   5.059   8.285
  659    HB2  LEU  83           HB2      LEU  83  94.673   3.062   6.271
  660    HB3  LEU  83           HB1      LEU  83  94.860   2.821   8.006
  661    HG   LEU  83           HG       LEU  83  93.032   4.873   6.728
  662   HD11  LEU  83          HD11      LEU  83  92.068   2.755   6.275
  663   HD12  LEU  83          HD12      LEU  83  91.273   3.288   7.757
  664   HD13  LEU  83          HD13      LEU  83  92.572   2.101   7.834
  665   HD21  LEU  83          HD21      LEU  83  93.556   5.712   8.861
  666   HD22  LEU  83          HD22      LEU  83  93.696   4.102   9.567
  667   HD23  LEU  83          HD23      LEU  83  92.107   4.760   9.177
  668    H    GLY  84           HN       GLY  84  97.667   4.182   8.823
  669    HA2  GLY  84           HA2      GLY  84  99.408   3.341   6.619
  670    HA3  GLY  84           HA1      GLY  84  99.912   3.743   8.256
  671    H    PHE  85           HN       PHE  85 100.481   1.341   6.692
  672    HA   PHE  85           HA       PHE  85  99.605  -0.606   8.702
  673    HB2  PHE  85           HB2      PHE  85  99.043  -0.760   5.743
  674    HB3  PHE  85           HB1      PHE  85  99.168  -2.211   6.730
  675    HD1  PHE  85           HD2      PHE  85  97.767  -2.285   8.896
  676    HD2  PHE  85           HD1      PHE  85  97.009   0.423   5.662
  677    HE1  PHE  85           HE2      PHE  85  95.465  -1.955   9.730
  678    HE2  PHE  85           HE1      PHE  85  94.693   0.757   6.494
  679    HZ   PHE  85           HZ       PHE  85  93.928  -0.421   8.537
  680    H    GLU  86           HN       GLU  86 101.188  -2.023   9.223
  681    HA   GLU  86           HA       GLU  86 103.672  -1.873   7.649
  682    HB2  GLU  86           HB2      GLU  86 103.753  -1.312  10.104
  683    HB3  GLU  86           HB1      GLU  86 103.273  -2.974  10.447
  684    HG2  GLU  86           HG2      GLU  86 105.353  -3.422   8.747
  685    HG3  GLU  86           HG1      GLU  86 105.882  -1.916   9.492
  686    H    CYS  87           HN       CYS  87 104.224  -3.602   6.441
  687    HA   CYS  87           HA       CYS  87 102.544  -5.900   6.317
  688    HB2  CYS  87           HB2      CYS  87 104.844  -4.820   4.866
  689    HB3  CYS  87           HB1      CYS  87 104.863  -6.581   4.962
  690    HG   CYS  87           HG       CYS  87 103.387  -5.981   2.908
  691    H    GLN  88           HN       GLN  88 102.590  -7.701   7.451
  692    HA   GLN  88           HA       GLN  88 104.889  -8.251   9.204
  693    HB2  GLN  88           HB2      GLN  88 102.248  -9.710   9.198
  694    HB3  GLN  88           HB1      GLN  88 103.426  -9.581  10.504
  695    HG2  GLN  88           HG2      GLN  88 101.761  -7.311   9.381
  696    HG3  GLN  88           HG1      GLN  88 101.516  -8.104  10.937
  697   HE21  GLN  88          HE21      GLN  88 103.392  -5.689   9.251
  698   HE22  GLN  88          HE22      GLN  88 104.357  -5.235  10.571
  699    H    HIS  89           HN       HIS  89 103.054  -9.553   6.513
  700    HA   HIS  89           HA       HIS  89 105.203 -11.355   5.844
  701    HB2  HIS  89           HB2      HIS  89 104.400 -13.268   6.718
  702    HB3  HIS  89           HB1      HIS  89 103.128 -12.341   7.509
  703    HD2  HIS  89           HD2      HIS  89 100.657 -13.249   6.716
  704    HE1  HIS  89           HE1      HIS  89 101.694 -14.563   2.837
  705    HE2  HIS  89           HE2      HIS  89  99.794 -14.354   4.511
  706    H    ILE  90           HN       ILE  90 105.168 -11.874   3.692
  707    HA   ILE  90           HA       ILE  90 102.772 -11.350   2.049
  708    HB   ILE  90           HB       ILE  90 103.893  -9.188   2.087
  709   HG12  ILE  90          HG12      ILE  90 104.572 -10.705  -0.456
  710   HG13  ILE  90          HG11      ILE  90 102.999 -10.003  -0.085
  711   HG21  ILE  90          HG21      ILE  90 106.083  -9.796   2.847
  712   HG22  ILE  90          HG22      ILE  90 106.288  -9.090   1.247
  713   HG23  ILE  90          HG23      ILE  90 106.348 -10.839   1.451
  714   HD11  ILE  90          HD11      ILE  90 103.938  -8.275  -1.316
  715   HD12  ILE  90          HD12      ILE  90 105.573  -8.637  -0.770
  716   HD13  ILE  90          HD13      ILE  90 104.450  -7.811   0.306
  717    H    ASP  91           HN       ASP  91 102.585 -12.518   0.306
  718    HA   ASP  91           HA       ASP  91 103.914 -14.964   0.159
  719    HB2  ASP  91           HB2      ASP  91 101.708 -14.553  -0.837
  720    HB3  ASP  91           HB1      ASP  91 102.446 -13.533  -2.063
  721    H    LEU  92           HN       LEU  92 105.491 -15.790  -1.006
  722    HA   LEU  92           HA       LEU  92 107.751 -14.280  -1.613
  723    HB2  LEU  92           HB2      LEU  92 107.806 -16.728  -1.283
  724    HB3  LEU  92           HB1      LEU  92 106.994 -16.951  -2.832
  725    HG   LEU  92           HG       LEU  92 109.405 -15.237  -2.963
  726   HD11  LEU  92          HD11      LEU  92 109.562 -18.142  -2.136
  727   HD12  LEU  92          HD12      LEU  92 110.325 -16.752  -1.363
  728   HD13  LEU  92          HD13      LEU  92 110.893 -17.308  -2.937
  729   HD21  LEU  92          HD21      LEU  92 109.714 -16.353  -5.032
  730   HD22  LEU  92          HD22      LEU  92 107.962 -16.242  -4.866
  731   HD23  LEU  92          HD23      LEU  92 108.787 -17.759  -4.510
  732    H    ASP  93           HN       ASP  93 105.170 -15.372  -3.793
  733    HA   ASP  93           HA       ASP  93 106.325 -14.323  -6.170
  734    HB2  ASP  93           HB2      ASP  93 103.690 -15.417  -5.351
  735    HB3  ASP  93           HB1      ASP  93 103.668 -14.320  -6.731
  736    H    SER  94           HN       SER  94 104.008 -13.062  -3.808
  737    HA   SER  94           HA       SER  94 103.387 -10.644  -5.112
  738    HB2  SER  94           HB2      SER  94 103.352 -11.531  -2.242
  739    HB3  SER  94           HB1      SER  94 102.982  -9.867  -2.666
  740    HG   SER  94           HG       SER  94 101.747 -11.837  -4.180
  741    H    ILE  95           HN       ILE  95 106.011 -11.565  -2.949
  742    HA   ILE  95           HA       ILE  95 107.095  -9.028  -2.454
  743    HB   ILE  95           HB       ILE  95 108.358 -11.766  -2.617
  744   HG12  ILE  95          HG12      ILE  95 107.819  -9.916  -0.274
  745   HG13  ILE  95          HG11      ILE  95 106.742 -11.217  -0.770
  746   HG21  ILE  95          HG21      ILE  95 109.596  -9.069  -2.098
  747   HG22  ILE  95          HG22      ILE  95 110.210 -10.401  -3.077
  748   HG23  ILE  95          HG23      ILE  95 110.251 -10.510  -1.319
  749   HD11  ILE  95          HD11      ILE  95 107.967 -12.402   0.766
  750   HD12  ILE  95          HD12      ILE  95 109.383 -11.365   0.591
  751   HD13  ILE  95          HD13      ILE  95 109.050 -12.613  -0.610
  752    H    SER  96           HN       SER  96 107.525 -11.261  -5.158
  753    HA   SER  96           HA       SER  96 109.589  -9.698  -6.332
  754    HB2  SER  96           HB2      SER  96 108.544 -12.244  -6.796
  755    HB3  SER  96           HB1      SER  96 108.073 -11.340  -8.235
  756    HG   SER  96           HG       SER  96 110.273 -10.729  -8.455
  757    H    HIS  97           HN       HIS  97 106.079  -9.810  -6.848
  758    HA   HIS  97           HA       HIS  97 106.132  -8.085  -9.086
  759    HB2  HIS  97           HB2      HIS  97 104.014  -8.719  -7.028
  760    HB3  HIS  97           HB1      HIS  97 103.746  -7.511  -8.269
  761    HD2  HIS  97           HD2      HIS  97 103.942 -11.385  -7.947
  762    HE1  HIS  97           HE1      HIS  97 103.092 -10.450 -11.975
  763    HE2  HIS  97           HE2      HIS  97 103.271 -12.339 -10.287
  764    H    LEU  98           HN       LEU  98 106.127  -7.494  -5.625
  765    HA   LEU  98           HA       LEU  98 105.843  -4.635  -5.805
  766    HB2  LEU  98           HB2      LEU  98 106.066  -6.592  -3.722
  767    HB3  LEU  98           HB1      LEU  98 107.344  -5.404  -3.479
  768    HG   LEU  98           HG       LEU  98 105.292  -4.728  -2.303
  769   HD11  LEU  98          HD11      LEU  98 105.316  -2.794  -4.565
  770   HD12  LEU  98          HD12      LEU  98 106.873  -3.121  -3.803
  771   HD13  LEU  98          HD13      LEU  98 105.528  -2.516  -2.838
  772   HD21  LEU  98          HD21      LEU  98 103.917  -5.879  -4.337
  773   HD22  LEU  98          HD22      LEU  98 103.826  -4.192  -4.843
  774   HD23  LEU  98          HD23      LEU  98 103.208  -4.674  -3.264
  775    H    ARG  99           HN       ARG  99 108.585  -6.838  -5.971
  776    HA   ARG  99           HA       ARG  99 110.605  -4.877  -5.695
  777    HB2  ARG  99           HB2      ARG  99 110.430  -7.619  -6.846
  778    HB3  ARG  99           HB1      ARG  99 111.784  -6.628  -7.376
  779    HG2  ARG  99           HG2      ARG  99 112.788  -6.655  -5.312
  780    HG3  ARG  99           HG1      ARG  99 111.252  -6.611  -4.448
  781    HD2  ARG  99           HD2      ARG  99 110.911  -8.932  -4.695
  782    HD3  ARG  99           HD1      ARG  99 112.121  -9.069  -5.965
  783    HE   ARG  99           HE       ARG  99 112.636  -8.830  -3.077
  784   HH11  ARG  99          HH21      ARG  99 113.799  -9.107  -6.332
  785   HH12  ARG  99          HH22      ARG  99 115.393  -9.593  -5.861
  786   HH21  ARG  99          HH11      ARG  99 114.717  -9.467  -2.463
  787   HH22  ARG  99          HH12      ARG  99 115.913  -9.797  -3.673
  788    H    ARG 100           HN       ARG 100 108.648  -5.934  -8.421
  789    HA   ARG 100           HA       ARG 100 109.956  -4.635 -10.542
  790    HB2  ARG 100           HB2      ARG 100 106.980  -5.021 -10.188
  791    HB3  ARG 100           HB1      ARG 100 107.831  -4.757 -11.706
  792    HG2  ARG 100           HG2      ARG 100 108.623  -7.059  -9.935
  793    HG3  ARG 100           HG1      ARG 100 107.212  -7.207 -10.976
  794    HD2  ARG 100           HD2      ARG 100 109.388  -6.076 -12.498
  795    HD3  ARG 100           HD1      ARG 100 109.939  -7.544 -11.699
  796    HE   ARG 100           HE       ARG 100 108.252  -7.460 -13.940
  797   HH11  ARG 100          HH21      ARG 100 108.457  -8.919 -10.806
  798   HH12  ARG 100          HH22      ARG 100 107.581 -10.343 -11.260
  799   HH21  ARG 100          HH11      ARG 100 107.103  -9.323 -14.540
  800   HH22  ARG 100          HH12      ARG 100 106.814 -10.571 -13.375
  801    H    LEU 101           HN       LEU 101 107.394  -3.508  -8.370
  802    HA   LEU 101           HA       LEU 101 107.124  -0.929  -9.535
  803    HB2  LEU 101           HB2      LEU 101 106.267  -2.192  -6.956
  804    HB3  LEU 101           HB1      LEU 101 106.189  -0.436  -7.098
  805    HG   LEU 101           HG       LEU 101 104.715  -0.565  -8.985
  806   HD11  LEU 101          HD11      LEU 101 104.014  -2.951  -9.751
  807   HD12  LEU 101          HD12      LEU 101 105.511  -3.474  -8.981
  808   HD13  LEU 101          HD13      LEU 101 105.563  -2.321 -10.313
  809   HD21  LEU 101          HD21      LEU 101 102.801  -1.717  -8.035
  810   HD22  LEU 101          HD22      LEU 101 103.726  -0.999  -6.716
  811   HD23  LEU 101          HD23      LEU 101 103.851  -2.728  -7.043
  812    H    VAL 102           HN       VAL 102 109.195  -2.213  -6.996
  813    HA   VAL 102           HA       VAL 102 110.179   0.306  -6.095
  814    HB   VAL 102           HB       VAL 102 110.989  -2.555  -5.777
  815   HG11  VAL 102          HG11      VAL 102 112.939  -1.631  -4.352
  816   HG12  VAL 102          HG12      VAL 102 112.756  -0.152  -5.296
  817   HG13  VAL 102          HG13      VAL 102 113.163  -1.668  -6.101
  818   HG21  VAL 102          HG21      VAL 102 109.314  -1.237  -4.332
  819   HG22  VAL 102          HG22      VAL 102 110.717  -0.363  -3.713
  820   HG23  VAL 102          HG23      VAL 102 110.590  -2.105  -3.477
  821    H    GLU 103           HN       GLU 103 111.449  -2.117  -8.367
  822    HA   GLU 103           HA       GLU 103 113.804  -0.692  -9.029
  823    HB2  GLU 103           HB2      GLU 103 112.262  -2.821 -10.518
  824    HB3  GLU 103           HB1      GLU 103 113.833  -2.204 -11.033
  825    HG2  GLU 103           HG2      GLU 103 114.766  -2.836  -8.808
  826    HG3  GLU 103           HG1      GLU 103 113.210  -3.553  -8.392
  827    H    LEU 104           HN       LEU 104 110.590  -0.793 -10.546
  828    HA   LEU 104           HA       LEU 104 111.314   0.801 -12.775
  829    HB2  LEU 104           HB2      LEU 104 108.632   0.191 -11.524
  830    HB3  LEU 104           HB1      LEU 104 108.817   1.101 -13.023
  831    HG   LEU 104           HG       LEU 104 110.091  -1.616 -12.663
  832   HD11  LEU 104          HD11      LEU 104 107.765  -2.046 -12.274
  833   HD12  LEU 104          HD12      LEU 104 108.070  -2.462 -13.961
  834   HD13  LEU 104          HD13      LEU 104 107.280  -0.937 -13.557
  835   HD21  LEU 104          HD21      LEU 104 109.379   0.177 -14.992
  836   HD22  LEU 104          HD22      LEU 104 109.698  -1.541 -15.218
  837   HD23  LEU 104          HD23      LEU 104 110.954  -0.491 -14.569
  838    H    ASN 105           HN       ASN 105 109.887   1.634  -9.624
  839    HA   ASN 105           HA       ASN 105 109.479   4.385 -10.278
  840    HB2  ASN 105           HB2      ASN 105 109.371   2.729  -7.821
  841    HB3  ASN 105           HB1      ASN 105 109.680   4.445  -7.580
  842   HD21  ASN 105          HD21      ASN 105 107.465   2.380  -9.567
  843   HD22  ASN 105          HD22      ASN 105 106.111   3.377  -9.336
  844    H    LEU 106           HN       LEU 106 112.128   2.614  -8.723
  845    HA   LEU 106           HA       LEU 106 113.674   4.788  -7.899
  846    HB2  LEU 106           HB2      LEU 106 113.977   2.035  -7.909
  847    HB3  LEU 106           HB1      LEU 106 115.255   2.570  -8.994
  848    HG   LEU 106           HG       LEU 106 115.931   4.247  -7.217
  849   HD11  LEU 106          HD11      LEU 106 114.190   4.516  -5.716
  850   HD12  LEU 106          HD12      LEU 106 115.109   3.282  -4.859
  851   HD13  LEU 106          HD13      LEU 106 113.699   2.826  -5.812
  852   HD21  LEU 106          HD21      LEU 106 117.054   2.028  -7.596
  853   HD22  LEU 106          HD22      LEU 106 116.011   1.339  -6.354
  854   HD23  LEU 106          HD23      LEU 106 117.171   2.597  -5.931
  855    H    GLY 107           HN       GLY 107 113.678   3.064 -11.011
  856    HA2  GLY 107           HA2      GLY 107 114.358   3.731 -13.108
  857    HA3  GLY 107           HA1      GLY 107 114.254   5.390 -12.523
  858    H    ASP 108           HN       ASP 108 116.339   2.674 -13.095
  859    HA   ASP 108           HA       ASP 108 118.649   3.233 -11.752
  860    HB2  ASP 108           HB2      ASP 108 118.264   2.310 -14.600
  861    HB3  ASP 108           HB1      ASP 108 119.849   2.388 -13.832
  862    H    GLU 109           HN       GLU 109 118.786   5.497 -11.404
  863    HA   GLU 109           HA       GLU 109 119.457   7.158 -13.743
  864    HB2  GLU 109           HB2      GLU 109 118.540   7.734 -10.943
  865    HB3  GLU 109           HB1      GLU 109 119.419   8.972 -11.840
  866    HG2  GLU 109           HG2      GLU 109 117.788   8.868 -13.653
  867    HG3  GLU 109           HG1      GLU 109 116.935   7.554 -12.846
  868    H    GLU 110           HN       GLU 110 120.595   7.456 -10.409
  869    HA   GLU 110           HA       GLU 110 123.235   6.531 -10.850
  870    HB2  GLU 110           HB2      GLU 110 123.477   8.435 -12.317
  871    HB3  GLU 110           HB1      GLU 110 122.803   9.515 -11.098
  872    HG2  GLU 110           HG2      GLU 110 124.695   9.326  -9.707
  873    HG3  GLU 110           HG1      GLU 110 125.255   7.863 -10.513
  874    H    LEU 111           HN       LEU 111 121.903   9.411  -9.215
  875    HA   LEU 111           HA       LEU 111 122.103  10.083  -7.010
  876    HB2  LEU 111           HB2      LEU 111 121.070   7.252  -6.851
  877    HB3  LEU 111           HB1      LEU 111 121.241   8.266  -5.418
  878    HG   LEU 111           HG       LEU 111 119.854  10.020  -6.645
  879   HD11  LEU 111          HD11      LEU 111 119.980   9.322  -8.913
  880   HD12  LEU 111          HD12      LEU 111 118.335   8.931  -8.414
  881   HD13  LEU 111          HD13      LEU 111 119.552   7.660  -8.509
  882   HD21  LEU 111          HD21      LEU 111 118.887   8.659  -4.869
  883   HD22  LEU 111          HD22      LEU 111 118.641   7.318  -5.988
  884   HD23  LEU 111          HD23      LEU 111 117.714   8.805  -6.177
  885    H    LEU 112           HN       LEU 112 124.608   9.570  -7.921
  886    HA   LEU 112           HA       LEU 112 125.971   7.658  -6.246
  887    HB2  LEU 112           HB2      LEU 112 126.610   8.652  -8.629
  888    HB3  LEU 112           HB1      LEU 112 127.431   9.863  -7.652
  889    HG   LEU 112           HG       LEU 112 129.000   8.084  -8.154
  890   HD11  LEU 112          HD11      LEU 112 128.949   9.109  -5.837
  891   HD12  LEU 112          HD12      LEU 112 129.714   7.523  -5.936
  892   HD13  LEU 112          HD13      LEU 112 128.076   7.673  -5.302
  893   HD21  LEU 112          HD21      LEU 112 126.895   6.402  -8.289
  894   HD22  LEU 112          HD22      LEU 112 127.447   6.017  -6.659
  895   HD23  LEU 112          HD23      LEU 112 128.542   5.832  -8.026
  896    H    GLU 113           HN       GLU 113 125.042   8.547  -4.222
  897    HA   GLU 113           HA       GLU 113 125.232   9.724  -2.260
  898    HB2  GLU 113           HB2      GLU 113 127.626   8.869  -2.635
  899    HB3  GLU 113           HB1      GLU 113 127.997  10.506  -3.175
  900    HG2  GLU 113           HG2      GLU 113 126.999  11.335  -0.992
  901    HG3  GLU 113           HG1      GLU 113 126.959   9.654  -0.463
  902    H    ARG 114           HN       ARG 114 123.937  11.460  -2.201
  903    HA   ARG 114           HA       ARG 114 124.758  13.884  -3.685
  904    HB2  ARG 114           HB2      ARG 114 122.507  12.819  -4.190
  905    HB3  ARG 114           HB1      ARG 114 122.009  13.309  -2.571
  906    HG2  ARG 114           HG2      ARG 114 122.469  15.655  -3.102
  907    HG3  ARG 114           HG1      ARG 114 123.092  15.196  -4.685
  908    HD2  ARG 114           HD2      ARG 114 120.434  14.100  -4.264
  909    HD3  ARG 114           HD1      ARG 114 120.435  15.847  -4.057
  910    HE   ARG 114           HE       ARG 114 121.499  15.973  -6.305
  911   HH11  ARG 114          HH21      ARG 114 119.772  13.110  -5.360
  912   HH12  ARG 114          HH22      ARG 114 119.441  12.620  -6.986
  913   HH21  ARG 114          HH11      ARG 114 121.060  15.319  -8.425
  914   HH22  ARG 114          HH12      ARG 114 120.168  13.864  -8.715
  915    H    GLU 115           HN       GLU 115 122.349  14.670  -1.587
  916    HA   GLU 115           HA       GLU 115 123.961  16.373  -0.028
  917    HB2  GLU 115           HB2      GLU 115 121.312  16.250  -0.543
  918    HB3  GLU 115           HB1      GLU 115 121.328  15.551   1.074
  919    HG2  GLU 115           HG2      GLU 115 121.071  17.922   1.352
  920    HG3  GLU 115           HG1      GLU 115 122.731  17.535   1.804
  921    H    LEU 116           HN       LEU 116 124.599  16.287   2.105
  922    HA   LEU 116           HA       LEU 116 125.451  13.771   3.093
  923    HB2  LEU 116           HB2      LEU 116 125.253  16.362   4.629
  924    HB3  LEU 116           HB1      LEU 116 126.327  15.000   4.946
  925    HG   LEU 116           HG       LEU 116 126.359  16.701   2.435
  926   HD11  LEU 116          HD11      LEU 116 128.225  16.589   4.824
  927   HD12  LEU 116          HD12      LEU 116 127.195  17.945   4.364
  928   HD13  LEU 116          HD13      LEU 116 128.551  17.479   3.337
  929   HD21  LEU 116          HD21      LEU 116 127.150  14.559   1.815
  930   HD22  LEU 116          HD22      LEU 116 127.939  14.303   3.372
  931   HD23  LEU 116          HD23      LEU 116 128.622  15.444   2.214
  932    H    ALA 117           HN       ALA 117 122.911  16.036   4.161
  933    HA   ALA 117           HA       ALA 117 122.054  14.645   6.417
  934    HB1  ALA 117           HB1      ALA 117 120.314  16.334   4.620
  935    HB2  ALA 117           HB2      ALA 117 121.462  16.997   5.783
  936    HB3  ALA 117           HB3      ALA 117 120.099  16.028   6.344
  937    H    LEU 118           HN       LEU 118 120.734  14.461   3.086
  938    HA   LEU 118           HA       LEU 118 118.597  12.776   3.642
  939    HB2  LEU 118           HB2      LEU 118 120.323  12.745   1.158
  940    HB3  LEU 118           HB1      LEU 118 118.690  12.096   1.287
  941    HG   LEU 118           HG       LEU 118 119.297  14.981   1.947
  942   HD11  LEU 118          HD11      LEU 118 118.303  13.996  -0.734
  943   HD12  LEU 118          HD12      LEU 118 120.009  14.318  -0.426
  944   HD13  LEU 118          HD13      LEU 118 118.830  15.622  -0.301
  945   HD21  LEU 118          HD21      LEU 118 116.840  15.126   1.194
  946   HD22  LEU 118          HD22      LEU 118 117.151  14.315   2.728
  947   HD23  LEU 118          HD23      LEU 118 116.829  13.366   1.277
  948    H    LEU 119           HN       LEU 119 121.912  11.826   2.723
  949    HA   LEU 119           HA       LEU 119 121.334   9.021   2.998
  950    HB2  LEU 119           HB2      LEU 119 124.085  10.248   3.098
  951    HB3  LEU 119           HB1      LEU 119 123.612   8.658   2.497
  952    HG   LEU 119           HG       LEU 119 122.819  11.307   1.253
  953   HD11  LEU 119          HD11      LEU 119 124.583   9.196   0.027
  954   HD12  LEU 119          HD12      LEU 119 125.262  10.454   1.060
  955   HD13  LEU 119          HD13      LEU 119 124.416  10.893  -0.424
  956   HD21  LEU 119          HD21      LEU 119 121.074   9.765   0.794
  957   HD22  LEU 119          HD22      LEU 119 122.200   8.421   0.607
  958   HD23  LEU 119          HD23      LEU 119 122.116   9.679  -0.625
  959    H    VAL 120           HN       VAL 120 123.194  11.348   4.944
  960    HA   VAL 120           HA       VAL 120 123.687   9.505   7.051
  961    HB   VAL 120           HB       VAL 120 123.820  12.529   7.071
  962   HG11  VAL 120          HG11      VAL 120 125.468  12.075   8.942
  963   HG12  VAL 120          HG12      VAL 120 124.892  10.408   8.948
  964   HG13  VAL 120          HG13      VAL 120 123.785  11.725   9.338
  965   HG21  VAL 120          HG21      VAL 120 125.225  11.271   5.358
  966   HG22  VAL 120          HG22      VAL 120 126.056  10.518   6.718
  967   HG23  VAL 120          HG23      VAL 120 126.134  12.265   6.494
  968    H    SER 121           HN       SER 121 120.913  11.479   6.378
  969    HA   SER 121           HA       SER 121 120.006  11.800   9.043
  970    HB2  SER 121           HB2      SER 121 118.888  13.108   7.418
  971    HB3  SER 121           HB1      SER 121 118.554  11.709   6.400
  972    HG   SER 121           HG       SER 121 116.902  12.693   8.030
  973    H    ALA 122           HN       ALA 122 119.475   9.202   6.655
  974    HA   ALA 122           HA       ALA 122 119.158   7.254   8.725
  975    HB1  ALA 122           HB1      ALA 122 116.688   8.103   7.197
  976    HB2  ALA 122           HB2      ALA 122 116.958   8.281   8.932
  977    HB3  ALA 122           HB3      ALA 122 116.804   6.673   8.224
  978    H    HIS 123           HN       HIS 123 118.712   5.099   7.850
  979    HA   HIS 123           HA       HIS 123 118.680   4.707   5.008
  980    HB2  HIS 123           HB2      HIS 123 120.846   4.098   4.577
  981    HB3  HIS 123           HB1      HIS 123 121.182   5.179   5.927
  982    HD2  HIS 123           HD2      HIS 123 120.545   3.251   8.466
  983    HE1  HIS 123           HE1      HIS 123 123.082   0.431   6.612
  984    HE2  HIS 123           HE2      HIS 123 121.964   1.084   8.796
  985    H    ASP 124           HN       ASP 124 118.526   2.415   4.447
  986    HA   ASP 124           HA       ASP 124 118.187   0.491   6.598
  987    HB2  ASP 124           HB2      ASP 124 116.086   1.798   6.657
  988    HB3  ASP 124           HB1      ASP 124 115.786   1.346   4.980
  989    H    ASP 125           HN       ASP 125 119.963  -0.216   4.892
  990    HA   ASP 125           HA       ASP 125 118.902  -1.236   2.401
  991    HB2  ASP 125           HB2      ASP 125 121.607  -1.691   3.678
  992    HB3  ASP 125           HB1      ASP 125 121.172  -1.994   1.997
  993   H5'1  C2E 501          H5'1      C2E 501 105.426   3.120  10.473
  994   H5'2  C2E 501          H5'2      C2E 501 104.777   1.715  11.336
  995    H4'  C2E 501           H4'      C2E 501 107.015   0.561  10.518
  996    H3'  C2E 501           H3'      C2E 501 106.811   2.980   8.736
  997    H2'  C2E 501           H2'      C2E 501 106.973   1.749   6.753
  998   HO2'  C2E 501          HO2'      C2E 501 107.486  -0.552   6.853
  999    H1'  C2E 501           H1'      C2E 501 105.281  -0.238   7.357
 1000    H8   C2E 501           H8       C2E 501 103.653   2.371   9.375
 1001    HN1  C2E 501           HN1      C2E 501 103.168   3.741   3.145
 1002   HN21  C2E 501          HN21      C2E 501 104.487   2.398   1.965
 1003   HN22  C2E 501          HN22      C2E 501 105.485   1.173   2.714
 1004   H511  C2E 501          H511      C2E 501 108.457   4.429  10.059
 1005   H512  C2E 501          H512      C2E 501 110.096   4.339  10.737
 1006    H4A  C2E 501           H4A      C2E 501 109.195   5.127  12.924
 1007    H3A  C2E 501           H3A      C2E 501 106.531   5.161  11.481
 1008    H2A  C2E 501           H2A      C2E 501 105.973   7.181  12.446
 1009   HO2A  C2E 501          HO2A      C2E 501 107.872   7.875  14.095
 1010    H1A  C2E 501           H1A      C2E 501 108.404   8.433  12.272
 1011    H81  C2E 501           H81      C2E 501 108.484   6.576   9.107
 1012   HN11  C2E 501          HN11      C2E 501 104.468  11.543   8.751
 1013   HN24  C2E 501          HN24      C2E 501 104.656  11.557  12.239
 1014   HN23  C2E 501          HN23      C2E 501 103.984  12.280  10.795
 1015   H5'1  C2E 502          H5'1      C2E 502 101.257  10.329   4.698
 1016   H5'2  C2E 502          H5'2      C2E 502 100.074  11.634   4.458
 1017    H4'  C2E 502           H4'      C2E 502  99.821  11.971   6.695
 1018    H3'  C2E 502           H3'      C2E 502 102.790  11.465   6.906
 1019    H2'  C2E 502           H2'      C2E 502 102.475  11.101   9.260
 1020   HO2'  C2E 502          HO2'      C2E 502 101.029  12.498  10.026
 1021    H1'  C2E 502           H1'      C2E 502 100.329   9.481   8.974
 1022    H8   C2E 502           H8       C2E 502 102.551   8.772   5.965
 1023    HN1  C2E 502           HN1      C2E 502 104.394   5.811  11.326
 1024   HN21  C2E 502          HN21      C2E 502 103.261   6.573  13.061
 1025   HN22  C2E 502          HN22      C2E 502 102.047   7.825  12.914
 1026   H511  C2E 502          H511      C2E 502 104.685  16.271   6.845
 1027   H512  C2E 502          H512      C2E 502 103.070  15.880   6.221
 1028    H4A  C2E 502           H4A      C2E 502 104.368  16.133   4.284
 1029    H3A  C2E 502           H3A      C2E 502 104.139  13.213   5.020
 1030    H2A  C2E 502           H2A      C2E 502 105.612  12.598   3.302
 1031   HO2A  C2E 502          HO2A      C2E 502 105.590  13.617   1.441
 1032    H1A  C2E 502           H1A      C2E 502 107.378  14.708   3.475
 1033    H81  C2E 502           H81      C2E 502 106.688  13.819   7.020
 1034   HN11  C2E 502          HN11      C2E 502 110.681   9.769   4.084
 1035   HN24  C2E 502          HN24      C2E 502 110.588  10.071   1.886
 1036   HN23  C2E 502          HN23      C2E 502 109.550  11.272   1.149
  Start of MODEL    6
    1    H    MET   1           H        MET   1 106.526  27.715   7.978
    2    HA   MET   1           HA       MET   1 106.530  27.097   5.426
    3    HB2  MET   1           HB2      MET   1 109.317  26.334   6.314
    4    HB3  MET   1           HB1      MET   1 108.620  26.226   4.697
    5    HG2  MET   1           HG2      MET   1 109.331  28.749   6.216
    6    HG3  MET   1           HG1      MET   1 110.075  28.153   4.732
    7    HE1  MET   1           HE1      MET   1 108.250  31.431   3.878
    8    HE2  MET   1           HE2      MET   1 109.443  30.437   3.049
    9    HE3  MET   1           HE3      MET   1 109.603  30.732   4.777
   10    H    SER   2           HN       SER   2 107.495  24.547   5.250
   11    HA   SER   2           HA       SER   2 106.079  23.224   7.464
   12    HB2  SER   2           HB2      SER   2 106.817  22.362   4.669
   13    HB3  SER   2           HB1      SER   2 106.230  21.223   5.879
   14    HG   SER   2           HG       SER   2 104.293  22.041   5.691
   15    H    ASP   3           HN       ASP   3 107.901  23.527   8.919
   16    HA   ASP   3           HA       ASP   3 110.198  21.777   8.329
   17    HB2  ASP   3           HB2      ASP   3 111.065  22.883  10.552
   18    HB3  ASP   3           HB1      ASP   3 111.108  23.812   9.055
   19    H    GLN   4           HN       GLN   4 107.477  22.227  10.426
   20    HA   GLN   4           HA       GLN   4 108.200  20.246  12.358
   21    HB2  GLN   4           HB2      GLN   4 106.316  22.185  12.315
   22    HB3  GLN   4           HB1      GLN   4 105.317  20.809  11.856
   23    HG2  GLN   4           HG2      GLN   4 107.139  20.850  14.281
   24    HG3  GLN   4           HG1      GLN   4 105.413  21.200  14.334
   25   HE21  GLN   4          HE21      GLN   4 107.744  18.655  14.358
   26   HE22  GLN   4          HE22      GLN   4 106.652  17.362  14.232
   27    H    HIS   5           HN       HIS   5 107.846  19.844   9.228
   28    HA   HIS   5           HA       HIS   5 106.231  17.379   9.323
   29    HB2  HIS   5           HB2      HIS   5 107.186  19.182   7.108
   30    HB3  HIS   5           HB1      HIS   5 106.653  17.540   6.763
   31    HD2  HIS   5           HD2      HIS   5 104.561  19.007   9.602
   32    HE1  HIS   5           HE1      HIS   5 102.364  19.708   6.066
   33    HE2  HIS   5           HE2      HIS   5 102.262  19.739   8.603
   34    H    ASP   6           HN       ASP   6 108.953  17.681  10.472
   35    HA   ASP   6           HA       ASP   6 111.053  16.767   9.042
   36    HB2  ASP   6           HB2      ASP   6 110.262  15.652  11.743
   37    HB3  ASP   6           HB1      ASP   6 111.884  15.670  11.054
   38    H    GLU   7           HN       GLU   7 111.839  14.834   8.256
   39    HA   GLU   7           HA       GLU   7 109.841  12.870   7.549
   40    HB2  GLU   7           HB2      GLU   7 111.311  13.322   5.796
   41    HB3  GLU   7           HB1      GLU   7 112.730  13.287   6.845
   42    HG2  GLU   7           HG2      GLU   7 112.803  10.962   6.907
   43    HG3  GLU   7           HG1      GLU   7 111.078  10.794   6.592
   44    H    ARG   8           HN       ARG   8 109.563  10.911   8.374
   45    HA   ARG   8           HA       ARG   8 111.397   9.980  10.495
   46    HB2  ARG   8           HB2      ARG   8 108.401  10.073  10.418
   47    HB3  ARG   8           HB1      ARG   8 109.206   8.802  11.318
   48    HG2  ARG   8           HG2      ARG   8 108.952  10.470  12.937
   49    HG3  ARG   8           HG1      ARG   8 110.597  10.743  12.374
   50    HD2  ARG   8           HD2      ARG   8 109.250  12.843  12.550
   51    HD3  ARG   8           HD1      ARG   8 109.864  12.547  10.932
   52    HE   ARG   8           HE       ARG   8 107.458  11.473  10.681
   53   HH11  ARG   8          HH21      ARG   8 108.442  14.360  12.332
   54   HH12  ARG   8          HH22      ARG   8 106.939  15.180  12.076
   55   HH21  ARG   8          HH11      ARG   8 105.495  12.557  10.336
   56   HH22  ARG   8          HH12      ARG   8 105.274  14.161  10.948
   57    H    ARG   9           HN       ARG   9 109.887   9.327   7.502
   58    HA   ARG   9           HA       ARG   9 110.169   6.404   7.753
   59    HB2  ARG   9           HB2      ARG   9 109.228   7.851   5.277
   60    HB3  ARG   9           HB1      ARG   9 108.911   6.188   5.766
   61    HG2  ARG   9           HG2      ARG   9 107.364   6.831   7.414
   62    HG3  ARG   9           HG1      ARG   9 107.946   8.487   7.439
   63    HD2  ARG   9           HD2      ARG   9 107.106   8.046   4.783
   64    HD3  ARG   9           HD1      ARG   9 105.868   7.310   5.792
   65    HE   ARG   9           HE       ARG   9 106.331   9.803   6.917
   66   HH11  ARG   9          HH21      ARG   9 105.406   8.513   3.837
   67   HH12  ARG   9          HH22      ARG   9 104.462   9.896   3.390
   68   HH21  ARG   9          HH11      ARG   9 105.099  11.614   6.332
   69   HH22  ARG   9          HH12      ARG   9 104.289  11.651   4.802
   70    H    ARG  10           HN       ARG  10 112.555   6.913   7.980
   71    HA   ARG  10           HA       ARG  10 114.664   7.399   7.038
   72    HB2  ARG  10           HB2      ARG  10 114.821   5.421   5.117
   73    HB3  ARG  10           HB1      ARG  10 115.110   5.195   6.838
   74    HG2  ARG  10           HG2      ARG  10 112.297   5.019   5.785
   75    HG3  ARG  10           HG1      ARG  10 113.385   3.654   5.588
   76    HD2  ARG  10           HD2      ARG  10 113.754   3.506   7.967
   77    HD3  ARG  10           HD1      ARG  10 112.873   5.001   8.250
   78    HE   ARG  10           HE       ARG  10 110.856   3.836   7.946
   79   HH11  ARG  10          HH21      ARG  10 113.628   1.905   7.192
   80   HH12  ARG  10          HH22      ARG  10 112.748   0.413   7.145
   81   HH21  ARG  10          HH11      ARG  10 109.696   1.883   7.886
   82   HH22  ARG  10          HH12      ARG  10 110.522   0.401   7.539
   83    H    PHE  11           HN       PHE  11 113.057   6.246   4.084
   84    HA   PHE  11           HA       PHE  11 113.448   8.887   2.853
   85    HB2  PHE  11           HB2      PHE  11 115.247   6.812   2.414
   86    HB3  PHE  11           HB1      PHE  11 114.160   6.700   1.033
   87    HD1  PHE  11           HD2      PHE  11 113.730   8.782  -0.362
   88    HD2  PHE  11           HD1      PHE  11 116.853   8.565   2.582
   89    HE1  PHE  11           HE2      PHE  11 114.850  10.734  -1.406
   90    HE2  PHE  11           HE1      PHE  11 117.977  10.521   1.532
   91    HZ   PHE  11           HZ       PHE  11 116.971  11.600  -0.459
   92    H    HIS  12           HN       HIS  12 111.957   9.383   1.281
   93    HA   HIS  12           HA       HIS  12 109.410   8.616   1.334
   94    HB2  HIS  12           HB2      HIS  12 110.792   9.028  -1.319
   95    HB3  HIS  12           HB1      HIS  12 109.117   9.397  -0.909
   96    HD2  HIS  12           HD2      HIS  12 112.383  11.268  -1.110
   97    HE1  HIS  12           HE1      HIS  12 110.105  13.379   1.749
   98    HE2  HIS  12           HE2      HIS  12 112.177  13.466   0.283
   99    H    ARG  13           HN       ARG  13 108.007   7.149   0.300
  100    HA   ARG  13           HA       ARG  13 109.278   4.573  -0.377
  101    HB2  ARG  13           HB2      ARG  13 106.348   4.992   0.220
  102    HB3  ARG  13           HB1      ARG  13 107.286   3.504   0.313
  103    HG2  ARG  13           HG2      ARG  13 108.221   4.049   2.353
  104    HG3  ARG  13           HG1      ARG  13 108.159   5.782   2.047
  105    HD2  ARG  13           HD2      ARG  13 105.734   4.056   2.576
  106    HD3  ARG  13           HD1      ARG  13 106.542   5.030   3.799
  107    HE   ARG  13           HE       ARG  13 105.828   6.606   1.522
  108   HH11  ARG  13          HH21      ARG  13 104.601   5.056   4.365
  109   HH12  ARG  13          HH22      ARG  13 103.276   6.155   4.558
  110   HH21  ARG  13          HH11      ARG  13 104.092   8.050   1.771
  111   HH22  ARG  13          HH12      ARG  13 102.988   7.849   3.090
  112    H    ILE  14           HN       ILE  14 107.842   3.233  -1.933
  113    HA   ILE  14           HA       ILE  14 107.766   4.611  -4.443
  114    HB   ILE  14           HB       ILE  14 106.781   1.864  -3.659
  115   HG12  ILE  14          HG12      ILE  14 109.180   2.094  -3.304
  116   HG13  ILE  14          HG11      ILE  14 108.907   1.120  -4.746
  117   HG21  ILE  14          HG21      ILE  14 105.683   2.277  -5.676
  118   HG22  ILE  14          HG22      ILE  14 107.189   1.547  -6.230
  119   HG23  ILE  14          HG23      ILE  14 106.984   3.297  -6.292
  120   HD11  ILE  14          HD11      ILE  14 109.060   3.462  -5.976
  121   HD12  ILE  14          HD12      ILE  14 110.525   2.595  -5.522
  122   HD13  ILE  14          HD13      ILE  14 109.945   3.923  -4.520
  123    H    ALA  15           HN       ALA  15 106.230   6.202  -4.525
  124    HA   ALA  15           HA       ALA  15 103.485   5.529  -3.734
  125    HB1  ALA  15           HB1      ALA  15 104.689   8.156  -4.618
  126    HB2  ALA  15           HB2      ALA  15 104.382   7.666  -2.953
  127    HB3  ALA  15           HB3      ALA  15 103.033   7.923  -4.060
  128    H    PHE  16           HN       PHE  16 102.125   4.783  -5.129
  129    HA   PHE  16           HA       PHE  16 101.920   5.905  -7.792
  130    HB2  PHE  16           HB2      PHE  16 102.106   3.875  -9.007
  131    HB3  PHE  16           HB1      PHE  16 103.525   3.944  -7.968
  132    HD1  PHE  16           HD2      PHE  16 102.629   3.046  -5.370
  133    HD2  PHE  16           HD1      PHE  16 101.435   1.668  -9.261
  134    HE1  PHE  16           HE2      PHE  16 102.038   0.843  -4.411
  135    HE2  PHE  16           HE1      PHE  16 100.857  -0.539  -8.299
  136    HZ   PHE  16           HZ       PHE  16 101.168  -0.954  -5.877
  137    H    ASP  17           HN       ASP  17  99.801   5.427  -8.749
  138    HA   ASP  17           HA       ASP  17  97.867   4.945  -6.616
  139    HB2  ASP  17           HB2      ASP  17  96.223   5.893  -8.185
  140    HB3  ASP  17           HB1      ASP  17  97.604   6.967  -7.971
  141    H    ALA  18           HN       ALA  18  96.204   3.446  -6.746
  142    HA   ALA  18           HA       ALA  18  95.583   1.814  -8.921
  143    HB1  ALA  18           HB1      ALA  18  97.675   0.711  -8.820
  144    HB2  ALA  18           HB2      ALA  18  96.583  -0.359  -7.938
  145    HB3  ALA  18           HB3      ALA  18  97.680   0.705  -7.056
  146    H    ASP  19           HN       ASP  19  94.468  -0.314  -8.052
  147    HA   ASP  19           HA       ASP  19  92.685   0.618  -5.892
  148    HB2  ASP  19           HB2      ASP  19  91.831  -0.219  -8.156
  149    HB3  ASP  19           HB1      ASP  19  92.300  -1.829  -7.618
  150    H    SER  20           HN       SER  20  92.559  -0.334  -3.942
  151    HA   SER  20           HA       SER  20  93.910  -2.926  -3.550
  152    HB2  SER  20           HB2      SER  20  94.739  -2.024  -1.340
  153    HB3  SER  20           HB1      SER  20  95.522  -1.340  -2.762
  154    HG   SER  20           HG       SER  20  94.508   0.524  -2.439
  155    H    GLU  21           HN       GLU  21  93.138  -4.122  -1.769
  156    HA   GLU  21           HA       GLU  21  90.605  -3.196  -0.553
  157    HB2  GLU  21           HB2      GLU  21  91.064  -5.916  -1.822
  158    HB3  GLU  21           HB1      GLU  21  89.632  -5.440  -0.909
  159    HG2  GLU  21           HG2      GLU  21  89.581  -3.438  -2.642
  160    HG3  GLU  21           HG1      GLU  21  90.529  -4.546  -3.628
  161    H    ILE  22           HN       ILE  22  90.295  -3.888   1.539
  162    HA   ILE  22           HA       ILE  22  92.512  -5.504   2.667
  163    HB   ILE  22           HB       ILE  22  91.097  -3.111   3.851
  164   HG12  ILE  22          HG12      ILE  22  93.395  -3.336   2.201
  165   HG13  ILE  22          HG11      ILE  22  92.837  -1.907   3.060
  166   HG21  ILE  22          HG21      ILE  22  91.458  -4.757   5.598
  167   HG22  ILE  22          HG22      ILE  22  92.642  -3.468   5.792
  168   HG23  ILE  22          HG23      ILE  22  93.122  -5.007   5.075
  169   HD11  ILE  22          HD11      ILE  22  94.659  -4.029   4.237
  170   HD12  ILE  22          HD12      ILE  22  94.157  -2.531   5.025
  171   HD13  ILE  22          HD13      ILE  22  95.195  -2.474   3.602
  172    H    LEU  23           HN       LEU  23  92.053  -7.122   3.959
  173    HA   LEU  23           HA       LEU  23  89.218  -7.590   4.702
  174    HB2  LEU  23           HB2      LEU  23  91.083  -9.877   4.235
  175    HB3  LEU  23           HB1      LEU  23  89.337  -9.775   4.003
  176    HG   LEU  23           HG       LEU  23  90.069  -7.979   2.160
  177   HD11  LEU  23          HD11      LEU  23  92.526  -8.483   2.896
  178   HD12  LEU  23          HD12      LEU  23  92.164  -8.348   1.178
  179   HD13  LEU  23          HD13      LEU  23  92.342  -9.938   1.919
  180   HD21  LEU  23          HD21      LEU  23  89.758  -9.677   0.502
  181   HD22  LEU  23          HD22      LEU  23  88.816 -10.207   1.894
  182   HD23  LEU  23          HD23      LEU  23  90.388 -10.931   1.568
  183    H    GLN  24           HN       GLN  24  88.905  -7.711   6.761
  184    HA   GLN  24           HA       GLN  24  91.046  -8.790   8.510
  185    HB2  GLN  24           HB2      GLN  24  91.125  -6.429   8.894
  186    HB3  GLN  24           HB1      GLN  24  89.366  -6.321   8.983
  187    HG2  GLN  24           HG2      GLN  24  89.279  -7.414  11.069
  188    HG3  GLN  24           HG1      GLN  24  90.891  -8.099  10.879
  189   HE21  GLN  24          HE21      GLN  24  89.107  -5.299  11.979
  190   HE22  GLN  24          HE22      GLN  24  90.454  -4.413  12.509
  191    H    GLY  25           HN       GLY  25  90.145 -10.754   8.964
  192    HA2  GLY  25           HA2      GLY  25  88.771 -12.183  10.166
  193    HA3  GLY  25           HA1      GLY  25  87.770 -10.800  10.612
  194    H    GLU  26           HN       GLU  26  85.744 -11.163   9.925
  195    HA   GLU  26           HA       GLU  26  85.319 -12.526   7.351
  196    HB2  GLU  26           HB2      GLU  26  82.926 -12.602   8.143
  197    HB3  GLU  26           HB1      GLU  26  84.063 -13.480   9.167
  198    HG2  GLU  26           HG2      GLU  26  84.074 -11.766  10.810
  199    HG3  GLU  26           HG1      GLU  26  83.322 -10.605   9.719
  200    H    ARG  27           HN       ARG  27  85.976  -9.516   8.119
  201    HA   ARG  27           HA       ARG  27  83.792  -8.293   6.543
  202    HB2  ARG  27           HB2      ARG  27  85.732  -7.006   8.450
  203    HB3  ARG  27           HB1      ARG  27  84.462  -6.188   7.544
  204    HG2  ARG  27           HG2      ARG  27  83.060  -6.637   9.257
  205    HG3  ARG  27           HG1      ARG  27  83.153  -8.336   8.790
  206    HD2  ARG  27           HD2      ARG  27  85.245  -8.504  10.188
  207    HD3  ARG  27           HD1      ARG  27  84.899  -6.882  10.783
  208    HE   ARG  27           HE       ARG  27  82.576  -8.320  11.206
  209   HH11  ARG  27          HH21      ARG  27  85.914  -8.571  12.085
  210   HH12  ARG  27          HH22      ARG  27  85.600  -9.367  13.591
  211   HH21  ARG  27          HH11      ARG  27  82.157  -9.362  13.181
  212   HH22  ARG  27          HH12      ARG  27  83.474  -9.815  14.211
  213    H    ARG  28           HN       ARG  28  84.234  -7.398   4.634
  214    HA   ARG  28           HA       ARG  28  87.054  -6.838   3.906
  215    HB2  ARG  28           HB2      ARG  28  86.081  -8.926   2.801
  216    HB3  ARG  28           HB1      ARG  28  84.949  -7.853   1.978
  217    HG2  ARG  28           HG2      ARG  28  87.265  -6.548   1.441
  218    HG3  ARG  28           HG1      ARG  28  87.878  -8.191   1.562
  219    HD2  ARG  28           HD2      ARG  28  85.816  -8.751   0.009
  220    HD3  ARG  28           HD1      ARG  28  85.921  -7.041  -0.392
  221    HE   ARG  28           HE       ARG  28  88.163  -7.432  -1.234
  222   HH11  ARG  28          HH21      ARG  28  86.333 -10.260  -0.380
  223   HH12  ARG  28          HH22      ARG  28  87.298 -11.332  -1.337
  224   HH21  ARG  28          HH11      ARG  28  89.420  -8.841  -2.479
  225   HH22  ARG  28          HH12      ARG  28  89.042 -10.531  -2.523
  226    H    TRP  29           HN       TRP  29  87.414  -5.070   2.624
  227    HA   TRP  29           HA       TRP  29  85.148  -3.367   1.905
  228    HB2  TRP  29           HB2      TRP  29  87.485  -2.490   3.599
  229    HB3  TRP  29           HB1      TRP  29  86.185  -1.449   3.021
  230    HD1  TRP  29           HD1      TRP  29  83.630  -2.341   3.874
  231    HE1  TRP  29           HE1      TRP  29  82.991  -3.106   6.259
  232    HE3  TRP  29           HE3      TRP  29  88.244  -3.551   5.669
  233    HZ2  TRP  29           HZ2      TRP  29  84.285  -4.099   8.616
  234    HZ3  TRP  29           HZ3      TRP  29  88.521  -4.397   7.980
  235    HH2  TRP  29           HH2      TRP  29  86.547  -4.679   9.457
  236    H    GLU  30           HN       GLU  30  85.715  -1.727   0.402
  237    HA   GLU  30           HA       GLU  30  88.085  -2.401  -1.187
  238    HB2  GLU  30           HB2      GLU  30  86.351  -0.379  -2.368
  239    HB3  GLU  30           HB1      GLU  30  86.815  -1.957  -2.998
  240    HG2  GLU  30           HG2      GLU  30  84.474  -2.106  -2.757
  241    HG3  GLU  30           HG1      GLU  30  85.095  -2.921  -1.325
  242    H    VAL  31           HN       VAL  31  89.730  -0.860  -1.497
  243    HA   VAL  31           HA       VAL  31  89.301   1.889  -0.571
  244    HB   VAL  31           HB       VAL  31  91.389   1.752   0.823
  245   HG11  VAL  31          HG11      VAL  31  90.258   0.821   2.752
  246   HG12  VAL  31          HG12      VAL  31  89.169  -0.106   1.721
  247   HG13  VAL  31          HG13      VAL  31  89.058   1.654   1.765
  248   HG21  VAL  31          HG21      VAL  31  90.920  -1.235   0.680
  249   HG22  VAL  31          HG22      VAL  31  92.256  -0.388   1.457
  250   HG23  VAL  31          HG23      VAL  31  92.135  -0.414  -0.301
  251    H    LEU  32           HN       LEU  32  90.997   3.324  -1.183
  252    HA   LEU  32           HA       LEU  32  92.398   2.433  -3.620
  253    HB2  LEU  32           HB2      LEU  32  91.166   4.388  -4.096
  254    HB3  LEU  32           HB1      LEU  32  91.513   5.107  -2.528
  255    HG   LEU  32           HG       LEU  32  93.845   5.472  -3.171
  256   HD11  LEU  32          HD11      LEU  32  94.083   5.067  -5.857
  257   HD12  LEU  32          HD12      LEU  32  93.062   3.699  -5.420
  258   HD13  LEU  32          HD13      LEU  32  94.632   3.912  -4.646
  259   HD21  LEU  32          HD21      LEU  32  91.769   6.403  -5.168
  260   HD22  LEU  32          HD22      LEU  32  93.415   7.032  -5.129
  261   HD23  LEU  32          HD23      LEU  32  92.351   7.263  -3.743
  262    H    LEU  33           HN       LEU  33  94.578   2.184  -3.578
  263    HA   LEU  33           HA       LEU  33  95.932   2.774  -1.051
  264    HB2  LEU  33           HB2      LEU  33  96.377   0.575  -1.809
  265    HB3  LEU  33           HB1      LEU  33  96.660   1.103  -3.463
  266    HG   LEU  33           HG       LEU  33  98.445   2.338  -1.426
  267   HD11  LEU  33          HD11      LEU  33  99.708  -0.116  -2.038
  268   HD12  LEU  33          HD12      LEU  33  98.095  -0.541  -1.482
  269   HD13  LEU  33          HD13      LEU  33  99.149   0.433  -0.461
  270   HD21  LEU  33          HD21      LEU  33  99.989   2.313  -3.184
  271   HD22  LEU  33          HD22      LEU  33  98.465   2.435  -4.060
  272   HD23  LEU  33          HD23      LEU  33  99.280   0.879  -3.925
  273    H    HIS  34           HN       HIS  34  97.177   4.454  -0.787
  274    HA   HIS  34           HA       HIS  34  97.702   6.196  -3.068
  275    HB2  HIS  34           HB2      HIS  34  97.863   6.494  -0.073
  276    HB3  HIS  34           HB1      HIS  34  98.513   7.733  -1.157
  277    HD2  HIS  34           HD2      HIS  34  95.014   6.213  -0.143
  278    HE1  HIS  34           HE1      HIS  34  94.329   9.634  -2.519
  279    HE2  HIS  34           HE2      HIS  34  93.220   7.862  -1.080
  280    H    ASP  35           HN       ASP  35  99.521   4.070  -0.948
  281    HA   ASP  35           HA       ASP  35 101.650   4.093  -2.768
  282    HB2  ASP  35           HB2      ASP  35 103.423   5.250  -1.531
  283    HB3  ASP  35           HB1      ASP  35 102.060   6.353  -1.751
  284    H    VAL  36           HN       VAL  36 103.534   2.817  -2.060
  285    HA   VAL  36           HA       VAL  36 103.066   1.128   0.288
  286    HB   VAL  36           HB       VAL  36 101.944   0.139  -1.809
  287   HG11  VAL  36          HG11      VAL  36 103.321  -0.814  -3.491
  288   HG12  VAL  36          HG12      VAL  36 104.781  -0.612  -2.523
  289   HG13  VAL  36          HG13      VAL  36 103.992   0.797  -3.231
  290   HG21  VAL  36          HG21      VAL  36 104.112  -1.607  -0.629
  291   HG22  VAL  36          HG22      VAL  36 102.499  -2.081  -1.158
  292   HG23  VAL  36          HG23      VAL  36 102.697  -1.116   0.301
  293    H    SER  37           HN       SER  37 104.883  -0.448   0.573
  294    HA   SER  37           HA       SER  37 107.447   0.446  -0.512
  295    HB2  SER  37           HB2      SER  37 106.980   1.637   1.703
  296    HB3  SER  37           HB1      SER  37 107.027   0.047   2.460
  297    HG   SER  37           HG       SER  37 109.064   1.284   2.358
  298    H    LEU  38           HN       LEU  38 109.172  -1.234   0.264
  299    HA   LEU  38           HA       LEU  38 108.170  -3.781  -0.459
  300    HB2  LEU  38           HB2      LEU  38 110.576  -2.814  -0.715
  301    HB3  LEU  38           HB1      LEU  38 110.821  -3.398   0.927
  302    HG   LEU  38           HG       LEU  38 109.633  -5.270  -1.106
  303   HD11  LEU  38          HD11      LEU  38 112.581  -4.600  -0.872
  304   HD12  LEU  38          HD12      LEU  38 111.554  -4.305  -2.275
  305   HD13  LEU  38          HD13      LEU  38 111.920  -5.959  -1.783
  306   HD21  LEU  38          HD21      LEU  38 110.809  -5.423   1.566
  307   HD22  LEU  38          HD22      LEU  38 111.610  -6.528   0.453
  308   HD23  LEU  38          HD23      LEU  38 109.868  -6.628   0.689
  309    H    HIS  39           HN       HIS  39 107.754  -2.177   2.373
  310    HA   HIS  39           HA       HIS  39 106.992  -4.600   3.752
  311    HB2  HIS  39           HB2      HIS  39 109.524  -4.175   4.157
  312    HB3  HIS  39           HB1      HIS  39 108.972  -2.872   5.209
  313    HD2  HIS  39           HD2      HIS  39 108.369  -3.754   7.755
  314    HE1  HIS  39           HE1      HIS  39 107.815  -7.842   6.858
  315    HE2  HIS  39           HE2      HIS  39 107.875  -6.126   8.728
  316    H    GLY  40           HN       GLY  40 105.614  -2.216   2.836
  317    HA2  GLY  40           HA2      GLY  40 104.095  -1.643   5.182
  318    HA3  GLY  40           HA1      GLY  40 105.125  -0.282   4.760
  319    H    ILE  41           HN       ILE  41 102.216  -0.310   4.725
  320    HA   ILE  41           HA       ILE  41 101.813   0.527   1.936
  321    HB   ILE  41           HB       ILE  41 100.743  -1.379   1.409
  322   HG12  ILE  41          HG12      ILE  41  98.714  -0.588   3.526
  323   HG13  ILE  41          HG11      ILE  41  98.804   0.148   1.923
  324   HG21  ILE  41          HG21      ILE  41 101.811  -2.585   3.214
  325   HG22  ILE  41          HG22      ILE  41 100.120  -3.076   3.131
  326   HG23  ILE  41          HG23      ILE  41 100.652  -1.950   4.381
  327   HD11  ILE  41          HD11      ILE  41  98.464  -2.053   0.883
  328   HD12  ILE  41          HD12      ILE  41  97.133  -1.665   1.975
  329   HD13  ILE  41          HD13      ILE  41  98.384  -2.801   2.479
  330    H    LEU  42           HN       LEU  42 100.190   1.983   1.594
  331    HA   LEU  42           HA       LEU  42  98.895   3.126   4.002
  332    HB2  LEU  42           HB2      LEU  42 100.808   4.389   2.466
  333    HB3  LEU  42           HB1      LEU  42  99.315   4.951   1.721
  334    HG   LEU  42           HG       LEU  42  99.615   5.021   4.717
  335   HD11  LEU  42          HD11      LEU  42 101.602   6.161   3.823
  336   HD12  LEU  42          HD12      LEU  42 100.473   7.333   4.503
  337   HD13  LEU  42          HD13      LEU  42 100.579   7.122   2.756
  338   HD21  LEU  42          HD21      LEU  42  97.423   5.443   3.475
  339   HD22  LEU  42          HD22      LEU  42  98.179   6.896   2.825
  340   HD23  LEU  42          HD23      LEU  42  97.943   6.726   4.565
  341    H    VAL  43           HN       VAL  43  96.711   3.584   3.800
  342    HA   VAL  43           HA       VAL  43  95.490   3.381   1.139
  343    HB   VAL  43           HB       VAL  43  93.818   1.771   1.898
  344   HG11  VAL  43          HG11      VAL  43  96.040   1.034   0.921
  345   HG12  VAL  43          HG12      VAL  43  95.234  -0.176   1.920
  346   HG13  VAL  43          HG13      VAL  43  96.587   0.747   2.573
  347   HG21  VAL  43          HG21      VAL  43  95.355   2.033   4.483
  348   HG22  VAL  43          HG22      VAL  43  94.397   0.595   4.137
  349   HG23  VAL  43          HG23      VAL  43  93.616   2.173   4.224
  350    H    GLY  44           HN       GLY  44  93.024   3.695   1.381
  351    HA2  GLY  44           HA2      GLY  44  92.614   6.144   3.001
  352    HA3  GLY  44           HA1      GLY  44  91.638   5.653   1.616
  353    H    GLN  45           HN       GLN  45  90.846   6.291   4.537
  354    HA   GLN  45           HA       GLN  45  90.003   3.736   5.570
  355    HB2  GLN  45           HB2      GLN  45  90.776   5.597   7.012
  356    HB3  GLN  45           HB1      GLN  45  89.371   6.531   6.520
  357    HG2  GLN  45           HG2      GLN  45  88.772   3.797   7.506
  358    HG3  GLN  45           HG1      GLN  45  89.420   4.901   8.715
  359   HE21  GLN  45          HE21      GLN  45  86.613   3.837   8.445
  360   HE22  GLN  45          HE22      GLN  45  85.625   5.214   8.339
  361    HA   PRO  46           HA       PRO  46  86.057   4.492   3.492
  362    HB2  PRO  46           HB2      PRO  46  85.110   1.938   3.428
  363    HB3  PRO  46           HB1      PRO  46  86.418   2.470   2.349
  364    HG2  PRO  46           HG2      PRO  46  86.570   0.875   4.859
  365    HG3  PRO  46           HG1      PRO  46  87.522   0.734   3.371
  366    HD2  PRO  46           HD2      PRO  46  88.368   2.047   5.711
  367    HD3  PRO  46           HD1      PRO  46  89.084   2.250   4.101
  368    H    GLN  47           HN       GLN  47  83.740   4.281   4.149
  369    HA   GLN  47           HA       GLN  47  83.362   4.857   6.890
  370    HB2  GLN  47           HB2      GLN  47  81.425   4.235   4.666
  371    HB3  GLN  47           HB1      GLN  47  80.913   4.703   6.289
  372    HG2  GLN  47           HG2      GLN  47  82.212   6.790   6.102
  373    HG3  GLN  47           HG1      GLN  47  82.729   6.326   4.482
  374   HE21  GLN  47          HE21      GLN  47  81.620   7.999   3.324
  375   HE22  GLN  47          HE22      GLN  47  79.927   8.119   3.287
  376    H    ASP  48           HN       ASP  48  82.718   1.910   5.019
  377    HA   ASP  48           HA       ASP  48  81.409   0.547   7.169
  378    HB2  ASP  48           HB2      ASP  48  80.948  -0.017   4.850
  379    HB3  ASP  48           HB1      ASP  48  82.624  -0.498   4.610
  380    H    TRP  49           HN       TRP  49  84.451   1.526   7.186
  381    HA   TRP  49           HA       TRP  49  86.083  -0.713   7.627
  382    HB2  TRP  49           HB2      TRP  49  86.862   1.640   7.371
  383    HB3  TRP  49           HB1      TRP  49  86.258   1.978   8.990
  384    HD1  TRP  49           HD1      TRP  49  87.599   1.082  11.007
  385    HE1  TRP  49           HE1      TRP  49  90.010   0.083  11.250
  386    HE3  TRP  49           HE3      TRP  49  88.494  -0.017   6.161
  387    HZ2  TRP  49           HZ2      TRP  49  92.066  -1.068   9.448
  388    HZ3  TRP  49           HZ3      TRP  49  90.613  -1.059   5.433
  389    HH2  TRP  49           HH2      TRP  49  92.370  -1.588   7.084
  390    H    ASN  50           HN       ASN  50  84.287  -1.994   8.844
  391    HA   ASN  50           HA       ASN  50  84.223  -1.289  11.691
  392    HB2  ASN  50           HB2      ASN  50  82.090  -1.963  10.627
  393    HB3  ASN  50           HB1      ASN  50  82.792  -3.530  10.236
  394   HD21  ASN  50          HD21      ASN  50  84.188  -2.741  13.131
  395   HD22  ASN  50          HD22      ASN  50  83.076  -3.464  14.189
  396    H    GLY  51           HN       GLY  51  86.512  -1.698  11.959
  397    HA2  GLY  51           HA2      GLY  51  87.015  -4.541  12.535
  398    HA3  GLY  51           HA1      GLY  51  88.165  -3.670  11.526
  399    H    ASP  52           HN       ASP  52  88.807  -4.879  13.979
  400    HA   ASP  52           HA       ASP  52  89.057  -2.704  15.932
  401    HB2  ASP  52           HB2      ASP  52  88.379  -5.071  16.556
  402    HB3  ASP  52           HB1      ASP  52  90.043  -5.539  16.210
  403    HA   PRO  53           HA       PRO  53  93.057  -1.723  13.999
  404    HB2  PRO  53           HB2      PRO  53  93.259  -0.240  16.592
  405    HB3  PRO  53           HB1      PRO  53  93.629   0.318  14.949
  406    HG2  PRO  53           HG2      PRO  53  91.393   1.053  16.186
  407    HG3  PRO  53           HG1      PRO  53  91.424   0.723  14.445
  408    HD2  PRO  53           HD2      PRO  53  90.259  -0.918  16.645
  409    HD3  PRO  53           HD1      PRO  53  89.772  -0.802  14.940
  410    H    GLN  54           HN       GLN  54  92.385  -3.086  17.111
  411    HA   GLN  54           HA       GLN  54  95.118  -3.627  17.773
  412    HB2  GLN  54           HB2      GLN  54  92.601  -4.861  18.913
  413    HB3  GLN  54           HB1      GLN  54  94.209  -4.914  19.634
  414    HG2  GLN  54           HG2      GLN  54  93.622  -2.172  19.072
  415    HG3  GLN  54           HG1      GLN  54  92.213  -2.854  19.879
  416   HE21  GLN  54          HE21      GLN  54  93.569  -4.771  21.554
  417   HE22  GLN  54          HE22      GLN  54  94.493  -3.909  22.688
  418    H    ARG  55           HN       ARG  55  92.678  -5.233  15.890
  419    HA   ARG  55           HA       ARG  55  94.204  -7.738  15.918
  420    HB2  ARG  55           HB2      ARG  55  91.471  -6.977  14.897
  421    HB3  ARG  55           HB1      ARG  55  92.248  -8.472  14.372
  422    HG2  ARG  55           HG2      ARG  55  92.481  -9.196  16.704
  423    HG3  ARG  55           HG1      ARG  55  91.759  -7.686  17.258
  424    HD2  ARG  55           HD2      ARG  55  90.168  -9.189  15.259
  425    HD3  ARG  55           HD1      ARG  55  90.333  -9.966  16.831
  426    HE   ARG  55           HE       ARG  55  89.630  -7.478  17.552
  427   HH11  ARG  55          HH21      ARG  55  88.428  -9.617  15.112
  428   HH12  ARG  55          HH22      ARG  55  86.805  -9.018  15.191
  429   HH21  ARG  55          HH11      ARG  55  87.505  -6.688  17.664
  430   HH22  ARG  55          HH12      ARG  55  86.282  -7.359  16.637
  431    HA   PRO  56           HA       PRO  56  96.270  -6.945  12.161
  432    HB2  PRO  56           HB2      PRO  56  95.865  -9.691  11.191
  433    HB3  PRO  56           HB1      PRO  56  97.359  -8.904  11.727
  434    HG2  PRO  56           HG2      PRO  56  96.109 -10.849  13.140
  435    HG3  PRO  56           HG1      PRO  56  97.093  -9.578  13.885
  436    HD2  PRO  56           HD2      PRO  56  94.108  -9.813  13.744
  437    HD3  PRO  56           HD1      PRO  56  95.136  -9.180  15.049
  438    H    PHE  57           HN       PHE  57  96.157  -6.859   9.855
  439    HA   PHE  57           HA       PHE  57  93.447  -7.168   8.699
  440    HB2  PHE  57           HB2      PHE  57  95.353  -4.837   8.320
  441    HB3  PHE  57           HB1      PHE  57  93.828  -5.058   7.469
  442    HD1  PHE  57           HD1      PHE  57  95.290  -4.697  10.896
  443    HD2  PHE  57           HD2      PHE  57  91.805  -4.299   8.423
  444    HE1  PHE  57           HE1      PHE  57  94.092  -3.572  12.756
  445    HE2  PHE  57           HE2      PHE  57  90.606  -3.185  10.278
  446    HZ   PHE  57           HZ       PHE  57  91.747  -2.821  12.446
  447    H    GLU  58           HN       GLU  58  93.530  -7.528   6.329
  448    HA   GLU  58           HA       GLU  58  96.228  -8.278   5.374
  449    HB2  GLU  58           HB2      GLU  58  93.640  -9.648   4.577
  450    HB3  GLU  58           HB1      GLU  58  95.274 -10.126   4.120
  451    HG2  GLU  58           HG2      GLU  58  95.309 -11.451   5.951
  452    HG3  GLU  58           HG1      GLU  58  95.340  -9.985   6.927
  453    H    ALA  59           HN       ALA  59  96.786  -7.528   3.291
  454    HA   ALA  59           HA       ALA  59  94.741  -5.823   1.966
  455    HB1  ALA  59           HB1      ALA  59  97.633  -5.447   2.576
  456    HB2  ALA  59           HB2      ALA  59  96.301  -4.294   2.656
  457    HB3  ALA  59           HB3      ALA  59  96.985  -4.740   1.096
  458    H    ARG  60           HN       ARG  60  94.395  -6.062  -0.146
  459    HA   ARG  60           HA       ARG  60  96.182  -7.859  -1.681
  460    HB2  ARG  60           HB2      ARG  60  93.169  -7.642  -1.682
  461    HB3  ARG  60           HB1      ARG  60  94.053  -8.326  -3.046
  462    HG2  ARG  60           HG2      ARG  60  95.203  -9.825  -1.245
  463    HG3  ARG  60           HG1      ARG  60  93.841  -9.362  -0.224
  464    HD2  ARG  60           HD2      ARG  60  92.567 -10.020  -2.563
  465    HD3  ARG  60           HD1      ARG  60  93.911 -11.157  -2.565
  466    HE   ARG  60           HE       ARG  60  92.979 -11.452  -0.062
  467   HH11  ARG  60          HH21      ARG  60  91.385 -11.250  -3.131
  468   HH12  ARG  60          HH22      ARG  60  90.056 -12.258  -2.662
  469   HH21  ARG  60          HH11      ARG  60  91.236 -12.776   0.557
  470   HH22  ARG  60          HH12      ARG  60  89.972 -13.121  -0.576
  471    H    LEU  61           HN       LEU  61  97.074  -6.860  -3.421
  472    HA   LEU  61           HA       LEU  61  95.875  -4.292  -4.265
  473    HB2  LEU  61           HB2      LEU  61  98.675  -5.208  -4.889
  474    HB3  LEU  61           HB1      LEU  61  98.028  -3.572  -4.907
  475    HG   LEU  61           HG       LEU  61  98.133  -5.213  -2.370
  476   HD11  LEU  61          HD11      LEU  61 100.208  -3.796  -1.889
  477   HD12  LEU  61          HD12      LEU  61 100.254  -3.462  -3.621
  478   HD13  LEU  61          HD13      LEU  61 100.416  -5.119  -3.037
  479   HD21  LEU  61          HD21      LEU  61  98.171  -2.869  -1.401
  480   HD22  LEU  61          HD22      LEU  61  96.680  -3.291  -2.242
  481   HD23  LEU  61          HD23      LEU  61  97.880  -2.265  -3.031
  482    H    TYR  62           HN       TYR  62  95.704  -3.799  -6.468
  483    HA   TYR  62           HA       TYR  62  95.995  -6.073  -8.327
  484    HB2  TYR  62           HB2      TYR  62  93.632  -4.183  -8.330
  485    HB3  TYR  62           HB1      TYR  62  93.851  -5.627  -9.318
  486    HD1  TYR  62           HD1      TYR  62  93.470  -4.440  -5.802
  487    HD2  TYR  62           HD2      TYR  62  93.220  -7.769  -8.508
  488    HE1  TYR  62           HE1      TYR  62  92.413  -5.816  -4.019
  489    HE2  TYR  62           HE2      TYR  62  92.168  -9.138  -6.728
  490    HH   TYR  62           HH       TYR  62  91.964  -8.013  -3.423
  491    H    LEU  63           HN       LEU  63  97.526  -5.443  -9.682
  492    HA   LEU  63           HA       LEU  63  97.586  -2.641 -10.620
  493    HB2  LEU  63           HB2      LEU  63  99.632  -3.907  -9.559
  494    HB3  LEU  63           HB1      LEU  63  99.776  -4.622 -11.161
  495    HG   LEU  63           HG       LEU  63  99.729  -1.654 -10.536
  496   HD11  LEU  63          HD11      LEU  63 101.830  -2.964  -9.971
  497   HD12  LEU  63          HD12      LEU  63 102.054  -1.663 -11.140
  498   HD13  LEU  63          HD13      LEU  63 101.968  -3.336 -11.689
  499   HD21  LEU  63          HD21      LEU  63  98.732  -1.862 -12.666
  500   HD22  LEU  63          HD22      LEU  63  99.751  -3.231 -13.111
  501   HD23  LEU  63          HD23      LEU  63 100.436  -1.608 -13.040
  502    H    GLY  64           HN       GLY  64  98.836  -5.556 -12.194
  503    HA2  GLY  64           HA2      GLY  64  97.629  -4.792 -14.712
  504    HA3  GLY  64           HA1      GLY  64  98.627  -6.219 -14.417
  505    H    LEU  65           HN       LEU  65  96.558  -6.849 -15.930
  506    HA   LEU  65           HA       LEU  65  94.174  -7.350 -14.433
  507    HB2  LEU  65           HB2      LEU  65  95.129  -8.304 -17.141
  508    HB3  LEU  65           HB1      LEU  65  93.582  -8.798 -16.460
  509    HG   LEU  65           HG       LEU  65  93.379  -6.830 -17.979
  510   HD11  LEU  65          HD11      LEU  65  91.761  -5.821 -16.686
  511   HD12  LEU  65          HD12      LEU  65  92.797  -5.725 -15.263
  512   HD13  LEU  65          HD13      LEU  65  92.037  -7.256 -15.699
  513   HD21  LEU  65          HD21      LEU  65  94.798  -5.212 -15.865
  514   HD22  LEU  65          HD22      LEU  65  94.436  -4.773 -17.533
  515   HD23  LEU  65          HD23      LEU  65  95.700  -5.951 -17.189
  516    H    ASP  66           HN       ASP  66  97.086  -9.183 -15.216
  517    HA   ASP  66           HA       ASP  66  96.072 -11.633 -13.928
  518    HB2  ASP  66           HB2      ASP  66  98.441 -10.957 -15.657
  519    HB3  ASP  66           HB1      ASP  66  98.239 -12.507 -14.844
  520    H    VAL  67           HN       VAL  67  97.335  -8.844 -12.845
  521    HA   VAL  67           HA       VAL  67  99.380 -10.116 -11.126
  522    HB   VAL  67           HB       VAL  67  98.965  -7.293 -12.072
  523   HG11  VAL  67          HG11      VAL  67 100.286  -8.225  -9.535
  524   HG12  VAL  67          HG12      VAL  67  99.322  -6.775  -9.820
  525   HG13  VAL  67          HG13      VAL  67 100.976  -6.863 -10.417
  526   HG21  VAL  67          HG21      VAL  67 101.550  -8.821 -11.804
  527   HG22  VAL  67          HG22      VAL  67 101.139  -7.530 -12.933
  528   HG23  VAL  67          HG23      VAL  67 100.465  -9.144 -13.159
  529    H    LEU  68           HN       LEU  68  98.210 -10.998  -9.530
  530    HA   LEU  68           HA       LEU  68  96.602  -9.166  -7.850
  531    HB2  LEU  68           HB2      LEU  68  95.105 -10.860  -8.438
  532    HB3  LEU  68           HB1      LEU  68  96.363 -12.089  -8.507
  533    HG   LEU  68           HG       LEU  68  96.566 -12.019  -6.044
  534   HD11  LEU  68          HD11      LEU  68  94.814 -10.766  -4.766
  535   HD12  LEU  68          HD12      LEU  68  94.291 -10.025  -6.278
  536   HD13  LEU  68          HD13      LEU  68  95.905  -9.701  -5.649
  537   HD21  LEU  68          HD21      LEU  68  93.654 -12.325  -6.813
  538   HD22  LEU  68          HD22      LEU  68  94.545 -13.208  -5.573
  539   HD23  LEU  68          HD23      LEU  68  94.887 -13.499  -7.279
  540    H    ILE  69           HN       ILE  69  97.707  -8.531  -6.090
  541    HA   ILE  69           HA       ILE  69  99.786 -10.347  -5.029
  542    HB   ILE  69           HB       ILE  69  99.534  -7.336  -4.993
  543   HG12  ILE  69          HG12      ILE  69 102.080  -8.503  -5.811
  544   HG13  ILE  69          HG11      ILE  69 100.755  -9.156  -6.771
  545   HG21  ILE  69          HG21      ILE  69 100.500  -7.492  -2.929
  546   HG22  ILE  69          HG22      ILE  69 101.964  -7.821  -3.856
  547   HG23  ILE  69          HG23      ILE  69 101.023  -9.155  -3.189
  548   HD11  ILE  69          HD11      ILE  69 101.554  -7.164  -7.878
  549   HD12  ILE  69          HD12      ILE  69 101.458  -6.235  -6.381
  550   HD13  ILE  69          HD13      ILE  69  99.982  -6.789  -7.170
  551    H    ARG  70           HN       ARG  70  99.891 -10.816  -2.881
  552    HA   ARG  70           HA       ARG  70  97.689  -9.834  -1.171
  553    HB2  ARG  70           HB2      ARG  70  97.299 -12.177  -2.070
  554    HB3  ARG  70           HB1      ARG  70  98.710 -12.684  -1.143
  555    HG2  ARG  70           HG2      ARG  70  97.680 -12.183   0.928
  556    HG3  ARG  70           HG1      ARG  70  96.438 -11.187   0.172
  557    HD2  ARG  70           HD2      ARG  70  95.106 -13.016   0.223
  558    HD3  ARG  70           HD1      ARG  70  96.126 -13.692  -1.042
  559    HE   ARG  70           HE       ARG  70  97.060 -14.094   1.694
  560   HH11  ARG  70          HH21      ARG  70  95.321 -15.283  -1.055
  561   HH12  ARG  70          HH22      ARG  70  95.434 -16.944  -0.579
  562   HH21  ARG  70          HH11      ARG  70  97.207 -16.270   2.324
  563   HH22  ARG  70          HH12      ARG  70  96.500 -17.502   1.334
  564    H    MET  71           HN       MET  71  98.286  -9.120   0.755
  565    HA   MET  71           HA       MET  71 100.854  -9.981   1.910
  566    HB2  MET  71           HB2      MET  71 100.221  -7.091   2.195
  567    HB3  MET  71           HB1      MET  71 101.780  -7.886   2.014
  568    HG2  MET  71           HG2      MET  71 101.693  -7.819  -0.302
  569    HG3  MET  71           HG1      MET  71  99.936  -7.872  -0.350
  570    HE1  MET  71           HE1      MET  71 102.478  -4.202   0.797
  571    HE2  MET  71           HE2      MET  71 103.115  -5.743   0.234
  572    HE3  MET  71           HE3      MET  71 102.321  -5.648   1.802
  573    H    GLU  72           HN       GLU  72 100.919  -9.875   4.160
  574    HA   GLU  72           HA       GLU  72  98.295  -9.428   5.409
  575    HB2  GLU  72           HB2      GLU  72  99.400 -11.729   5.619
  576    HB3  GLU  72           HB1      GLU  72 100.615 -10.951   6.630
  577    HG2  GLU  72           HG2      GLU  72  99.246 -11.087   8.416
  578    HG3  GLU  72           HG1      GLU  72  98.028 -10.136   7.574
  579    H    ILE  73           HN       ILE  73  98.149  -7.612   6.672
  580    HA   ILE  73           HA       ILE  73 100.687  -6.521   7.736
  581    HB   ILE  73           HB       ILE  73 100.161  -4.346   6.982
  582   HG12  ILE  73          HG12      ILE  73  97.444  -5.536   6.357
  583   HG13  ILE  73          HG11      ILE  73  97.807  -4.192   7.436
  584   HG21  ILE  73          HG21      ILE  73 100.412  -4.671   4.691
  585   HG22  ILE  73          HG22      ILE  73  99.218  -5.966   4.635
  586   HG23  ILE  73          HG23      ILE  73 100.825  -6.275   5.287
  587   HD11  ILE  73          HD11      ILE  73  97.529  -4.229   4.495
  588   HD12  ILE  73          HD12      ILE  73  98.864  -3.255   5.101
  589   HD13  ILE  73          HD13      ILE  73  97.216  -2.924   5.632
  590    H    SER  74           HN       SER  74 100.445  -4.926   9.406
  591    HA   SER  74           HA       SER  74  97.995  -5.225  11.056
  592    HB2  SER  74           HB2      SER  74  99.599  -6.274  12.386
  593    HB3  SER  74           HB1      SER  74 100.908  -5.263  11.783
  594    HG   SER  74           HG       SER  74 100.354  -3.709  13.147
  595    H    LEU  75           HN       LEU  75  97.259  -3.376  12.098
  596    HA   LEU  75           HA       LEU  75  97.687  -0.963  10.642
  597    HB2  LEU  75           HB2      LEU  75  95.600  -1.738  12.049
  598    HB3  LEU  75           HB1      LEU  75  96.441  -0.931  13.373
  599    HG   LEU  75           HG       LEU  75  96.214   0.548  10.776
  600   HD11  LEU  75          HD11      LEU  75  93.958  -0.168  10.910
  601   HD12  LEU  75          HD12      LEU  75  93.974   1.439  11.640
  602   HD13  LEU  75          HD13      LEU  75  93.926   0.004  12.667
  603   HD21  LEU  75          HD21      LEU  75  97.440   1.466  12.713
  604   HD22  LEU  75          HD22      LEU  75  95.975   1.353  13.689
  605   HD23  LEU  75          HD23      LEU  75  96.036   2.455  12.313
  606    H    ALA  76           HN       ALA  76  99.060   0.575  10.839
  607    HA   ALA  76           HA       ALA  76 100.926   0.512  13.102
  608    HB1  ALA  76           HB1      ALA  76 101.198   1.779  10.373
  609    HB2  ALA  76           HB2      ALA  76 102.021   0.335  10.953
  610    HB3  ALA  76           HB3      ALA  76 102.400   1.903  11.660
  611    H    TRP  77           HN       TRP  77  98.813   2.663  11.273
  612    HA   TRP  77           HA       TRP  77  98.249   4.291  13.583
  613    HB2  TRP  77           HB2      TRP  77  99.252   6.391  12.750
  614    HB3  TRP  77           HB1      TRP  77 100.508   5.168  12.995
  615    HD1  TRP  77           HD1      TRP  77 101.670   4.148  10.893
  616    HE1  TRP  77           HE1      TRP  77 101.532   4.611   8.361
  617    HE3  TRP  77           HE3      TRP  77  97.807   7.477  10.793
  618    HZ2  TRP  77           HZ2      TRP  77 100.168   6.329   6.584
  619    HZ3  TRP  77           HZ3      TRP  77  97.107   8.521   8.654
  620    HH2  TRP  77           HH2      TRP  77  98.272   7.942   6.541
  621    H    ALA  78           HN       ALA  78  96.975   6.304  12.902
  622    HA   ALA  78           HA       ALA  78  95.656   6.133  10.280
  623    HB1  ALA  78           HB1      ALA  78  94.192   5.880  12.914
  624    HB2  ALA  78           HB2      ALA  78  94.257   4.684  11.620
  625    HB3  ALA  78           HB3      ALA  78  93.414   6.212  11.368
  626    H    ARG  79           HN       ARG  79  95.596   8.256   9.556
  627    HA   ARG  79           HA       ARG  79  94.813  10.333  11.428
  628    HB2  ARG  79           HB2      ARG  79  97.431   9.910  11.410
  629    HB3  ARG  79           HB1      ARG  79  97.357  10.895   9.950
  630    HG2  ARG  79           HG2      ARG  79  96.321  12.722  11.165
  631    HG3  ARG  79           HG1      ARG  79  96.174  11.732  12.617
  632    HD2  ARG  79           HD2      ARG  79  98.780  11.483  12.371
  633    HD3  ARG  79           HD1      ARG  79  98.636  12.936  11.386
  634    HE   ARG  79           HE       ARG  79  98.208  12.731  14.262
  635   HH11  ARG  79          HH21      ARG  79  97.810  14.535  11.334
  636   HH12  ARG  79          HH22      ARG  79  97.606  16.056  12.138
  637   HH21  ARG  79          HH11      ARG  79  97.939  14.719  15.320
  638   HH22  ARG  79          HH12      ARG  79  97.678  16.160  14.396
  639    H    ASP  80           HN       ASP  80  93.701  11.955  10.522
  640    HA   ASP  80           HA       ASP  80  92.635  13.202   8.931
  641    HB2  ASP  80           HB2      ASP  80  95.151  12.768   7.326
  642    HB3  ASP  80           HB1      ASP  80  94.012  14.106   7.188
  643    H    GLY  81           HN       GLY  81  91.723  10.577   8.786
  644    HA2  GLY  81           HA2      GLY  81  90.331   9.466   7.333
  645    HA3  GLY  81           HA1      GLY  81  90.852  10.546   6.051
  646    H    LEU  82           HN       LEU  82  93.776   9.782   6.622
  647    HA   LEU  82           HA       LEU  82  93.713   7.433   4.902
  648    HB2  LEU  82           HB2      LEU  82  96.196   8.813   5.895
  649    HB3  LEU  82           HB1      LEU  82  95.946   7.932   4.388
  650    HG   LEU  82           HG       LEU  82  94.789  10.628   5.142
  651   HD11  LEU  82          HD11      LEU  82  96.020  11.335   3.090
  652   HD12  LEU  82          HD12      LEU  82  96.667   9.702   2.947
  653   HD13  LEU  82          HD13      LEU  82  97.096  10.702   4.335
  654   HD21  LEU  82          HD21      LEU  82  93.043   9.481   3.964
  655   HD22  LEU  82          HD22      LEU  82  94.187   8.769   2.827
  656   HD23  LEU  82          HD23      LEU  82  93.844  10.497   2.767
  657    H    LEU  83           HN       LEU  83  95.168   5.619   5.326
  658    HA   LEU  83           HA       LEU  83  95.593   5.047   8.221
  659    HB2  LEU  83           HB2      LEU  83  94.416   3.175   6.180
  660    HB3  LEU  83           HB1      LEU  83  94.742   2.815   7.872
  661    HG   LEU  83           HG       LEU  83  92.886   5.017   6.955
  662   HD11  LEU  83          HD11      LEU  83  91.075   3.406   7.612
  663   HD12  LEU  83          HD12      LEU  83  92.307   2.157   7.777
  664   HD13  LEU  83          HD13      LEU  83  91.995   2.881   6.200
  665   HD21  LEU  83          HD21      LEU  83  93.558   5.453   9.186
  666   HD22  LEU  83          HD22      LEU  83  93.567   3.740   9.607
  667   HD23  LEU  83          HD23      LEU  83  92.037   4.581   9.366
  668    H    GLY  84           HN       GLY  84  97.555   4.082   8.623
  669    HA2  GLY  84           HA2      GLY  84  99.096   3.134   6.290
  670    HA3  GLY  84           HA1      GLY  84  99.794   3.738   7.783
  671    H    PHE  85           HN       PHE  85 100.342   1.206   6.586
  672    HA   PHE  85           HA       PHE  85  99.599  -0.504   8.849
  673    HB2  PHE  85           HB2      PHE  85  99.079  -1.141   5.943
  674    HB3  PHE  85           HB1      PHE  85  99.150  -2.371   7.201
  675    HD1  PHE  85           HD2      PHE  85  97.442  -2.509   8.941
  676    HD2  PHE  85           HD1      PHE  85  97.258   0.488   5.873
  677    HE1  PHE  85           HE2      PHE  85  95.089  -2.029   9.553
  678    HE2  PHE  85           HE1      PHE  85  94.901   0.956   6.483
  679    HZ   PHE  85           HZ       PHE  85  93.822  -0.290   8.321
  680    H    GLU  86           HN       GLU  86 101.154  -2.014   9.365
  681    HA   GLU  86           HA       GLU  86 103.669  -1.803   7.827
  682    HB2  GLU  86           HB2      GLU  86 103.648  -1.272  10.305
  683    HB3  GLU  86           HB1      GLU  86 103.247  -2.965  10.594
  684    HG2  GLU  86           HG2      GLU  86 105.652  -2.130   8.962
  685    HG3  GLU  86           HG1      GLU  86 105.731  -2.365  10.707
  686    H    CYS  87           HN       CYS  87 104.333  -3.525   6.665
  687    HA   CYS  87           HA       CYS  87 102.655  -5.852   6.505
  688    HB2  CYS  87           HB2      CYS  87 103.639  -4.961   4.488
  689    HB3  CYS  87           HB1      CYS  87 105.260  -5.148   5.156
  690    HG   CYS  87           HG       CYS  87 105.225  -7.466   4.305
  691    H    GLN  88           HN       GLN  88 102.839  -7.708   7.525
  692    HA   GLN  88           HA       GLN  88 105.286  -8.248   9.078
  693    HB2  GLN  88           HB2      GLN  88 103.934  -9.741  10.420
  694    HB3  GLN  88           HB1      GLN  88 103.113  -8.186  10.298
  695    HG2  GLN  88           HG2      GLN  88 102.151  -9.576   8.091
  696    HG3  GLN  88           HG1      GLN  88 102.262 -10.823   9.326
  697   HE21  GLN  88          HE21      GLN  88 101.333  -7.328   9.398
  698   HE22  GLN  88          HE22      GLN  88  99.877  -7.592  10.231
  699    H    HIS  89           HN       HIS  89 103.274  -9.458   6.470
  700    HA   HIS  89           HA       HIS  89 105.361 -11.292   5.690
  701    HB2  HIS  89           HB2      HIS  89 104.569 -13.098   6.787
  702    HB3  HIS  89           HB1      HIS  89 103.102 -12.247   7.260
  703    HD2  HIS  89           HD2      HIS  89 101.013 -13.746   6.267
  704    HE1  HIS  89           HE1      HIS  89 102.664 -14.669   2.491
  705    HE2  HIS  89           HE2      HIS  89 100.612 -14.918   3.968
  706    H    ILE  90           HN       ILE  90 105.272 -11.775   3.557
  707    HA   ILE  90           HA       ILE  90 102.856 -11.247   1.972
  708    HB   ILE  90           HB       ILE  90 103.943  -9.074   1.974
  709   HG12  ILE  90          HG12      ILE  90 104.655 -10.537  -0.587
  710   HG13  ILE  90          HG11      ILE  90 103.027 -10.000  -0.180
  711   HG21  ILE  90          HG21      ILE  90 106.158  -9.516   2.661
  712   HG22  ILE  90          HG22      ILE  90 106.333  -9.008   0.984
  713   HG23  ILE  90          HG23      ILE  90 106.405 -10.719   1.400
  714   HD11  ILE  90          HD11      ILE  90 103.712  -8.146  -1.361
  715   HD12  ILE  90          HD12      ILE  90 105.413  -8.396  -0.970
  716   HD13  ILE  90          HD13      ILE  90 104.328  -7.683   0.224
  717    H    ASP  91           HN       ASP  91 102.672 -12.402   0.195
  718    HA   ASP  91           HA       ASP  91 103.959 -14.857   0.036
  719    HB2  ASP  91           HB2      ASP  91 101.771 -13.922  -1.104
  720    HB3  ASP  91           HB1      ASP  91 102.857 -13.641  -2.461
  721    H    LEU  92           HN       LEU  92 105.562 -15.710  -1.085
  722    HA   LEU  92           HA       LEU  92 107.864 -14.239  -1.664
  723    HB2  LEU  92           HB2      LEU  92 107.855 -16.692  -1.320
  724    HB3  LEU  92           HB1      LEU  92 107.076 -16.895  -2.888
  725    HG   LEU  92           HG       LEU  92 109.019 -15.780  -3.974
  726   HD11  LEU  92          HD11      LEU  92 111.118 -15.743  -2.386
  727   HD12  LEU  92          HD12      LEU  92 109.912 -15.602  -1.106
  728   HD13  LEU  92          HD13      LEU  92 109.998 -14.382  -2.375
  729   HD21  LEU  92          HD21      LEU  92 108.917 -18.253  -3.720
  730   HD22  LEU  92          HD22      LEU  92 109.783 -18.114  -2.191
  731   HD23  LEU  92          HD23      LEU  92 110.576 -17.654  -3.698
  732    H    ASP  93           HN       ASP  93 105.291 -15.320  -3.853
  733    HA   ASP  93           HA       ASP  93 106.482 -14.284  -6.224
  734    HB2  ASP  93           HB2      ASP  93 103.578 -14.882  -5.601
  735    HB3  ASP  93           HB1      ASP  93 104.232 -14.568  -7.207
  736    H    SER  94           HN       SER  94 104.141 -13.042  -3.880
  737    HA   SER  94           HA       SER  94 103.501 -10.630  -5.195
  738    HB2  SER  94           HB2      SER  94 103.467 -11.491  -2.311
  739    HB3  SER  94           HB1      SER  94 103.042  -9.849  -2.776
  740    HG   SER  94           HG       SER  94 101.609 -11.005  -4.364
  741    H    ILE  95           HN       ILE  95 106.109 -11.554  -3.023
  742    HA   ILE  95           HA       ILE  95 107.195  -9.023  -2.499
  743    HB   ILE  95           HB       ILE  95 108.414 -11.781  -2.647
  744   HG12  ILE  95          HG12      ILE  95 108.028  -9.888  -0.317
  745   HG13  ILE  95          HG11      ILE  95 106.840 -11.101  -0.785
  746   HG21  ILE  95          HG21      ILE  95 109.740  -9.120  -2.116
  747   HG22  ILE  95          HG22      ILE  95 110.267 -10.406  -3.201
  748   HG23  ILE  95          HG23      ILE  95 110.386 -10.622  -1.456
  749   HD11  ILE  95          HD11      ILE  95 108.039 -12.783   0.139
  750   HD12  ILE  95          HD12      ILE  95 108.959 -11.517   0.952
  751   HD13  ILE  95          HD13      ILE  95 109.550 -12.201  -0.562
  752    H    SER  96           HN       SER  96 107.611 -11.236  -5.213
  753    HA   SER  96           HA       SER  96 109.691  -9.686  -6.393
  754    HB2  SER  96           HB2      SER  96 108.636 -12.219  -6.868
  755    HB3  SER  96           HB1      SER  96 108.109 -11.301  -8.279
  756    HG   SER  96           HG       SER  96 110.736 -10.925  -7.450
  757    H    HIS  97           HN       HIS  97 106.183  -9.734  -6.764
  758    HA   HIS  97           HA       HIS  97 106.181  -7.980  -9.004
  759    HB2  HIS  97           HB2      HIS  97 104.101  -8.713  -6.945
  760    HB3  HIS  97           HB1      HIS  97 103.798  -7.479  -8.154
  761    HD2  HIS  97           HD2      HIS  97 103.965 -11.341  -7.900
  762    HE1  HIS  97           HE1      HIS  97 103.304 -10.362 -11.953
  763    HE2  HIS  97           HE2      HIS  97 103.379 -12.266 -10.272
  764    H    LEU  98           HN       LEU  98 106.179  -7.491  -5.513
  765    HA   LEU  98           HA       LEU  98 105.890  -4.624  -5.634
  766    HB2  LEU  98           HB2      LEU  98 106.296  -6.662  -3.571
  767    HB3  LEU  98           HB1      LEU  98 107.300  -5.240  -3.291
  768    HG   LEU  98           HG       LEU  98 105.230  -3.822  -3.609
  769   HD11  LEU  98          HD11      LEU  98 103.727  -6.416  -3.227
  770   HD12  LEU  98          HD12      LEU  98 104.023  -5.743  -4.829
  771   HD13  LEU  98          HD13      LEU  98 103.079  -4.833  -3.650
  772   HD21  LEU  98          HD21      LEU  98 104.428  -4.203  -1.364
  773   HD22  LEU  98          HD22      LEU  98 106.157  -4.551  -1.371
  774   HD23  LEU  98          HD23      LEU  98 104.992  -5.875  -1.392
  775    H    ARG  99           HN       ARG  99 108.614  -6.840  -5.816
  776    HA   ARG  99           HA       ARG  99 110.627  -4.839  -5.545
  777    HB2  ARG  99           HB2      ARG  99 110.563  -7.604  -6.733
  778    HB3  ARG  99           HB1      ARG  99 111.989  -6.583  -6.923
  779    HG2  ARG  99           HG2      ARG  99 112.236  -6.367  -4.525
  780    HG3  ARG  99           HG1      ARG  99 110.705  -7.199  -4.247
  781    HD2  ARG  99           HD2      ARG  99 112.642  -8.703  -3.899
  782    HD3  ARG  99           HD1      ARG  99 111.614  -9.256  -5.216
  783    HE   ARG  99           HE       ARG  99 114.314  -8.144  -5.457
  784   HH11  ARG  99          HH21      ARG  99 111.380  -9.209  -6.960
  785   HH12  ARG  99          HH22      ARG  99 112.102  -9.442  -8.516
  786   HH21  ARG  99          HH11      ARG  99 115.264  -8.452  -7.495
  787   HH22  ARG  99          HH12      ARG  99 114.298  -9.014  -8.820
  788    H    ARG 100           HN       ARG 100 108.756  -6.106  -8.232
  789    HA   ARG 100           HA       ARG 100 110.063  -4.925 -10.426
  790    HB2  ARG 100           HB2      ARG 100 107.214  -5.707  -9.898
  791    HB3  ARG 100           HB1      ARG 100 107.693  -4.955 -11.414
  792    HG2  ARG 100           HG2      ARG 100 109.223  -7.323 -10.351
  793    HG3  ARG 100           HG1      ARG 100 107.718  -7.566 -11.236
  794    HD2  ARG 100           HD2      ARG 100 108.669  -7.021 -13.229
  795    HD3  ARG 100           HD1      ARG 100 109.561  -5.668 -12.541
  796    HE   ARG 100           HE       ARG 100 110.808  -7.956 -11.594
  797   HH11  ARG 100          HH21      ARG 100 110.036  -6.517 -14.643
  798   HH12  ARG 100          HH22      ARG 100 111.414  -7.175 -15.460
  799   HH21  ARG 100          HH11      ARG 100 112.617  -8.823 -12.656
  800   HH22  ARG 100          HH12      ARG 100 112.876  -8.482 -14.333
  801    H    LEU 101           HN       LEU 101 107.660  -3.641  -8.165
  802    HA   LEU 101           HA       LEU 101 107.222  -1.215  -9.590
  803    HB2  LEU 101           HB2      LEU 101 106.581  -2.198  -6.830
  804    HB3  LEU 101           HB1      LEU 101 106.457  -0.472  -7.150
  805    HG   LEU 101           HG       LEU 101 105.071  -2.621  -8.783
  806   HD11  LEU 101          HD11      LEU 101 104.080  -2.600  -6.594
  807   HD12  LEU 101          HD12      LEU 101 103.010  -1.680  -7.652
  808   HD13  LEU 101          HD13      LEU 101 104.092  -0.836  -6.544
  809   HD21  LEU 101          HD21      LEU 101 105.127  -0.822 -10.238
  810   HD22  LEU 101          HD22      LEU 101 105.272   0.362  -8.939
  811   HD23  LEU 101          HD23      LEU 101 103.707  -0.366  -9.299
  812    H    VAL 102           HN       VAL 102 109.449  -2.177  -7.034
  813    HA   VAL 102           HA       VAL 102 110.445   0.433  -6.488
  814    HB   VAL 102           HB       VAL 102 111.648  -2.306  -6.047
  815   HG11  VAL 102          HG11      VAL 102 112.566   0.458  -5.232
  816   HG12  VAL 102          HG12      VAL 102 113.489  -0.785  -6.076
  817   HG13  VAL 102          HG13      VAL 102 113.078  -0.995  -4.374
  818   HG21  VAL 102          HG21      VAL 102 110.505  -0.384  -4.013
  819   HG22  VAL 102          HG22      VAL 102 110.816  -2.111  -3.832
  820   HG23  VAL 102          HG23      VAL 102 109.486  -1.556  -4.850
  821    H    GLU 103           HN       GLU 103 111.656  -2.221  -8.540
  822    HA   GLU 103           HA       GLU 103 113.975  -0.872  -9.436
  823    HB2  GLU 103           HB2      GLU 103 112.379  -3.129 -10.658
  824    HB3  GLU 103           HB1      GLU 103 113.931  -2.572 -11.285
  825    HG2  GLU 103           HG2      GLU 103 114.890  -2.956  -8.974
  826    HG3  GLU 103           HG1      GLU 103 113.370  -3.741  -8.550
  827    H    LEU 104           HN       LEU 104 110.729  -1.168 -10.863
  828    HA   LEU 104           HA       LEU 104 111.379   0.308 -13.218
  829    HB2  LEU 104           HB2      LEU 104 108.822  -0.591 -11.926
  830    HB3  LEU 104           HB1      LEU 104 108.781   0.514 -13.296
  831    HG   LEU 104           HG       LEU 104 108.657  -2.060 -13.738
  832   HD11  LEU 104          HD11      LEU 104 110.104  -1.725 -15.821
  833   HD12  LEU 104          HD12      LEU 104 110.460  -0.118 -15.190
  834   HD13  LEU 104          HD13      LEU 104 108.799  -0.563 -15.578
  835   HD21  LEU 104          HD21      LEU 104 111.669  -1.780 -13.645
  836   HD22  LEU 104          HD22      LEU 104 110.714  -3.243 -13.865
  837   HD23  LEU 104          HD23      LEU 104 110.754  -2.448 -12.295
  838    H    ASN 105           HN       ASN 105 109.821   1.190 -10.140
  839    HA   ASN 105           HA       ASN 105 109.340   3.897 -10.956
  840    HB2  ASN 105           HB2      ASN 105 109.405   2.717  -8.171
  841    HB3  ASN 105           HB1      ASN 105 108.704   4.268  -8.632
  842   HD21  ASN 105          HD21      ASN 105 106.512   3.648  -8.066
  843   HD22  ASN 105          HD22      ASN 105 105.654   2.487  -8.959
  844    H    LEU 106           HN       LEU 106 111.915   2.222  -9.233
  845    HA   LEU 106           HA       LEU 106 113.269   4.482  -8.225
  846    HB2  LEU 106           HB2      LEU 106 113.850   2.289  -7.421
  847    HB3  LEU 106           HB1      LEU 106 114.289   1.750  -9.041
  848    HG   LEU 106           HG       LEU 106 115.680   4.176  -7.975
  849   HD11  LEU 106          HD11      LEU 106 115.836   2.803  -6.024
  850   HD12  LEU 106          HD12      LEU 106 117.367   2.614  -6.879
  851   HD13  LEU 106          HD13      LEU 106 116.137   1.354  -6.985
  852   HD21  LEU 106          HD21      LEU 106 115.955   2.625 -10.240
  853   HD22  LEU 106          HD22      LEU 106 117.188   1.933  -9.188
  854   HD23  LEU 106          HD23      LEU 106 117.223   3.652  -9.574
  855    H    GLY 107           HN       GLY 107 113.000   3.168 -11.406
  856    HA2  GLY 107           HA2      GLY 107 115.322   4.011 -12.659
  857    HA3  GLY 107           HA1      GLY 107 113.746   3.934 -13.442
  858    H    ASP 108           HN       ASP 108 112.481   5.795 -13.608
  859    HA   ASP 108           HA       ASP 108 112.905   8.236 -12.361
  860    HB2  ASP 108           HB2      ASP 108 114.015   9.382 -14.456
  861    HB3  ASP 108           HB1      ASP 108 115.020   8.596 -13.243
  862    H    GLU 109           HN       GLU 109 110.767   6.656 -13.362
  863    HA   GLU 109           HA       GLU 109 109.695   7.695 -15.781
  864    HB2  GLU 109           HB2      GLU 109 109.016   5.546 -14.610
  865    HB3  GLU 109           HB1      GLU 109 108.106   6.553 -13.482
  866    HG2  GLU 109           HG2      GLU 109 106.801   7.493 -15.325
  867    HG3  GLU 109           HG1      GLU 109 107.746   6.570 -16.492
  868    H    GLU 110           HN       GLU 110 108.204   8.110 -12.577
  869    HA   GLU 110           HA       GLU 110 106.731  10.379 -13.188
  870    HB2  GLU 110           HB2      GLU 110 107.123  10.825 -10.587
  871    HB3  GLU 110           HB1      GLU 110 106.104   9.502 -11.153
  872    HG2  GLU 110           HG2      GLU 110 107.857   8.904  -9.385
  873    HG3  GLU 110           HG1      GLU 110 107.824   7.893 -10.828
  874    H    LEU 111           HN       LEU 111 110.109  10.046 -12.722
  875    HA   LEU 111           HA       LEU 111 111.834  11.541 -12.933
  876    HB2  LEU 111           HB2      LEU 111 109.849  12.594 -14.517
  877    HB3  LEU 111           HB1      LEU 111 110.178  13.931 -13.418
  878    HG   LEU 111           HG       LEU 111 112.250  12.442 -15.063
  879   HD11  LEU 111          HD11      LEU 111 110.875  13.885 -16.457
  880   HD12  LEU 111          HD12      LEU 111 112.443  14.657 -16.221
  881   HD13  LEU 111          HD13      LEU 111 111.041  15.212 -15.307
  882   HD21  LEU 111          HD21      LEU 111 113.596  14.554 -14.246
  883   HD22  LEU 111          HD22      LEU 111 113.432  13.166 -13.173
  884   HD23  LEU 111          HD23      LEU 111 112.402  14.578 -12.949
  885    H    LEU 112           HN       LEU 112 109.040  13.227 -11.466
  886    HA   LEU 112           HA       LEU 112 108.803  14.201  -9.395
  887    HB2  LEU 112           HB2      LEU 112 110.575  12.141  -8.915
  888    HB3  LEU 112           HB1      LEU 112 111.491  13.541  -8.368
  889    HG   LEU 112           HG       LEU 112 108.618  13.254  -7.512
  890   HD11  LEU 112          HD11      LEU 112 109.415  11.086  -6.942
  891   HD12  LEU 112          HD12      LEU 112 109.549  12.039  -5.464
  892   HD13  LEU 112          HD13      LEU 112 110.984  11.714  -6.437
  893   HD21  LEU 112          HD21      LEU 112 109.797  15.313  -6.941
  894   HD22  LEU 112          HD22      LEU 112 111.140  14.393  -6.261
  895   HD23  LEU 112          HD23      LEU 112 109.563  14.364  -5.473
  896    H    GLU 113           HN       GLU 113 111.460  14.737 -11.471
  897    HA   GLU 113           HA       GLU 113 112.852  16.538 -11.840
  898    HB2  GLU 113           HB2      GLU 113 110.443  17.379 -12.283
  899    HB3  GLU 113           HB1      GLU 113 110.618  18.240 -10.755
  900    HG2  GLU 113           HG2      GLU 113 112.877  19.080 -11.770
  901    HG3  GLU 113           HG1      GLU 113 112.172  18.595 -13.311
  902    H    ARG 114           HN       ARG 114 113.178  15.298  -9.287
  903    HA   ARG 114           HA       ARG 114 114.765  17.244  -7.990
  904    HB2  ARG 114           HB2      ARG 114 112.243  17.801  -7.369
  905    HB3  ARG 114           HB1      ARG 114 112.473  16.486  -6.220
  906    HG2  ARG 114           HG2      ARG 114 113.160  18.327  -4.965
  907    HG3  ARG 114           HG1      ARG 114 114.696  17.763  -5.624
  908    HD2  ARG 114           HD2      ARG 114 114.151  19.395  -7.600
  909    HD3  ARG 114           HD1      ARG 114 113.037  20.134  -6.454
  910    HE   ARG 114           HE       ARG 114 114.869  20.955  -5.270
  911   HH11  ARG 114          HH21      ARG 114 115.816  18.560  -7.578
  912   HH12  ARG 114          HH22      ARG 114 117.512  18.862  -7.405
  913   HH21  ARG 114          HH11      ARG 114 117.093  21.363  -5.040
  914   HH22  ARG 114          HH12      ARG 114 118.235  20.449  -5.968
  915    H    GLU 115           HN       GLU 115 115.897  16.383  -6.156
  916    HA   GLU 115           HA       GLU 115 115.417  13.740  -5.194
  917    HB2  GLU 115           HB2      GLU 115 116.274  13.154  -7.425
  918    HB3  GLU 115           HB1      GLU 115 117.728  14.102  -7.116
  919    HG2  GLU 115           HG2      GLU 115 118.093  11.683  -6.697
  920    HG3  GLU 115           HG1      GLU 115 118.318  12.643  -5.239
  921    H    LEU 116           HN       LEU 116 118.036  16.061  -5.851
  922    HA   LEU 116           HA       LEU 116 119.478  15.468  -3.485
  923    HB2  LEU 116           HB2      LEU 116 119.610  18.087  -4.984
  924    HB3  LEU 116           HB1      LEU 116 120.883  17.309  -4.043
  925    HG   LEU 116           HG       LEU 116 119.701  16.304  -6.647
  926   HD11  LEU 116          HD11      LEU 116 121.349  18.231  -6.717
  927   HD12  LEU 116          HD12      LEU 116 121.867  16.785  -7.582
  928   HD13  LEU 116          HD13      LEU 116 122.536  17.148  -5.992
  929   HD21  LEU 116          HD21      LEU 116 121.723  14.656  -6.321
  930   HD22  LEU 116          HD22      LEU 116 120.205  14.329  -5.486
  931   HD23  LEU 116          HD23      LEU 116 121.548  15.067  -4.615
  932    H    ALA 117           HN       ALA 117 116.932  17.739  -4.225
  933    HA   ALA 117           HA       ALA 117 117.283  19.264  -1.867
  934    HB1  ALA 117           HB1      ALA 117 116.008  20.253  -3.696
  935    HB2  ALA 117           HB2      ALA 117 114.955  20.143  -2.286
  936    HB3  ALA 117           HB3      ALA 117 114.804  18.971  -3.594
  937    H    LEU 118           HN       LEU 118 115.878  16.281  -2.584
  938    HA   LEU 118           HA       LEU 118 114.064  15.938  -0.410
  939    HB2  LEU 118           HB2      LEU 118 115.628  13.736  -1.764
  940    HB3  LEU 118           HB1      LEU 118 114.073  13.611  -0.945
  941    HG   LEU 118           HG       LEU 118 114.656  15.075  -3.531
  942   HD11  LEU 118          HD11      LEU 118 113.175  13.461  -4.521
  943   HD12  LEU 118          HD12      LEU 118 112.690  12.848  -2.941
  944   HD13  LEU 118          HD13      LEU 118 114.323  12.554  -3.537
  945   HD21  LEU 118          HD21      LEU 118 112.083  15.413  -3.421
  946   HD22  LEU 118          HD22      LEU 118 113.093  16.477  -2.444
  947   HD23  LEU 118          HD23      LEU 118 112.262  15.115  -1.691
  948    H    LEU 119           HN       LEU 119 117.491  15.628  -0.791
  949    HA   LEU 119           HA       LEU 119 118.145  14.091   1.460
  950    HB2  LEU 119           HB2      LEU 119 119.559  15.724  -0.411
  951    HB3  LEU 119           HB1      LEU 119 120.098  16.179   1.200
  952    HG   LEU 119           HG       LEU 119 121.401  14.308   0.126
  953   HD11  LEU 119          HD11      LEU 119 120.344  14.509   2.797
  954   HD12  LEU 119          HD12      LEU 119 121.919  13.918   2.276
  955   HD13  LEU 119          HD13      LEU 119 120.553  12.807   2.381
  956   HD21  LEU 119          HD21      LEU 119 119.361  12.298   0.818
  957   HD22  LEU 119          HD22      LEU 119 120.429  12.385  -0.580
  958   HD23  LEU 119          HD23      LEU 119 118.928  13.308  -0.563
  959    H    VAL 120           HN       VAL 120 116.582  17.059   1.273
  960    HA   VAL 120           HA       VAL 120 117.309  18.374   3.728
  961    HB   VAL 120           HB       VAL 120 114.823  18.320   2.019
  962   HG11  VAL 120          HG11      VAL 120 114.394  20.493   3.362
  963   HG12  VAL 120          HG12      VAL 120 115.533  19.831   4.534
  964   HG13  VAL 120          HG13      VAL 120 114.046  18.959   4.160
  965   HG21  VAL 120          HG21      VAL 120 117.097  19.320   1.217
  966   HG22  VAL 120          HG22      VAL 120 116.780  20.584   2.404
  967   HG23  VAL 120          HG23      VAL 120 115.649  20.318   1.077
  968    H    SER 121           HN       SER 121 115.855  15.367   3.090
  969    HA   SER 121           HA       SER 121 114.139  15.401   5.446
  970    HB2  SER 121           HB2      SER 121 113.224  13.413   4.606
  971    HB3  SER 121           HB1      SER 121 113.569  14.348   3.161
  972    HG   SER 121           HG       SER 121 114.477  11.952   3.823
  973    H    ALA 122           HN       ALA 122 117.297  14.331   4.471
  974    HA   ALA 122           HA       ALA 122 117.564  12.438   6.677
  975    HB1  ALA 122           HB1      ALA 122 119.922  12.293   5.749
  976    HB2  ALA 122           HB2      ALA 122 119.377  13.357   4.453
  977    HB3  ALA 122           HB3      ALA 122 118.632  11.774   4.664
  978    H    HIS 123           HN       HIS 123 120.316  14.276   5.869
  979    HA   HIS 123           HA       HIS 123 120.180  16.466   7.605
  980    HB2  HIS 123           HB2      HIS 123 120.763  15.719   9.663
  981    HB3  HIS 123           HB1      HIS 123 120.247  14.136   9.091
  982    HD2  HIS 123           HD2      HIS 123 122.275  12.263   9.117
  983    HE1  HIS 123           HE1      HIS 123 125.544  14.924   9.316
  984    HE2  HIS 123           HE2      HIS 123 124.867  12.477   9.330
  985    H    ASP 124           HN       ASP 124 122.148  17.637   7.624
  986    HA   ASP 124           HA       ASP 124 124.399  16.433   6.160
  987    HB2  ASP 124           HB2      ASP 124 124.572  18.667   4.905
  988    HB3  ASP 124           HB1      ASP 124 123.308  17.550   4.390
  989    H    ASP 125           HN       ASP 125 124.040  17.031   8.961
  990    HA   ASP 125           HA       ASP 125 125.137  18.051  10.708
  991    HB2  ASP 125           HB2      ASP 125 127.158  18.241   8.481
  992    HB3  ASP 125           HB1      ASP 125 127.500  18.881  10.088
  993   H5'1  C2E 501          H5'1      C2E 501 105.488   0.767  12.029
  994   H5'2  C2E 501          H5'2      C2E 501 107.114   1.462  12.161
  995    H4'  C2E 501           H4'      C2E 501 107.228  -0.005  10.317
  996    H3'  C2E 501           H3'      C2E 501 106.826   2.836   9.345
  997    H2'  C2E 501           H2'      C2E 501 106.873   2.053   7.118
  998   HO2'  C2E 501          HO2'      C2E 501 107.250  -0.597   7.416
  999    H1'  C2E 501           H1'      C2E 501 105.287  -0.139   7.495
 1000    H8   C2E 501           H8       C2E 501 103.705   2.287   9.793
 1001    HN1  C2E 501           HN1      C2E 501 102.754   3.893   3.671
 1002   HN21  C2E 501          HN21      C2E 501 104.052   2.666   2.356
 1003   HN22  C2E 501          HN22      C2E 501 105.157   1.465   2.984
 1004   H511  C2E 501          H511      C2E 501 107.639   4.845  10.202
 1005   H512  C2E 501          H512      C2E 501 109.300   4.936  10.823
 1006    H4A  C2E 501           H4A      C2E 501 108.230   5.170  13.155
 1007    H3A  C2E 501           H3A      C2E 501 105.759   5.556  11.445
 1008    H2A  C2E 501           H2A      C2E 501 105.067   7.278  12.899
 1009   HO2A  C2E 501          HO2A      C2E 501 106.940   6.080  14.619
 1010    H1A  C2E 501           H1A      C2E 501 107.440   8.573  13.001
 1011    H81  C2E 501           H81      C2E 501 107.535   7.045   9.604
 1012   HN11  C2E 501          HN11      C2E 501 103.554  12.058   9.782
 1013   HN24  C2E 501          HN24      C2E 501 103.902  11.841  13.249
 1014   HN23  C2E 501          HN23      C2E 501 103.173  12.660  11.884
 1015   H5'1  C2E 502          H5'1      C2E 502 102.436  11.832   5.899
 1016   H5'2  C2E 502          H5'2      C2E 502 101.460  10.599   5.079
 1017    H4'  C2E 502           H4'      C2E 502  99.590  12.041   6.494
 1018    H3'  C2E 502           H3'      C2E 502 102.085  12.420   7.970
 1019    H2'  C2E 502           H2'      C2E 502 101.729  10.973   9.727
 1020   HO2'  C2E 502          HO2'      C2E 502  99.517  12.373   9.822
 1021    H1'  C2E 502           H1'      C2E 502  99.714   9.289   8.864
 1022    H8   C2E 502           H8       C2E 502 102.318   8.883   6.263
 1023    HN1  C2E 502           HN1      C2E 502 103.726   5.900  11.739
 1024   HN21  C2E 502          HN21      C2E 502 102.372   6.563  13.345
 1025   HN22  C2E 502          HN22      C2E 502 101.116   7.754  13.084
 1026   H511  C2E 502          H511      C2E 502 103.385  15.870   8.147
 1027   H512  C2E 502          H512      C2E 502 102.308  17.025   7.337
 1028    H4A  C2E 502           H4A      C2E 502 103.296  16.699   5.317
 1029    H3A  C2E 502           H3A      C2E 502 103.300  13.773   6.037
 1030    H2A  C2E 502           H2A      C2E 502 105.036  13.378   4.467
 1031   HO2A  C2E 502          HO2A      C2E 502 103.988  15.659   3.310
 1032    H1A  C2E 502           H1A      C2E 502 106.537  15.582   5.067
 1033    H81  C2E 502           H81      C2E 502 105.376  14.655   8.428
 1034   HN11  C2E 502          HN11      C2E 502 109.010   9.994   6.014
 1035   HN24  C2E 502          HN24      C2E 502 109.375  10.346   3.852
 1036   HN23  C2E 502          HN23      C2E 502 108.729  11.734   3.006
  Start of MODEL    7
    1    H    MET   1           H        MET   1 104.097  26.502  13.624
    2    HA   MET   1           HA       MET   1 105.881  25.075  13.320
    3    HB2  MET   1           HB2      MET   1 103.270  23.811  12.469
    4    HB3  MET   1           HB1      MET   1 104.731  22.851  12.703
    5    HG2  MET   1           HG2      MET   1 103.630  24.723  14.811
    6    HG3  MET   1           HG1      MET   1 103.228  23.007  14.735
    7    HE1  MET   1           HE1      MET   1 104.507  21.252  15.904
    8    HE2  MET   1           HE2      MET   1 104.036  22.518  17.037
    9    HE3  MET   1           HE3      MET   1 105.634  21.785  17.160
   10    H    SER   2           HN       SER   2 104.756  23.007  11.012
   11    HA   SER   2           HA       SER   2 105.091  22.763   8.708
   12    HB2  SER   2           HB2      SER   2 107.060  25.015   8.599
   13    HB3  SER   2           HB1      SER   2 105.949  24.437   7.362
   14    HG   SER   2           HG       SER   2 105.508  26.136   9.545
   15    H    ASP   3           HN       ASP   3 107.129  22.786  11.301
   16    HA   ASP   3           HA       ASP   3 109.351  21.532   9.823
   17    HB2  ASP   3           HB2      ASP   3 110.695  21.801  11.829
   18    HB3  ASP   3           HB1      ASP   3 109.926  23.345  11.468
   19    H    GLN   4           HN       GLN   4 106.903  20.212  10.026
   20    HA   GLN   4           HA       GLN   4 107.630  17.957  11.797
   21    HB2  GLN   4           HB2      GLN   4 104.877  18.959  11.030
   22    HB3  GLN   4           HB1      GLN   4 105.141  17.341  11.686
   23    HG2  GLN   4           HG2      GLN   4 106.149  19.832  13.071
   24    HG3  GLN   4           HG1      GLN   4 104.551  19.158  13.385
   25   HE21  GLN   4          HE21      GLN   4 106.426  16.519  12.641
   26   HE22  GLN   4          HE22      GLN   4 106.936  16.092  14.203
   27    H    HIS   5           HN       HIS   5 106.956  18.990   8.607
   28    HA   HIS   5           HA       HIS   5 106.266  16.533   7.413
   29    HB2  HIS   5           HB2      HIS   5 107.971  18.640   6.091
   30    HB3  HIS   5           HB1      HIS   5 106.811  17.544   5.341
   31    HD2  HIS   5           HD2      HIS   5 104.164  18.127   7.163
   32    HE1  HIS   5           HE1      HIS   5 104.821  22.199   6.261
   33    HE2  HIS   5           HE2      HIS   5 103.113  20.517   7.099
   34    H    ASP   6           HN       ASP   6 108.990  17.317   9.115
   35    HA   ASP   6           HA       ASP   6 111.254  16.484   7.920
   36    HB2  ASP   6           HB2      ASP   6 110.254  15.523  10.608
   37    HB3  ASP   6           HB1      ASP   6 111.927  15.439  10.060
   38    H    GLU   7           HN       GLU   7 112.233  14.616   7.241
   39    HA   GLU   7           HA       GLU   7 110.452  12.449   6.521
   40    HB2  GLU   7           HB2      GLU   7 111.988  13.060   4.832
   41    HB3  GLU   7           HB1      GLU   7 113.351  13.050   5.953
   42    HG2  GLU   7           HG2      GLU   7 113.416  10.702   6.054
   43    HG3  GLU   7           HG1      GLU   7 111.761  10.537   5.477
   44    H    ARG   8           HN       ARG   8 110.251  10.559   7.502
   45    HA   ARG   8           HA       ARG   8 112.148   9.834   9.655
   46    HB2  ARG   8           HB2      ARG   8 109.148   9.777   9.612
   47    HB3  ARG   8           HB1      ARG   8 110.042   8.647  10.614
   48    HG2  ARG   8           HG2      ARG   8 109.722  10.433  12.082
   49    HG3  ARG   8           HG1      ARG   8 111.325  10.779  11.442
   50    HD2  ARG   8           HD2      ARG   8 109.784  12.766  11.490
   51    HD3  ARG   8           HD1      ARG   8 110.434  12.404   9.901
   52    HE   ARG   8           HE       ARG   8 108.139  11.108   9.725
   53   HH11  ARG   8          HH21      ARG   8 108.842  14.176  11.177
   54   HH12  ARG   8          HH22      ARG   8 107.276  14.841  10.853
   55   HH21  ARG   8          HH11      ARG   8 106.090  11.986   9.293
   56   HH22  ARG   8          HH12      ARG   8 105.719  13.602   9.788
   57    H    ARG   9           HN       ARG   9 110.763   8.977   6.702
   58    HA   ARG   9           HA       ARG   9 111.022   6.075   7.163
   59    HB2  ARG   9           HB2      ARG   9 110.075   7.377   4.611
   60    HB3  ARG   9           HB1      ARG   9 109.789   5.731   5.169
   61    HG2  ARG   9           HG2      ARG   9 108.224   6.405   6.781
   62    HG3  ARG   9           HG1      ARG   9 108.786   8.066   6.771
   63    HD2  ARG   9           HD2      ARG   9 107.978   7.639   4.138
   64    HD3  ARG   9           HD1      ARG   9 106.773   6.785   5.089
   65    HE   ARG   9           HE       ARG   9 106.846   9.152   6.364
   66   HH11  ARG   9          HH21      ARG   9 106.849   8.371   2.988
   67   HH12  ARG   9          HH22      ARG   9 105.920   9.759   2.530
   68   HH21  ARG   9          HH11      ARG   9 105.624  10.964   5.764
   69   HH22  ARG   9          HH12      ARG   9 105.224  11.221   4.098
   70    H    ARG  10           HN       ARG  10 113.354   6.391   7.365
   71    HA   ARG  10           HA       ARG  10 115.491   6.925   6.423
   72    HB2  ARG  10           HB2      ARG  10 115.131   4.552   4.705
   73    HB3  ARG  10           HB1      ARG  10 116.287   4.847   5.996
   74    HG2  ARG  10           HG2      ARG  10 115.030   3.220   7.026
   75    HG3  ARG  10           HG1      ARG  10 114.075   4.617   7.507
   76    HD2  ARG  10           HD2      ARG  10 112.629   4.265   5.498
   77    HD3  ARG  10           HD1      ARG  10 113.555   2.817   5.123
   78    HE   ARG  10           HE       ARG  10 111.542   3.087   7.176
   79   HH11  ARG  10          HH21      ARG  10 114.379   1.425   6.101
   80   HH12  ARG  10          HH22      ARG  10 114.041  -0.019   6.995
   81   HH21  ARG  10          HH11      ARG  10 111.089   1.191   8.351
   82   HH22  ARG  10          HH12      ARG  10 112.180  -0.150   8.269
   83    H    PHE  11           HN       PHE  11 113.658   5.566   3.674
   84    HA   PHE  11           HA       PHE  11 114.434   7.906   2.057
   85    HB2  PHE  11           HB2      PHE  11 115.531   5.295   1.797
   86    HB3  PHE  11           HB1      PHE  11 114.446   5.527   0.429
   87    HD1  PHE  11           HD1      PHE  11 116.854   7.684   2.369
   88    HD2  PHE  11           HD2      PHE  11 115.502   6.330  -1.478
   89    HE1  PHE  11           HE1      PHE  11 118.554   9.121   1.265
   90    HE2  PHE  11           HE2      PHE  11 117.199   7.764  -2.576
   91    HZ   PHE  11           HZ       PHE  11 118.721   9.158  -1.206
   92    H    HIS  12           HN       HIS  12 112.890   8.555   0.588
   93    HA   HIS  12           HA       HIS  12 110.236   8.192   1.007
   94    HB2  HIS  12           HB2      HIS  12 109.818   9.034  -1.197
   95    HB3  HIS  12           HB1      HIS  12 111.296   9.802  -0.616
   96    HD2  HIS  12           HD2      HIS  12 113.713   8.199  -1.580
   97    HE1  HIS  12           HE1      HIS  12 111.696   7.208  -5.154
   98    HE2  HIS  12           HE2      HIS  12 113.963   7.285  -4.013
   99    H    ARG  13           HN       ARG  13 108.555   6.929   0.115
  100    HA   ARG  13           HA       ARG  13 109.400   4.205  -0.602
  101    HB2  ARG  13           HB2      ARG  13 106.516   4.747  -0.177
  102    HB3  ARG  13           HB1      ARG  13 107.530   3.459   0.469
  103    HG2  ARG  13           HG2      ARG  13 108.624   5.307   1.920
  104    HG3  ARG  13           HG1      ARG  13 107.223   6.286   1.487
  105    HD2  ARG  13           HD2      ARG  13 106.971   3.518   2.676
  106    HD3  ARG  13           HD1      ARG  13 107.039   4.970   3.664
  107    HE   ARG  13           HE       ARG  13 104.783   4.046   2.162
  108   HH11  ARG  13          HH21      ARG  13 106.498   6.855   3.230
  109   HH12  ARG  13          HH22      ARG  13 105.091   7.865   3.277
  110   HH21  ARG  13          HH11      ARG  13 102.932   5.369   2.225
  111   HH22  ARG  13          HH12      ARG  13 103.077   7.027   2.706
  112    H    ILE  14           HN       ILE  14 107.313   3.215  -1.957
  113    HA   ILE  14           HA       ILE  14 107.509   4.604  -4.536
  114    HB   ILE  14           HB       ILE  14 106.424   1.871  -3.832
  115   HG12  ILE  14          HG12      ILE  14 108.816   1.970  -3.412
  116   HG13  ILE  14          HG11      ILE  14 108.544   1.078  -4.906
  117   HG21  ILE  14          HG21      ILE  14 106.800   3.352  -6.427
  118   HG22  ILE  14          HG22      ILE  14 105.392   2.452  -5.858
  119   HG23  ILE  14          HG23      ILE  14 106.838   1.589  -6.383
  120   HD11  ILE  14          HD11      ILE  14 109.675   3.832  -4.523
  121   HD12  ILE  14          HD12      ILE  14 108.832   3.455  -6.026
  122   HD13  ILE  14          HD13      ILE  14 110.252   2.524  -5.555
  123    H    ALA  15           HN       ALA  15 106.000   6.250  -4.500
  124    HA   ALA  15           HA       ALA  15 103.258   5.618  -3.684
  125    HB1  ALA  15           HB1      ALA  15 104.695   8.171  -4.373
  126    HB2  ALA  15           HB2      ALA  15 103.965   7.704  -2.837
  127    HB3  ALA  15           HB3      ALA  15 102.939   8.102  -4.216
  128    H    PHE  16           HN       PHE  16 101.840   4.937  -5.065
  129    HA   PHE  16           HA       PHE  16 101.662   6.078  -7.724
  130    HB2  PHE  16           HB2      PHE  16 101.705   3.997  -8.915
  131    HB3  PHE  16           HB1      PHE  16 103.176   4.072  -7.950
  132    HD1  PHE  16           HD2      PHE  16 102.710   3.170  -5.379
  133    HD2  PHE  16           HD1      PHE  16 100.665   1.923  -8.946
  134    HE1  PHE  16           HE2      PHE  16 102.114   1.029  -4.292
  135    HE2  PHE  16           HE1      PHE  16 100.079  -0.225  -7.856
  136    HZ   PHE  16           HZ       PHE  16 100.809  -0.672  -5.532
  137    H    ASP  17           HN       ASP  17  99.532   5.592  -8.701
  138    HA   ASP  17           HA       ASP  17  97.547   5.202  -6.581
  139    HB2  ASP  17           HB2      ASP  17  96.906   5.966  -9.416
  140    HB3  ASP  17           HB1      ASP  17  96.037   6.366  -7.935
  141    H    ALA  18           HN       ALA  18  95.902   3.670  -6.697
  142    HA   ALA  18           HA       ALA  18  95.341   1.995  -8.854
  143    HB1  ALA  18           HB1      ALA  18  96.397  -0.139  -7.877
  144    HB2  ALA  18           HB2      ALA  18  97.443   0.945  -6.960
  145    HB3  ALA  18           HB3      ALA  18  97.476   0.972  -8.722
  146    H    ASP  19           HN       ASP  19  94.252  -0.106  -8.041
  147    HA   ASP  19           HA       ASP  19  92.464   0.690  -5.832
  148    HB2  ASP  19           HB2      ASP  19  91.855  -1.800  -7.295
  149    HB3  ASP  19           HB1      ASP  19  90.817  -0.427  -6.924
  150    H    SER  20           HN       SER  20  92.396  -0.354  -3.926
  151    HA   SER  20           HA       SER  20  93.798  -2.938  -3.670
  152    HB2  SER  20           HB2      SER  20  94.525  -2.023  -1.349
  153    HB3  SER  20           HB1      SER  20  95.435  -1.528  -2.773
  154    HG   SER  20           HG       SER  20  93.392   0.128  -2.518
  155    H    GLU  21           HN       GLU  21  93.062  -4.232  -1.922
  156    HA   GLU  21           HA       GLU  21  90.511  -3.394  -0.674
  157    HB2  GLU  21           HB2      GLU  21  91.048  -6.145  -1.830
  158    HB3  GLU  21           HB1      GLU  21  89.550  -5.579  -1.089
  159    HG2  GLU  21           HG2      GLU  21  89.371  -3.848  -2.877
  160    HG3  GLU  21           HG1      GLU  21  90.798  -4.542  -3.646
  161    H    ILE  22           HN       ILE  22  90.224  -4.132   1.427
  162    HA   ILE  22           HA       ILE  22  92.484  -5.711   2.523
  163    HB   ILE  22           HB       ILE  22  91.140  -3.252   3.632
  164   HG12  ILE  22          HG12      ILE  22  94.061  -4.013   3.317
  165   HG13  ILE  22          HG11      ILE  22  93.153  -3.083   2.123
  166   HG21  ILE  22          HG21      ILE  22  91.150  -4.693   5.515
  167   HG22  ILE  22          HG22      ILE  22  92.632  -3.749   5.673
  168   HG23  ILE  22          HG23      ILE  22  92.700  -5.403   5.068
  169   HD11  ILE  22          HD11      ILE  22  92.718  -1.332   3.763
  170   HD12  ILE  22          HD12      ILE  22  94.452  -1.635   3.674
  171   HD13  ILE  22          HD13      ILE  22  93.513  -2.278   5.020
  172    H    LEU  23           HN       LEU  23  92.050  -7.347   3.817
  173    HA   LEU  23           HA       LEU  23  89.213  -7.830   4.538
  174    HB2  LEU  23           HB2      LEU  23  91.061 -10.137   4.211
  175    HB3  LEU  23           HB1      LEU  23  89.351  -9.986   3.799
  176    HG   LEU  23           HG       LEU  23  90.294  -8.244   2.024
  177   HD11  LEU  23          HD11      LEU  23  92.484  -8.544   1.330
  178   HD12  LEU  23          HD12      LEU  23  92.567 -10.195   1.948
  179   HD13  LEU  23          HD13      LEU  23  92.665  -8.831   3.061
  180   HD21  LEU  23          HD21      LEU  23  90.295 -10.038   0.360
  181   HD22  LEU  23          HD22      LEU  23  89.024 -10.341   1.544
  182   HD23  LEU  23          HD23      LEU  23  90.536 -11.243   1.625
  183    H    GLN  24           HN       GLN  24  88.850  -7.919   6.583
  184    HA   GLN  24           HA       GLN  24  90.977  -8.864   8.431
  185    HB2  GLN  24           HB2      GLN  24  90.740  -6.378   8.493
  186    HB3  GLN  24           HB1      GLN  24  89.054  -6.583   8.957
  187    HG2  GLN  24           HG2      GLN  24  90.441  -8.226  10.748
  188    HG3  GLN  24           HG1      GLN  24  91.467  -6.803  10.596
  189   HE21  GLN  24          HE21      GLN  24  90.895  -5.073  11.910
  190   HE22  GLN  24          HE22      GLN  24  89.361  -4.839  12.595
  191    H    GLY  25           HN       GLY  25  90.106 -10.877   8.884
  192    HA2  GLY  25           HA2      GLY  25  88.739 -12.304  10.091
  193    HA3  GLY  25           HA1      GLY  25  87.697 -10.937  10.481
  194    H    GLU  26           HN       GLU  26  85.702 -11.381   9.763
  195    HA   GLU  26           HA       GLU  26  85.352 -12.789   7.197
  196    HB2  GLU  26           HB2      GLU  26  83.050 -13.105   7.914
  197    HB3  GLU  26           HB1      GLU  26  84.143 -13.626   9.198
  198    HG2  GLU  26           HG2      GLU  26  83.896 -11.294  10.186
  199    HG3  GLU  26           HG1      GLU  26  82.585 -11.038   9.037
  200    H    ARG  27           HN       ARG  27  85.937  -9.765   7.954
  201    HA   ARG  27           HA       ARG  27  83.759  -8.580   6.338
  202    HB2  ARG  27           HB2      ARG  27  85.660  -7.101   8.125
  203    HB3  ARG  27           HB1      ARG  27  84.146  -6.542   7.417
  204    HG2  ARG  27           HG2      ARG  27  83.154  -7.177   9.353
  205    HG3  ARG  27           HG1      ARG  27  83.382  -8.836   8.797
  206    HD2  ARG  27           HD2      ARG  27  85.677  -8.765   9.832
  207    HD3  ARG  27           HD1      ARG  27  85.238  -7.218  10.551
  208    HE   ARG  27           HE       ARG  27  84.413  -9.806  11.460
  209   HH11  ARG  27          HH21      ARG  27  83.430  -6.511  11.076
  210   HH12  ARG  27          HH22      ARG  27  82.296  -6.553  12.383
  211   HH21  ARG  27          HH11      ARG  27  82.926  -9.870  13.173
  212   HH22  ARG  27          HH12      ARG  27  82.010  -8.456  13.572
  213    H    ARG  28           HN       ARG  28  84.236  -7.639   4.446
  214    HA   ARG  28           HA       ARG  28  87.065  -7.042   3.784
  215    HB2  ARG  28           HB2      ARG  28  86.084  -9.128   2.634
  216    HB3  ARG  28           HB1      ARG  28  85.052  -8.004   1.748
  217    HG2  ARG  28           HG2      ARG  28  87.258  -6.738   1.210
  218    HG3  ARG  28           HG1      ARG  28  88.059  -8.226   1.701
  219    HD2  ARG  28           HD2      ARG  28  86.454  -9.406   0.061
  220    HD3  ARG  28           HD1      ARG  28  86.139  -7.798  -0.583
  221    HE   ARG  28           HE       ARG  28  88.811  -7.849  -0.693
  222   HH11  ARG  28          HH21      ARG  28  86.443 -10.247  -1.498
  223   HH12  ARG  28          HH22      ARG  28  87.407 -10.979  -2.736
  224   HH21  ARG  28          HH11      ARG  28  90.076  -8.809  -2.316
  225   HH22  ARG  28          HH12      ARG  28  89.460 -10.165  -3.199
  226    H    TRP  29           HN       TRP  29  87.411  -5.279   2.474
  227    HA   TRP  29           HA       TRP  29  85.131  -3.594   1.760
  228    HB2  TRP  29           HB2      TRP  29  87.426  -2.675   3.492
  229    HB3  TRP  29           HB1      TRP  29  86.087  -1.674   2.927
  230    HD1  TRP  29           HD1      TRP  29  83.588  -2.694   3.720
  231    HE1  TRP  29           HE1      TRP  29  82.939  -3.520   6.100
  232    HE3  TRP  29           HE3      TRP  29  88.213  -3.727   5.539
  233    HZ2  TRP  29           HZ2      TRP  29  84.273  -4.492   8.461
  234    HZ3  TRP  29           HZ3      TRP  29  88.525  -4.594   7.834
  235    HH2  TRP  29           HH2      TRP  29  86.559  -4.984   9.306
  236    H    GLU  30           HN       GLU  30  85.689  -1.893   0.322
  237    HA   GLU  30           HA       GLU  30  88.078  -2.502  -1.270
  238    HB2  GLU  30           HB2      GLU  30  85.540  -0.968  -1.868
  239    HB3  GLU  30           HB1      GLU  30  86.935  -0.960  -2.947
  240    HG2  GLU  30           HG2      GLU  30  86.789  -3.312  -3.314
  241    HG3  GLU  30           HG1      GLU  30  85.657  -3.523  -1.978
  242    H    VAL  31           HN       VAL  31  89.765  -1.068  -1.309
  243    HA   VAL  31           HA       VAL  31  89.314   1.684  -0.329
  244    HB   VAL  31           HB       VAL  31  91.506   1.482   0.909
  245   HG11  VAL  31          HG11      VAL  31  90.463   0.506   2.863
  246   HG12  VAL  31          HG12      VAL  31  89.299  -0.363   1.863
  247   HG13  VAL  31          HG13      VAL  31  89.232   1.397   1.968
  248   HG21  VAL  31          HG21      VAL  31  92.328  -0.726   1.441
  249   HG22  VAL  31          HG22      VAL  31  92.182  -0.630  -0.314
  250   HG23  VAL  31          HG23      VAL  31  90.960  -1.488   0.626
  251    H    LEU  32           HN       LEU  32  90.857   3.206  -0.991
  252    HA   LEU  32           HA       LEU  32  92.130   2.533  -3.557
  253    HB2  LEU  32           HB2      LEU  32  90.674   4.499  -3.535
  254    HB3  LEU  32           HB1      LEU  32  91.557   5.176  -2.170
  255    HG   LEU  32           HG       LEU  32  93.645   5.007  -3.741
  256   HD11  LEU  32          HD11      LEU  32  92.651   3.694  -5.520
  257   HD12  LEU  32          HD12      LEU  32  92.987   5.309  -6.146
  258   HD13  LEU  32          HD13      LEU  32  91.340   4.860  -5.704
  259   HD21  LEU  32          HD21      LEU  32  93.173   7.235  -4.616
  260   HD22  LEU  32          HD22      LEU  32  92.526   7.111  -2.981
  261   HD23  LEU  32          HD23      LEU  32  91.443   6.998  -4.367
  262    H    LEU  33           HN       LEU  33  94.274   2.238  -3.648
  263    HA   LEU  33           HA       LEU  33  95.863   2.618  -1.243
  264    HB2  LEU  33           HB2      LEU  33  96.336   0.602  -2.421
  265    HB3  LEU  33           HB1      LEU  33  96.426   1.433  -3.971
  266    HG   LEU  33           HG       LEU  33  98.354   2.380  -1.903
  267   HD11  LEU  33          HD11      LEU  33  98.605   0.086  -1.383
  268   HD12  LEU  33          HD12      LEU  33  99.879   0.419  -2.555
  269   HD13  LEU  33          HD13      LEU  33  98.406  -0.404  -3.065
  270   HD21  LEU  33          HD21      LEU  33  98.116   3.002  -4.440
  271   HD22  LEU  33          HD22      LEU  33  98.947   1.472  -4.717
  272   HD23  LEU  33          HD23      LEU  33  99.729   2.742  -3.777
  273    H    HIS  34           HN       HIS  34  97.733   3.939  -1.136
  274    HA   HIS  34           HA       HIS  34  97.834   6.063  -3.185
  275    HB2  HIS  34           HB2      HIS  34  97.843   6.249  -0.169
  276    HB3  HIS  34           HB1      HIS  34  98.551   7.533  -1.159
  277    HD2  HIS  34           HD2      HIS  34  95.007   6.000  -0.380
  278    HE1  HIS  34           HE1      HIS  34  94.448   9.512  -2.652
  279    HE2  HIS  34           HE2      HIS  34  93.267   7.698  -1.326
  280    H    ASP  35           HN       ASP  35  99.576   3.911  -1.070
  281    HA   ASP  35           HA       ASP  35 101.761   3.962  -2.793
  282    HB2  ASP  35           HB2      ASP  35 103.493   5.131  -1.531
  283    HB3  ASP  35           HB1      ASP  35 102.121   6.226  -1.731
  284    H    VAL  36           HN       VAL  36 103.608   2.684  -2.054
  285    HA   VAL  36           HA       VAL  36 103.099   0.991   0.266
  286    HB   VAL  36           HB       VAL  36 101.993  -0.001  -1.813
  287   HG11  VAL  36          HG11      VAL  36 104.091   0.723  -3.204
  288   HG12  VAL  36          HG12      VAL  36 103.310  -0.815  -3.573
  289   HG13  VAL  36          HG13      VAL  36 104.787  -0.785  -2.611
  290   HG21  VAL  36          HG21      VAL  36 102.586  -2.221  -1.202
  291   HG22  VAL  36          HG22      VAL  36 102.809  -1.275   0.266
  292   HG23  VAL  36          HG23      VAL  36 104.206  -1.737  -0.705
  293    H    SER  37           HN       SER  37 104.914  -0.602   0.571
  294    HA   SER  37           HA       SER  37 107.495   0.283  -0.473
  295    HB2  SER  37           HB2      SER  37 107.127   1.512   1.674
  296    HB3  SER  37           HB1      SER  37 106.924  -0.036   2.488
  297    HG   SER  37           HG       SER  37 109.195   1.224   1.584
  298    H    LEU  38           HN       LEU  38 109.197  -1.408   0.221
  299    HA   LEU  38           HA       LEU  38 108.212  -3.944  -0.495
  300    HB2  LEU  38           HB2      LEU  38 110.467  -4.785   0.001
  301    HB3  LEU  38           HB1      LEU  38 110.556  -3.259  -0.878
  302    HG   LEU  38           HG       LEU  38 110.493  -2.366   1.720
  303   HD11  LEU  38          HD11      LEU  38 112.077  -4.955   1.671
  304   HD12  LEU  38          HD12      LEU  38 110.640  -4.635   2.641
  305   HD13  LEU  38          HD13      LEU  38 112.133  -3.758   2.966
  306   HD21  LEU  38          HD21      LEU  38 112.844  -3.109  -0.042
  307   HD22  LEU  38          HD22      LEU  38 113.014  -2.170   1.441
  308   HD23  LEU  38          HD23      LEU  38 112.062  -1.535   0.099
  309    H    HIS  39           HN       HIS  39 107.679  -2.383   2.336
  310    HA   HIS  39           HA       HIS  39 106.807  -4.784   3.648
  311    HB2  HIS  39           HB2      HIS  39 108.246  -4.353   5.709
  312    HB3  HIS  39           HB1      HIS  39 109.067  -5.059   4.317
  313    HD2  HIS  39           HD2      HIS  39 108.408  -1.252   4.019
  314    HE1  HIS  39           HE1      HIS  39 112.464  -1.722   5.086
  315    HE2  HIS  39           HE2      HIS  39 110.711  -0.058   4.311
  316    H    GLY  40           HN       GLY  40 105.447  -2.472   2.851
  317    HA2  GLY  40           HA2      GLY  40 104.022  -1.795   5.190
  318    HA3  GLY  40           HA1      GLY  40 105.135  -0.486   4.811
  319    H    ILE  41           HN       ILE  41 102.221  -0.360   4.746
  320    HA   ILE  41           HA       ILE  41 101.891   0.588   1.982
  321    HB   ILE  41           HB       ILE  41 100.827  -1.314   1.406
  322   HG12  ILE  41          HG12      ILE  41  98.681  -0.397   3.345
  323   HG13  ILE  41          HG11      ILE  41  98.947   0.341   1.765
  324   HG21  ILE  41          HG21      ILE  41 100.471  -1.832   4.365
  325   HG22  ILE  41          HG22      ILE  41 101.672  -2.559   3.297
  326   HG23  ILE  41          HG23      ILE  41  99.964  -2.940   3.092
  327   HD11  ILE  41          HD11      ILE  41  97.277  -1.794   2.237
  328   HD12  ILE  41          HD12      ILE  41  98.745  -2.599   1.682
  329   HD13  ILE  41          HD13      ILE  41  97.968  -1.385   0.668
  330    H    LEU  42           HN       LEU  42 100.359   2.111   1.669
  331    HA   LEU  42           HA       LEU  42  99.056   3.241   4.082
  332    HB2  LEU  42           HB2      LEU  42 101.022   4.500   2.633
  333    HB3  LEU  42           HB1      LEU  42  99.575   5.064   1.803
  334    HG   LEU  42           HG       LEU  42  99.977   5.216   4.798
  335   HD11  LEU  42          HD11      LEU  42 100.154   7.717   4.261
  336   HD12  LEU  42          HD12      LEU  42 100.430   7.225   2.591
  337   HD13  LEU  42          HD13      LEU  42 101.556   6.731   3.853
  338   HD21  LEU  42          HD21      LEU  42  97.633   5.156   4.152
  339   HD22  LEU  42          HD22      LEU  42  97.907   6.400   2.935
  340   HD23  LEU  42          HD23      LEU  42  98.061   6.791   4.649
  341    H    VAL  43           HN       VAL  43  96.876   3.493   3.888
  342    HA   VAL  43           HA       VAL  43  95.697   3.435   1.183
  343    HB   VAL  43           HB       VAL  43  94.124   1.733   1.749
  344   HG11  VAL  43          HG11      VAL  43  95.612  -0.172   2.093
  345   HG12  VAL  43          HG12      VAL  43  96.860   0.892   2.743
  346   HG13  VAL  43          HG13      VAL  43  96.399   1.008   1.044
  347   HG21  VAL  43          HG21      VAL  43  94.214   0.618   3.991
  348   HG22  VAL  43          HG22      VAL  43  93.721   2.307   4.094
  349   HG23  VAL  43          HG23      VAL  43  95.369   1.840   4.516
  350    H    GLY  44           HN       GLY  44  93.231   3.664   1.407
  351    HA2  GLY  44           HA2      GLY  44  92.736   6.056   3.089
  352    HA3  GLY  44           HA1      GLY  44  91.800   5.591   1.667
  353    H    GLN  45           HN       GLN  45  90.985   6.094   4.606
  354    HA   GLN  45           HA       GLN  45  90.145   3.498   5.525
  355    HB2  GLN  45           HB2      GLN  45  90.852   5.337   7.046
  356    HB3  GLN  45           HB1      GLN  45  89.420   6.240   6.566
  357    HG2  GLN  45           HG2      GLN  45  88.947   3.440   7.464
  358    HG3  GLN  45           HG1      GLN  45  89.461   4.576   8.708
  359   HE21  GLN  45          HE21      GLN  45  87.255   4.425   9.658
  360   HE22  GLN  45          HE22      GLN  45  85.967   5.266   8.939
  361    HA   PRO  46           HA       PRO  46  86.235   4.241   3.404
  362    HB2  PRO  46           HB2      PRO  46  85.318   1.688   3.261
  363    HB3  PRO  46           HB1      PRO  46  86.692   2.221   2.269
  364    HG2  PRO  46           HG2      PRO  46  86.687   0.645   4.801
  365    HG3  PRO  46           HG1      PRO  46  87.708   0.465   3.367
  366    HD2  PRO  46           HD2      PRO  46  88.458   1.813   5.721
  367    HD3  PRO  46           HD1      PRO  46  89.252   1.988   4.145
  368    H    GLN  47           HN       GLN  47  83.893   3.988   3.992
  369    HA   GLN  47           HA       GLN  47  83.429   4.503   6.735
  370    HB2  GLN  47           HB2      GLN  47  81.475   3.795   4.543
  371    HB3  GLN  47           HB1      GLN  47  81.040   4.453   6.120
  372    HG2  GLN  47           HG2      GLN  47  81.129   6.309   4.609
  373    HG3  GLN  47           HG1      GLN  47  82.577   6.404   5.610
  374   HE21  GLN  47          HE21      GLN  47  81.400   5.605   2.352
  375   HE22  GLN  47          HE22      GLN  47  82.929   5.628   1.616
  376    H    ASP  48           HN       ASP  48  82.868   1.595   4.776
  377    HA   ASP  48           HA       ASP  48  81.503   0.159   6.835
  378    HB2  ASP  48           HB2      ASP  48  82.775  -0.638   4.227
  379    HB3  ASP  48           HB1      ASP  48  82.057  -1.829   5.310
  380    H    TRP  49           HN       TRP  49  84.517   1.208   7.008
  381    HA   TRP  49           HA       TRP  49  86.157  -1.016   7.497
  382    HB2  TRP  49           HB2      TRP  49  86.911   1.354   7.280
  383    HB3  TRP  49           HB1      TRP  49  86.274   1.658   8.892
  384    HD1  TRP  49           HD1      TRP  49  87.569   0.727  10.915
  385    HE1  TRP  49           HE1      TRP  49  89.974  -0.275  11.192
  386    HE3  TRP  49           HE3      TRP  49  88.571  -0.281   6.069
  387    HZ2  TRP  49           HZ2      TRP  49  92.064  -1.392   9.419
  388    HZ3  TRP  49           HZ3      TRP  49  90.704  -1.311   5.369
  389    HH2  TRP  49           HH2      TRP  49  92.424  -1.872   7.049
  390    H    ASN  50           HN       ASN  50  84.321  -2.311   8.637
  391    HA   ASN  50           HA       ASN  50  84.165  -1.619  11.484
  392    HB2  ASN  50           HB2      ASN  50  82.043  -2.253  10.525
  393    HB3  ASN  50           HB1      ASN  50  82.728  -3.731   9.857
  394   HD21  ASN  50          HD21      ASN  50  84.087  -3.132  12.913
  395   HD22  ASN  50          HD22      ASN  50  83.076  -4.143  13.828
  396    H    GLY  51           HN       GLY  51  86.433  -2.008  11.811
  397    HA2  GLY  51           HA2      GLY  51  86.961  -4.836  12.421
  398    HA3  GLY  51           HA1      GLY  51  88.117  -3.968  11.415
  399    H    ASP  52           HN       ASP  52  88.501  -5.155  14.067
  400    HA   ASP  52           HA       ASP  52  88.765  -2.899  15.888
  401    HB2  ASP  52           HB2      ASP  52  88.123  -5.371  16.450
  402    HB3  ASP  52           HB1      ASP  52  89.865  -5.633  16.427
  403    HA   PRO  53           HA       PRO  53  92.815  -1.877  14.169
  404    HB2  PRO  53           HB2      PRO  53  92.969  -0.554  16.859
  405    HB3  PRO  53           HB1      PRO  53  93.392   0.097  15.266
  406    HG2  PRO  53           HG2      PRO  53  91.128   0.782  16.467
  407    HG3  PRO  53           HG1      PRO  53  91.200   0.535  14.712
  408    HD2  PRO  53           HD2      PRO  53  89.983  -1.206  16.807
  409    HD3  PRO  53           HD1      PRO  53  89.527  -0.998  15.101
  410    H    GLN  54           HN       GLN  54  92.123  -3.437  17.189
  411    HA   GLN  54           HA       GLN  54  94.861  -3.988  17.847
  412    HB2  GLN  54           HB2      GLN  54  92.268  -5.106  18.925
  413    HB3  GLN  54           HB1      GLN  54  93.858  -5.480  19.588
  414    HG2  GLN  54           HG2      GLN  54  93.481  -2.597  19.261
  415    HG3  GLN  54           HG1      GLN  54  92.240  -3.302  20.295
  416   HE21  GLN  54          HE21      GLN  54  93.557  -5.254  21.721
  417   HE22  GLN  54          HE22      GLN  54  94.849  -4.589  22.598
  418    H    ARG  55           HN       ARG  55  92.436  -5.557  15.904
  419    HA   ARG  55           HA       ARG  55  93.966  -8.062  15.878
  420    HB2  ARG  55           HB2      ARG  55  91.228  -7.241  14.975
  421    HB3  ARG  55           HB1      ARG  55  91.992  -8.606  14.164
  422    HG2  ARG  55           HG2      ARG  55  92.483  -9.309  16.734
  423    HG3  ARG  55           HG1      ARG  55  91.010  -8.371  16.973
  424    HD2  ARG  55           HD2      ARG  55  90.394 -10.682  16.595
  425    HD3  ARG  55           HD1      ARG  55  89.916  -9.742  15.184
  426    HE   ARG  55           HE       ARG  55  91.512 -10.897  13.929
  427   HH11  ARG  55          HH21      ARG  55  91.931 -11.413  17.323
  428   HH12  ARG  55          HH22      ARG  55  93.107 -12.670  17.129
  429   HH21  ARG  55          HH11      ARG  55  93.053 -12.549  13.663
  430   HH22  ARG  55          HH12      ARG  55  93.744 -13.310  15.057
  431    HA   PRO  56           HA       PRO  56  96.167  -7.163  12.230
  432    HB2  PRO  56           HB2      PRO  56  96.224  -9.627  10.987
  433    HB3  PRO  56           HB1      PRO  56  97.229  -9.195  12.384
  434    HG2  PRO  56           HG2      PRO  56  94.684 -10.744  12.292
  435    HG3  PRO  56           HG1      PRO  56  96.136 -11.015  13.271
  436    HD2  PRO  56           HD2      PRO  56  93.896  -9.856  14.295
  437    HD3  PRO  56           HD1      PRO  56  95.527  -9.436  14.860
  438    H    PHE  57           HN       PHE  57  96.098  -7.033   9.919
  439    HA   PHE  57           HA       PHE  57  93.407  -7.331   8.713
  440    HB2  PHE  57           HB2      PHE  57  95.313  -4.992   8.386
  441    HB3  PHE  57           HB1      PHE  57  93.788  -5.199   7.531
  442    HD1  PHE  57           HD2      PHE  57  95.242  -4.915  10.972
  443    HD2  PHE  57           HD1      PHE  57  91.770  -4.442   8.489
  444    HE1  PHE  57           HE2      PHE  57  94.036  -3.833  12.852
  445    HE2  PHE  57           HE1      PHE  57  90.567  -3.370  10.366
  446    HZ   PHE  57           HZ       PHE  57  91.696  -3.065  12.548
  447    H    GLU  58           HN       GLU  58  93.520  -7.613   6.327
  448    HA   GLU  58           HA       GLU  58  96.224  -8.352   5.404
  449    HB2  GLU  58           HB2      GLU  58  93.608  -9.798   4.966
  450    HB3  GLU  58           HB1      GLU  58  94.970 -10.024   3.869
  451    HG2  GLU  58           HG2      GLU  58  96.392 -10.647   5.821
  452    HG3  GLU  58           HG1      GLU  58  94.974 -10.524   6.860
  453    H    ALA  59           HN       ALA  59  96.835  -7.521   3.395
  454    HA   ALA  59           HA       ALA  59  94.821  -5.811   2.045
  455    HB1  ALA  59           HB1      ALA  59  96.298  -4.170   2.390
  456    HB2  ALA  59           HB2      ALA  59  97.401  -5.001   1.296
  457    HB3  ALA  59           HB3      ALA  59  97.487  -5.304   3.028
  458    H    ARG  60           HN       ARG  60  94.478  -6.051  -0.059
  459    HA   ARG  60           HA       ARG  60  96.278  -7.838  -1.590
  460    HB2  ARG  60           HB2      ARG  60  93.261  -7.588  -1.688
  461    HB3  ARG  60           HB1      ARG  60  94.209  -8.439  -2.907
  462    HG2  ARG  60           HG2      ARG  60  94.815  -9.191  -0.101
  463    HG3  ARG  60           HG1      ARG  60  93.202  -9.631  -0.658
  464    HD2  ARG  60           HD2      ARG  60  95.647 -10.231  -2.318
  465    HD3  ARG  60           HD1      ARG  60  95.107 -11.333  -1.053
  466    HE   ARG  60           HE       ARG  60  93.699 -10.727  -3.554
  467   HH11  ARG  60          HH21      ARG  60  93.757 -12.268  -0.452
  468   HH12  ARG  60          HH22      ARG  60  92.498 -13.392  -0.839
  469   HH21  ARG  60          HH11      ARG  60  92.050 -12.186  -4.060
  470   HH22  ARG  60          HH12      ARG  60  91.530 -13.346  -2.883
  471    H    LEU  61           HN       LEU  61  97.176  -6.835  -3.335
  472    HA   LEU  61           HA       LEU  61  96.024  -4.232  -4.120
  473    HB2  LEU  61           HB2      LEU  61  98.735  -5.200  -4.963
  474    HB3  LEU  61           HB1      LEU  61  98.160  -3.550  -4.746
  475    HG   LEU  61           HG       LEU  61  98.620  -5.561  -2.520
  476   HD11  LEU  61          HD11      LEU  61 100.450  -3.957  -1.902
  477   HD12  LEU  61          HD12      LEU  61 100.163  -3.112  -3.423
  478   HD13  LEU  61          HD13      LEU  61 100.730  -4.781  -3.437
  479   HD21  LEU  61          HD21      LEU  61  96.889  -4.123  -1.783
  480   HD22  LEU  61          HD22      LEU  61  97.581  -2.725  -2.604
  481   HD23  LEU  61          HD23      LEU  61  98.355  -3.370  -1.156
  482    H    TYR  62           HN       TYR  62  95.790  -3.674  -6.288
  483    HA   TYR  62           HA       TYR  62  95.979  -5.860  -8.245
  484    HB2  TYR  62           HB2      TYR  62  93.581  -4.020  -8.053
  485    HB3  TYR  62           HB1      TYR  62  93.775  -5.420  -9.107
  486    HD1  TYR  62           HD1      TYR  62  93.642  -4.410  -5.508
  487    HD2  TYR  62           HD2      TYR  62  93.138  -7.569  -8.378
  488    HE1  TYR  62           HE1      TYR  62  92.707  -5.880  -3.733
  489    HE2  TYR  62           HE2      TYR  62  92.208  -9.033  -6.606
  490    HH   TYR  62           HH       TYR  62  91.134  -7.915  -3.675
  491    H    LEU  63           HN       LEU  63  97.437  -5.134  -9.621
  492    HA   LEU  63           HA       LEU  63  97.411  -2.285 -10.414
  493    HB2  LEU  63           HB2      LEU  63  99.501  -3.812  -9.533
  494    HB3  LEU  63           HB1      LEU  63  99.670  -3.996 -11.275
  495    HG   LEU  63           HG       LEU  63  99.294  -1.284  -9.987
  496   HD11  LEU  63          HD11      LEU  63 101.807  -1.092 -10.265
  497   HD12  LEU  63          HD12      LEU  63 101.838  -2.842 -10.491
  498   HD13  LEU  63          HD13      LEU  63 101.280  -2.159  -8.963
  499   HD21  LEU  63          HD21      LEU  63 100.643  -2.083 -12.581
  500   HD22  LEU  63          HD22      LEU  63 100.154  -0.465 -12.078
  501   HD23  LEU  63          HD23      LEU  63  98.932  -1.670 -12.481
  502    H    GLY  64           HN       GLY  64  98.670  -5.106 -12.148
  503    HA2  GLY  64           HA2      GLY  64  97.410  -4.240 -14.608
  504    HA3  GLY  64           HA1      GLY  64  98.429  -5.667 -14.395
  505    H    LEU  65           HN       LEU  65  96.434  -6.382 -15.878
  506    HA   LEU  65           HA       LEU  65  94.027  -6.910 -14.413
  507    HB2  LEU  65           HB2      LEU  65  93.499  -8.361 -16.466
  508    HB3  LEU  65           HB1      LEU  65  93.722  -6.635 -16.752
  509    HG   LEU  65           HG       LEU  65  96.190  -8.296 -16.888
  510   HD11  LEU  65          HD11      LEU  65  95.670  -9.007 -19.218
  511   HD12  LEU  65          HD12      LEU  65  94.014  -8.443 -18.995
  512   HD13  LEU  65          HD13      LEU  65  94.626  -9.785 -18.028
  513   HD21  LEU  65          HD21      LEU  65  95.151  -6.319 -18.918
  514   HD22  LEU  65          HD22      LEU  65  96.821  -6.703 -18.506
  515   HD23  LEU  65          HD23      LEU  65  95.833  -5.759 -17.391
  516    H    ASP  66           HN       ASP  66  96.972  -8.727 -15.193
  517    HA   ASP  66           HA       ASP  66  95.946 -11.191 -13.935
  518    HB2  ASP  66           HB2      ASP  66  97.048 -11.123 -16.219
  519    HB3  ASP  66           HB1      ASP  66  98.540 -10.713 -15.374
  520    H    VAL  67           HN       VAL  67  97.241  -8.418 -12.827
  521    HA   VAL  67           HA       VAL  67  99.316  -9.705 -11.168
  522    HB   VAL  67           HB       VAL  67  98.776  -6.838 -11.923
  523   HG11  VAL  67          HG11      VAL  67 100.874  -6.448 -10.419
  524   HG12  VAL  67          HG12      VAL  67 100.389  -7.947  -9.627
  525   HG13  VAL  67          HG13      VAL  67  99.297  -6.561  -9.641
  526   HG21  VAL  67          HG21      VAL  67 100.159  -8.458 -13.349
  527   HG22  VAL  67          HG22      VAL  67 101.330  -8.457 -12.028
  528   HG23  VAL  67          HG23      VAL  67 100.960  -6.958 -12.883
  529    H    LEU  68           HN       LEU  68  98.168 -10.691  -9.596
  530    HA   LEU  68           HA       LEU  68  96.546  -8.972  -7.822
  531    HB2  LEU  68           HB2      LEU  68  95.035 -10.619  -8.433
  532    HB3  LEU  68           HB1      LEU  68  96.292 -11.818  -8.709
  533    HG   LEU  68           HG       LEU  68  96.585 -12.151  -6.328
  534   HD11  LEU  68          HD11      LEU  68  95.099  -9.600  -6.193
  535   HD12  LEU  68          HD12      LEU  68  96.256 -10.289  -5.056
  536   HD13  LEU  68          HD13      LEU  68  94.572 -10.799  -5.015
  537   HD21  LEU  68          HD21      LEU  68  93.612 -12.033  -6.913
  538   HD22  LEU  68          HD22      LEU  68  94.433 -13.119  -5.792
  539   HD23  LEU  68          HD23      LEU  68  94.681 -13.293  -7.530
  540    H    ILE  69           HN       ILE  69  97.629  -8.431  -6.027
  541    HA   ILE  69           HA       ILE  69  99.732 -10.276  -5.052
  542    HB   ILE  69           HB       ILE  69  99.514  -7.327  -4.458
  543   HG12  ILE  69          HG12      ILE  69  99.637  -7.645  -6.904
  544   HG13  ILE  69          HG11      ILE  69 101.151  -6.985  -6.284
  545   HG21  ILE  69          HG21      ILE  69 101.978  -9.065  -4.510
  546   HG22  ILE  69          HG22      ILE  69 100.953  -8.970  -3.079
  547   HG23  ILE  69          HG23      ILE  69 101.741  -7.517  -3.699
  548   HD11  ILE  69          HD11      ILE  69 101.728  -8.742  -7.817
  549   HD12  ILE  69          HD12      ILE  69 100.578  -9.849  -7.075
  550   HD13  ILE  69          HD13      ILE  69 102.024  -9.364  -6.196
  551    H    ARG  70           HN       ARG  70  99.901 -10.771  -2.902
  552    HA   ARG  70           HA       ARG  70  97.722  -9.848  -1.132
  553    HB2  ARG  70           HB2      ARG  70  97.322 -12.038  -0.321
  554    HB3  ARG  70           HB1      ARG  70  97.385 -12.200  -2.077
  555    HG2  ARG  70           HG2      ARG  70  99.923 -12.680  -1.705
  556    HG3  ARG  70           HG1      ARG  70  99.449 -13.004  -0.037
  557    HD2  ARG  70           HD2      ARG  70  98.613 -14.448  -2.545
  558    HD3  ARG  70           HD1      ARG  70  99.291 -15.116  -1.064
  559    HE   ARG  70           HE       ARG  70  96.502 -14.435  -1.546
  560   HH11  ARG  70          HH21      ARG  70  99.011 -15.105   0.738
  561   HH12  ARG  70          HH22      ARG  70  97.927 -15.595   1.996
  562   HH21  ARG  70          HH11      ARG  70  95.071 -15.081   0.099
  563   HH22  ARG  70          HH12      ARG  70  95.696 -15.581   1.634
  564    H    MET  71           HN       MET  71  98.292  -9.226   0.814
  565    HA   MET  71           HA       MET  71 100.876 -10.016   1.967
  566    HB2  MET  71           HB2      MET  71 100.589  -7.217   2.422
  567    HB3  MET  71           HB1      MET  71 101.881  -8.059   1.577
  568    HG2  MET  71           HG2      MET  71 100.996  -7.608  -0.511
  569    HG3  MET  71           HG1      MET  71  99.334  -7.593   0.076
  570    HE1  MET  71           HE1      MET  71 102.390  -4.244   0.935
  571    HE2  MET  71           HE2      MET  71 102.743  -5.653  -0.059
  572    HE3  MET  71           HE3      MET  71 102.412  -5.856   1.659
  573    H    GLU  72           HN       GLU  72 100.944  -9.752   4.240
  574    HA   GLU  72           HA       GLU  72  98.302  -9.340   5.454
  575    HB2  GLU  72           HB2      GLU  72  99.494 -11.530   5.868
  576    HB3  GLU  72           HB1      GLU  72 100.738 -10.624   6.727
  577    HG2  GLU  72           HG2      GLU  72  99.463 -10.511   8.591
  578    HG3  GLU  72           HG1      GLU  72  98.101  -9.861   7.684
  579    H    ILE  73           HN       ILE  73  98.035  -7.487   6.712
  580    HA   ILE  73           HA       ILE  73 100.493  -6.111   7.627
  581    HB   ILE  73           HB       ILE  73  99.289  -3.972   6.966
  582   HG12  ILE  73          HG12      ILE  73  97.701  -5.915   5.263
  583   HG13  ILE  73          HG11      ILE  73  97.072  -5.168   6.730
  584   HG21  ILE  73          HG21      ILE  73 101.004  -4.289   5.481
  585   HG22  ILE  73          HG22      ILE  73  99.703  -4.710   4.369
  586   HG23  ILE  73          HG23      ILE  73 100.589  -5.979   5.207
  587   HD11  ILE  73          HD11      ILE  73  96.438  -3.967   4.608
  588   HD12  ILE  73          HD12      ILE  73  98.145  -3.587   4.381
  589   HD13  ILE  73          HD13      ILE  73  97.281  -2.965   5.780
  590    H    SER  74           HN       SER  74 100.238  -4.630   9.308
  591    HA   SER  74           HA       SER  74  97.789  -4.956  10.953
  592    HB2  SER  74           HB2      SER  74  99.610  -6.145  12.022
  593    HB3  SER  74           HB1      SER  74 100.684  -4.764  11.824
  594    HG   SER  74           HG       SER  74  98.291  -4.232  13.090
  595    H    LEU  75           HN       LEU  75  97.131  -3.112  12.159
  596    HA   LEU  75           HA       LEU  75  97.530  -0.625  10.835
  597    HB2  LEU  75           HB2      LEU  75  95.569  -1.559  12.415
  598    HB3  LEU  75           HB1      LEU  75  96.486  -0.679  13.633
  599    HG   LEU  75           HG       LEU  75  96.419   1.333  12.106
  600   HD11  LEU  75          HD11      LEU  75  95.955   0.537   9.951
  601   HD12  LEU  75          HD12      LEU  75  94.376   1.132  10.461
  602   HD13  LEU  75          HD13      LEU  75  94.731  -0.591  10.533
  603   HD21  LEU  75          HD21      LEU  75  94.028   1.841  12.611
  604   HD22  LEU  75          HD22      LEU  75  94.887   1.153  13.989
  605   HD23  LEU  75          HD23      LEU  75  93.794   0.146  13.036
  606    H    ALA  76           HN       ALA  76  99.101   0.745  10.976
  607    HA   ALA  76           HA       ALA  76 100.961   0.585  13.241
  608    HB1  ALA  76           HB1      ALA  76 102.026   0.368  11.070
  609    HB2  ALA  76           HB2      ALA  76 102.501   1.896  11.805
  610    HB3  ALA  76           HB3      ALA  76 101.284   1.872  10.526
  611    H    TRP  77           HN       TRP  77  99.018   2.831  11.390
  612    HA   TRP  77           HA       TRP  77  98.469   4.519  13.662
  613    HB2  TRP  77           HB2      TRP  77  99.594   6.553  12.828
  614    HB3  TRP  77           HB1      TRP  77 100.784   5.275  13.110
  615    HD1  TRP  77           HD1      TRP  77 102.017   4.259  11.053
  616    HE1  TRP  77           HE1      TRP  77 101.929   4.677   8.513
  617    HE3  TRP  77           HE3      TRP  77  98.157   7.594  10.827
  618    HZ2  TRP  77           HZ2      TRP  77 100.621   6.403   6.683
  619    HZ3  TRP  77           HZ3      TRP  77  97.520   8.629   8.665
  620    HH2  TRP  77           HH2      TRP  77  98.729   8.026   6.585
  621    H    ALA  78           HN       ALA  78  97.160   6.477  12.956
  622    HA   ALA  78           HA       ALA  78  95.960   6.269  10.271
  623    HB1  ALA  78           HB1      ALA  78  94.550   4.815  11.587
  624    HB2  ALA  78           HB2      ALA  78  93.681   6.315  11.264
  625    HB3  ALA  78           HB3      ALA  78  94.403   6.037  12.850
  626    H    ARG  79           HN       ARG  79  95.859   8.356   9.491
  627    HA   ARG  79           HA       ARG  79  94.968  10.461  11.281
  628    HB2  ARG  79           HB2      ARG  79  97.545  10.173  11.443
  629    HB3  ARG  79           HB1      ARG  79  97.576  10.922   9.850
  630    HG2  ARG  79           HG2      ARG  79  96.536  12.919  10.676
  631    HG3  ARG  79           HG1      ARG  79  96.161  12.160  12.223
  632    HD2  ARG  79           HD2      ARG  79  98.597  11.917  12.658
  633    HD3  ARG  79           HD1      ARG  79  98.929  12.763  11.150
  634    HE   ARG  79           HE       ARG  79  98.438  14.751  12.238
  635   HH11  ARG  79          HH21      ARG  79  97.148  12.045  13.965
  636   HH12  ARG  79          HH22      ARG  79  96.597  12.987  15.310
  637   HH21  ARG  79          HH11      ARG  79  97.715  15.997  13.999
  638   HH22  ARG  79          HH12      ARG  79  96.918  15.226  15.329
  639    H    ASP  80           HN       ASP  80  93.812  12.013  10.299
  640    HA   ASP  80           HA       ASP  80  92.735  13.182   8.662
  641    HB2  ASP  80           HB2      ASP  80  95.473  12.851   7.462
  642    HB3  ASP  80           HB1      ASP  80  94.208  13.774   6.656
  643    H    GLY  81           HN       GLY  81  91.875  10.530   8.552
  644    HA2  GLY  81           HA2      GLY  81  90.522   9.390   7.080
  645    HA3  GLY  81           HA1      GLY  81  91.095  10.427   5.785
  646    H    LEU  82           HN       LEU  82  93.975   9.707   6.417
  647    HA   LEU  82           HA       LEU  82  93.946   7.257   4.836
  648    HB2  LEU  82           HB2      LEU  82  96.456   8.636   5.731
  649    HB3  LEU  82           HB1      LEU  82  96.129   7.763   4.234
  650    HG   LEU  82           HG       LEU  82  95.041  10.482   5.012
  651   HD11  LEU  82          HD11      LEU  82  97.443  10.223   4.140
  652   HD12  LEU  82          HD12      LEU  82  96.399  11.329   3.247
  653   HD13  LEU  82          HD13      LEU  82  96.717   9.713   2.614
  654   HD21  LEU  82          HD21      LEU  82  93.281   9.390   3.818
  655   HD22  LEU  82          HD22      LEU  82  94.414   8.624   2.704
  656   HD23  LEU  82          HD23      LEU  82  94.125  10.362   2.613
  657    H    LEU  83           HN       LEU  83  95.332   5.449   5.396
  658    HA   LEU  83           HA       LEU  83  95.659   5.072   8.340
  659    HB2  LEU  83           HB2      LEU  83  94.703   3.047   6.331
  660    HB3  LEU  83           HB1      LEU  83  94.894   2.808   8.065
  661    HG   LEU  83           HG       LEU  83  93.052   4.864   6.821
  662   HD11  LEU  83          HD11      LEU  83  92.581   2.047   7.816
  663   HD12  LEU  83          HD12      LEU  83  92.157   2.729   6.246
  664   HD13  LEU  83          HD13      LEU  83  91.277   3.226   7.691
  665   HD21  LEU  83          HD21      LEU  83  93.503   5.604   9.006
  666   HD22  LEU  83          HD22      LEU  83  93.672   3.964   9.631
  667   HD23  LEU  83          HD23      LEU  83  92.075   4.602   9.247
  668    H    GLY  84           HN       GLY  84  97.663   4.228   8.904
  669    HA2  GLY  84           HA2      GLY  84  99.463   3.458   6.736
  670    HA3  GLY  84           HA1      GLY  84  99.902   3.761   8.413
  671    H    PHE  85           HN       PHE  85 100.549   1.464   6.756
  672    HA   PHE  85           HA       PHE  85  99.559  -0.595   8.590
  673    HB2  PHE  85           HB2      PHE  85  99.092  -0.470   5.634
  674    HB3  PHE  85           HB1      PHE  85  99.298  -2.035   6.409
  675    HD1  PHE  85           HD2      PHE  85  97.878  -2.495   8.531
  676    HD2  PHE  85           HD1      PHE  85  97.010   0.608   5.696
  677    HE1  PHE  85           HE2      PHE  85  95.543  -2.399   9.355
  678    HE2  PHE  85           HE1      PHE  85  94.673   0.705   6.519
  679    HZ   PHE  85           HZ       PHE  85  93.943  -0.792   8.350
  680    H    GLU  86           HN       GLU  86 101.149  -1.953   9.187
  681    HA   GLU  86           HA       GLU  86 103.676  -1.796   7.681
  682    HB2  GLU  86           HB2      GLU  86 103.656  -1.244  10.141
  683    HB3  GLU  86           HB1      GLU  86 103.204  -2.919  10.452
  684    HG2  GLU  86           HG2      GLU  86 105.349  -3.287   8.803
  685    HG3  GLU  86           HG1      GLU  86 105.817  -1.791   9.609
  686    H    CYS  87           HN       CYS  87 104.315  -3.525   6.520
  687    HA   CYS  87           HA       CYS  87 102.639  -5.812   6.267
  688    HB2  CYS  87           HB2      CYS  87 104.221  -4.707   4.531
  689    HB3  CYS  87           HB1      CYS  87 105.470  -5.707   5.272
  690    HG   CYS  87           HG       CYS  87 103.386  -7.638   4.760
  691    H    GLN  88           HN       GLN  88 102.578  -7.580   7.458
  692    HA   GLN  88           HA       GLN  88 104.784  -8.178   9.302
  693    HB2  GLN  88           HB2      GLN  88 102.233  -9.762   9.162
  694    HB3  GLN  88           HB1      GLN  88 103.266  -9.433  10.552
  695    HG2  GLN  88           HG2      GLN  88 101.674  -7.293   9.122
  696    HG3  GLN  88           HG1      GLN  88 101.078  -8.163  10.530
  697   HE21  GLN  88          HE21      GLN  88 102.590  -5.317   9.699
  698   HE22  GLN  88          HE22      GLN  88 103.428  -5.018  11.146
  699    H    HIS  89           HN       HIS  89 103.104  -9.418   6.494
  700    HA   HIS  89           HA       HIS  89 105.289 -11.159   5.838
  701    HB2  HIS  89           HB2      HIS  89 104.555 -13.069   6.777
  702    HB3  HIS  89           HB1      HIS  89 103.136 -12.235   7.407
  703    HD2  HIS  89           HD2      HIS  89 100.880 -13.464   6.437
  704    HE1  HIS  89           HE1      HIS  89 102.364 -14.574   2.636
  705    HE2  HIS  89           HE2      HIS  89 100.334 -14.640   4.163
  706    H    ILE  90           HN       ILE  90 105.261 -11.723   3.689
  707    HA   ILE  90           HA       ILE  90 102.872 -11.224   2.047
  708    HB   ILE  90           HB       ILE  90 103.977  -9.047   2.036
  709   HG12  ILE  90          HG12      ILE  90 104.734 -10.500  -0.507
  710   HG13  ILE  90          HG11      ILE  90 103.066 -10.106  -0.098
  711   HG21  ILE  90          HG21      ILE  90 106.423 -10.721   1.462
  712   HG22  ILE  90          HG22      ILE  90 106.200  -9.501   2.714
  713   HG23  ILE  90          HG23      ILE  90 106.356  -9.015   1.027
  714   HD11  ILE  90          HD11      ILE  90 104.403  -8.420  -1.564
  715   HD12  ILE  90          HD12      ILE  90 105.195  -7.975  -0.052
  716   HD13  ILE  90          HD13      ILE  90 103.450  -7.793  -0.221
  717    H    ASP  91           HN       ASP  91 102.707 -12.398   0.293
  718    HA   ASP  91           HA       ASP  91 104.026 -14.845   0.210
  719    HB2  ASP  91           HB2      ASP  91 101.836 -13.848  -1.011
  720    HB3  ASP  91           HB1      ASP  91 102.955 -13.851  -2.369
  721    H    LEU  92           HN       LEU  92 105.635 -15.706  -0.910
  722    HA   LEU  92           HA       LEU  92 107.904 -14.202  -1.529
  723    HB2  LEU  92           HB2      LEU  92 107.595 -16.792  -1.208
  724    HB3  LEU  92           HB1      LEU  92 107.395 -16.795  -2.959
  725    HG   LEU  92           HG       LEU  92 109.592 -15.301  -2.889
  726   HD11  LEU  92          HD11      LEU  92 111.047 -15.745  -1.058
  727   HD12  LEU  92          HD12      LEU  92 110.012 -17.036  -0.447
  728   HD13  LEU  92          HD13      LEU  92 109.493 -15.356  -0.319
  729   HD21  LEU  92          HD21      LEU  92 110.922 -17.509  -2.902
  730   HD22  LEU  92          HD22      LEU  92 109.608 -17.368  -4.069
  731   HD23  LEU  92          HD23      LEU  92 109.379 -18.304  -2.592
  732    H    ASP  93           HN       ASP  93 105.337 -15.377  -3.664
  733    HA   ASP  93           HA       ASP  93 106.496 -14.381  -6.071
  734    HB2  ASP  93           HB2      ASP  93 104.390 -14.910  -7.103
  735    HB3  ASP  93           HB1      ASP  93 104.753 -16.190  -5.946
  736    H    SER  94           HN       SER  94 104.204 -13.103  -3.697
  737    HA   SER  94           HA       SER  94 103.428 -10.808  -5.153
  738    HB2  SER  94           HB2      SER  94 103.056  -9.900  -2.713
  739    HB3  SER  94           HB1      SER  94 102.044 -11.202  -3.328
  740    HG   SER  94           HG       SER  94 104.450 -11.905  -2.122
  741    H    ILE  95           HN       ILE  95 106.160 -11.518  -3.069
  742    HA   ILE  95           HA       ILE  95 107.143  -8.893  -2.756
  743    HB   ILE  95           HB       ILE  95 108.440 -11.615  -2.700
  744   HG12  ILE  95          HG12      ILE  95 108.134  -9.496  -0.555
  745   HG13  ILE  95          HG11      ILE  95 106.951 -10.772  -0.827
  746   HG21  ILE  95          HG21      ILE  95 109.721  -8.892  -2.634
  747   HG22  ILE  95          HG22      ILE  95 110.275 -10.363  -3.435
  748   HG23  ILE  95          HG23      ILE  95 110.415 -10.207  -1.685
  749   HD11  ILE  95          HD11      ILE  95 108.200 -11.965   0.649
  750   HD12  ILE  95          HD12      ILE  95 109.600 -10.913   0.452
  751   HD13  ILE  95          HD13      ILE  95 109.300 -12.207  -0.708
  752    H    SER  96           HN       SER  96 107.626 -11.337  -5.277
  753    HA   SER  96           HA       SER  96 109.613  -9.820  -6.622
  754    HB2  SER  96           HB2      SER  96 108.634 -12.414  -6.845
  755    HB3  SER  96           HB1      SER  96 108.105 -11.655  -8.347
  756    HG   SER  96           HG       SER  96 110.740 -11.815  -7.290
  757    H    HIS  97           HN       HIS  97 106.100 -10.102  -7.144
  758    HA   HIS  97           HA       HIS  97 106.140  -8.547  -9.504
  759    HB2  HIS  97           HB2      HIS  97 103.998  -9.152  -7.465
  760    HB3  HIS  97           HB1      HIS  97 103.701  -8.020  -8.774
  761    HD2  HIS  97           HD2      HIS  97 103.327 -11.708  -8.217
  762    HE1  HIS  97           HE1      HIS  97 103.864 -11.290 -12.380
  763    HE2  HIS  97           HE2      HIS  97 103.160 -12.889 -10.538
  764    H    LEU  98           HN       LEU  98 105.914  -7.686  -6.095
  765    HA   LEU  98           HA       LEU  98 105.600  -4.855  -6.544
  766    HB2  LEU  98           HB2      LEU  98 105.248  -6.327  -4.345
  767    HB3  LEU  98           HB1      LEU  98 106.952  -5.950  -4.101
  768    HG   LEU  98           HG       LEU  98 106.157  -3.480  -4.671
  769   HD11  LEU  98          HD11      LEU  98 103.846  -4.058  -5.211
  770   HD12  LEU  98          HD12      LEU  98 103.874  -3.083  -3.743
  771   HD13  LEU  98          HD13      LEU  98 103.641  -4.828  -3.638
  772   HD21  LEU  98          HD21      LEU  98 105.878  -3.081  -2.272
  773   HD22  LEU  98          HD22      LEU  98 107.148  -4.277  -2.528
  774   HD23  LEU  98          HD23      LEU  98 105.546  -4.793  -2.003
  775    H    ARG  99           HN       ARG  99 108.393  -6.991  -6.372
  776    HA   ARG  99           HA       ARG  99 110.349  -4.981  -6.130
  777    HB2  ARG  99           HB2      ARG  99 110.300  -7.758  -7.214
  778    HB3  ARG  99           HB1      ARG  99 111.658  -6.737  -7.677
  779    HG2  ARG  99           HG2      ARG  99 112.333  -6.417  -5.429
  780    HG3  ARG  99           HG1      ARG  99 110.789  -6.987  -4.796
  781    HD2  ARG  99           HD2      ARG  99 111.305  -9.222  -5.167
  782    HD3  ARG  99           HD1      ARG  99 112.438  -8.854  -6.465
  783    HE   ARG  99           HE       ARG  99 113.048  -9.012  -3.659
  784   HH11  ARG  99          HH21      ARG  99 113.833  -7.517  -6.678
  785   HH12  ARG  99          HH22      ARG  99 115.473  -7.171  -6.238
  786   HH21  ARG  99          HH11      ARG  99 115.195  -8.559  -3.072
  787   HH22  ARG  99          HH12      ARG  99 116.244  -7.761  -4.196
  788    H    ARG 100           HN       ARG 100 108.503  -6.153  -8.890
  789    HA   ARG 100           HA       ARG 100 109.870  -4.909 -11.019
  790    HB2  ARG 100           HB2      ARG 100 106.974  -5.619 -10.610
  791    HB3  ARG 100           HB1      ARG 100 107.571  -4.904 -12.101
  792    HG2  ARG 100           HG2      ARG 100 109.037  -7.273 -11.002
  793    HG3  ARG 100           HG1      ARG 100 107.482  -7.552 -11.786
  794    HD2  ARG 100           HD2      ARG 100 108.234  -6.786 -13.855
  795    HD3  ARG 100           HD1      ARG 100 109.517  -5.810 -13.145
  796    HE   ARG 100           HE       ARG 100 110.199  -8.399 -12.526
  797   HH11  ARG 100          HH21      ARG 100 109.430  -6.627 -15.398
  798   HH12  ARG 100          HH22      ARG 100 110.459  -7.574 -16.422
  799   HH21  ARG 100          HH11      ARG 100 111.549  -9.642 -13.864
  800   HH22  ARG 100          HH12      ARG 100 111.658  -9.281 -15.554
  801    H    LEU 101           HN       LEU 101 107.189  -3.764  -9.010
  802    HA   LEU 101           HA       LEU 101 106.992  -1.197 -10.259
  803    HB2  LEU 101           HB2      LEU 101 106.028  -2.203  -7.574
  804    HB3  LEU 101           HB1      LEU 101 105.729  -0.565  -8.139
  805    HG   LEU 101           HG       LEU 101 103.774  -1.647  -8.802
  806   HD11  LEU 101          HD11      LEU 101 104.991  -0.627 -10.791
  807   HD12  LEU 101          HD12      LEU 101 103.775  -1.839 -11.180
  808   HD13  LEU 101          HD13      LEU 101 105.480  -2.269 -11.220
  809   HD21  LEU 101          HD21      LEU 101 105.523  -4.043  -9.364
  810   HD22  LEU 101          HD22      LEU 101 103.834  -3.963  -9.856
  811   HD23  LEU 101          HD23      LEU 101 104.259  -3.886  -8.146
  812    H    VAL 102           HN       VAL 102 108.860  -2.429  -7.560
  813    HA   VAL 102           HA       VAL 102 109.744   0.106  -6.604
  814    HB   VAL 102           HB       VAL 102 110.914  -2.670  -6.332
  815   HG11  VAL 102          HG11      VAL 102 112.106  -1.526  -4.346
  816   HG12  VAL 102          HG12      VAL 102 111.733  -0.007  -5.163
  817   HG13  VAL 102          HG13      VAL 102 112.746  -1.212  -5.960
  818   HG21  VAL 102          HG21      VAL 102 109.815  -2.737  -4.235
  819   HG22  VAL 102          HG22      VAL 102 108.618  -2.022  -5.315
  820   HG23  VAL 102          HG23      VAL 102 109.546  -0.994  -4.223
  821    H    GLU 103           HN       GLU 103 111.189  -2.312  -8.767
  822    HA   GLU 103           HA       GLU 103 113.591  -0.908  -9.270
  823    HB2  GLU 103           HB2      GLU 103 113.424  -3.278  -9.727
  824    HB3  GLU 103           HB1      GLU 103 112.139  -3.001 -10.902
  825    HG2  GLU 103           HG2      GLU 103 114.790  -1.623 -11.241
  826    HG3  GLU 103           HG1      GLU 103 114.609  -3.301 -11.743
  827    H    LEU 104           HN       LEU 104 110.486  -0.994 -11.012
  828    HA   LEU 104           HA       LEU 104 111.332   0.599 -13.196
  829    HB2  LEU 104           HB2      LEU 104 108.585   0.128 -12.020
  830    HB3  LEU 104           HB1      LEU 104 108.875   0.985 -13.533
  831    HG   LEU 104           HG       LEU 104 110.031  -1.766 -13.092
  832   HD11  LEU 104          HD11      LEU 104 107.607  -1.927 -12.631
  833   HD12  LEU 104          HD12      LEU 104 108.027  -2.726 -14.146
  834   HD13  LEU 104          HD13      LEU 104 107.266  -1.135 -14.170
  835   HD21  LEU 104          HD21      LEU 104 110.882  -0.670 -15.039
  836   HD22  LEU 104          HD22      LEU 104 109.288  -0.059 -15.483
  837   HD23  LEU 104          HD23      LEU 104 109.646  -1.779 -15.628
  838    H    ASN 105           HN       ASN 105 109.805   1.394 -10.101
  839    HA   ASN 105           HA       ASN 105 109.651   4.210 -10.674
  840    HB2  ASN 105           HB2      ASN 105 109.307   2.570  -8.166
  841    HB3  ASN 105           HB1      ASN 105 109.249   4.331  -8.142
  842   HD21  ASN 105          HD21      ASN 105 107.511   1.434  -9.124
  843   HD22  ASN 105          HD22      ASN 105 106.104   2.233  -9.638
  844    H    LEU 106           HN       LEU 106 111.716   2.208  -8.575
  845    HA   LEU 106           HA       LEU 106 113.402   4.251  -7.668
  846    HB2  LEU 106           HB2      LEU 106 113.400   2.002  -6.686
  847    HB3  LEU 106           HB1      LEU 106 114.040   1.333  -8.186
  848    HG   LEU 106           HG       LEU 106 116.090   2.651  -7.937
  849   HD11  LEU 106          HD11      LEU 106 115.500   4.648  -6.868
  850   HD12  LEU 106          HD12      LEU 106 116.318   3.778  -5.573
  851   HD13  LEU 106          HD13      LEU 106 114.557   3.823  -5.628
  852   HD21  LEU 106          HD21      LEU 106 116.872   1.631  -5.727
  853   HD22  LEU 106          HD22      LEU 106 116.187   0.500  -6.894
  854   HD23  LEU 106          HD23      LEU 106 115.221   1.044  -5.524
  855    H    GLY 107           HN       GLY 107 113.055   2.819 -10.743
  856    HA2  GLY 107           HA2      GLY 107 115.710   3.598 -11.686
  857    HA3  GLY 107           HA1      GLY 107 114.482   2.726 -12.603
  858    H    ASP 108           HN       ASP 108 116.099   5.277 -13.068
  859    HA   ASP 108           HA       ASP 108 113.947   7.244 -13.334
  860    HB2  ASP 108           HB2      ASP 108 116.926   7.411 -13.847
  861    HB3  ASP 108           HB1      ASP 108 115.801   8.745 -14.101
  862    H    GLU 109           HN       GLU 109 113.364   8.169 -15.335
  863    HA   GLU 109           HA       GLU 109 113.648   6.343 -17.599
  864    HB2  GLU 109           HB2      GLU 109 111.475   7.598 -16.732
  865    HB3  GLU 109           HB1      GLU 109 112.087   8.894 -17.759
  866    HG2  GLU 109           HG2      GLU 109 112.221   7.285 -19.656
  867    HG3  GLU 109           HG1      GLU 109 111.522   6.041 -18.620
  868    H    GLU 110           HN       GLU 110 113.089   8.762 -19.371
  869    HA   GLU 110           HA       GLU 110 115.753   9.153 -20.272
  870    HB2  GLU 110           HB2      GLU 110 113.468   9.364 -21.544
  871    HB3  GLU 110           HB1      GLU 110 113.521  11.034 -20.982
  872    HG2  GLU 110           HG2      GLU 110 115.704   9.645 -22.564
  873    HG3  GLU 110           HG1      GLU 110 114.554  10.811 -23.215
  874    H    LEU 111           HN       LEU 111 113.588  10.998 -18.205
  875    HA   LEU 111           HA       LEU 111 114.791  13.471 -18.117
  876    HB2  LEU 111           HB2      LEU 111 112.813  12.238 -16.691
  877    HB3  LEU 111           HB1      LEU 111 114.066  12.379 -15.461
  878    HG   LEU 111           HG       LEU 111 113.047  14.668 -17.177
  879   HD11  LEU 111          HD11      LEU 111 112.180  15.446 -14.891
  880   HD12  LEU 111          HD12      LEU 111 112.445  13.789 -14.348
  881   HD13  LEU 111          HD13      LEU 111 111.305  14.119 -15.653
  882   HD21  LEU 111          HD21      LEU 111 115.274  15.186 -16.570
  883   HD22  LEU 111          HD22      LEU 111 115.113  14.427 -14.987
  884   HD23  LEU 111          HD23      LEU 111 114.310  15.962 -15.316
  885    H    LEU 112           HN       LEU 112 116.626  14.325 -17.292
  886    HA   LEU 112           HA       LEU 112 118.959  13.001 -16.980
  887    HB2  LEU 112           HB2      LEU 112 117.905  15.548 -15.874
  888    HB3  LEU 112           HB1      LEU 112 119.370  14.925 -15.117
  889    HG   LEU 112           HG       LEU 112 119.192  15.021 -18.120
  890   HD11  LEU 112          HD11      LEU 112 119.799  17.339 -16.265
  891   HD12  LEU 112          HD12      LEU 112 118.562  17.269 -17.521
  892   HD13  LEU 112          HD13      LEU 112 120.268  17.305 -17.965
  893   HD21  LEU 112          HD21      LEU 112 121.644  15.364 -17.849
  894   HD22  LEU 112          HD22      LEU 112 121.096  13.882 -17.065
  895   HD23  LEU 112          HD23      LEU 112 121.439  15.317 -16.098
  896    H    GLU 113           HN       GLU 113 119.856  11.601 -15.613
  897    HA   GLU 113           HA       GLU 113 118.349  10.610 -13.367
  898    HB2  GLU 113           HB2      GLU 113 121.221   9.907 -13.917
  899    HB3  GLU 113           HB1      GLU 113 119.936   8.894 -13.257
  900    HG2  GLU 113           HG2      GLU 113 118.783   8.980 -15.467
  901    HG3  GLU 113           HG1      GLU 113 120.145   9.897 -16.111
  902    H    ARG 114           HN       ARG 114 118.621  11.062 -11.240
  903    HA   ARG 114           HA       ARG 114 121.024  12.486 -10.362
  904    HB2  ARG 114           HB2      ARG 114 118.942  14.026 -11.056
  905    HB3  ARG 114           HB1      ARG 114 118.444  13.638  -9.411
  906    HG2  ARG 114           HG2      ARG 114 120.926  14.264  -8.805
  907    HG3  ARG 114           HG1      ARG 114 120.890  15.115 -10.349
  908    HD2  ARG 114           HD2      ARG 114 118.918  15.512  -8.082
  909    HD3  ARG 114           HD1      ARG 114 120.242  16.602  -8.484
  910    HE   ARG 114           HE       ARG 114 118.381  16.063 -10.657
  911   HH11  ARG 114          HH21      ARG 114 119.288  18.056  -7.977
  912   HH12  ARG 114          HH22      ARG 114 118.418  19.445  -8.538
  913   HH21  ARG 114          HH11      ARG 114 117.239  17.877 -11.398
  914   HH22  ARG 114          HH12      ARG 114 117.255  19.343 -10.475
  915    H    GLU 115           HN       GLU 115 117.829  12.039  -8.852
  916    HA   GLU 115           HA       GLU 115 117.188  10.886  -6.964
  917    HB2  GLU 115           HB2      GLU 115 118.266   8.999  -8.337
  918    HB3  GLU 115           HB1      GLU 115 119.673   9.207  -7.297
  919    HG2  GLU 115           HG2      GLU 115 118.184   8.870  -5.309
  920    HG3  GLU 115           HG1      GLU 115 116.860   8.512  -6.416
  921    H    LEU 116           HN       LEU 116 120.093  12.526  -7.257
  922    HA   LEU 116           HA       LEU 116 121.261  12.113  -4.714
  923    HB2  LEU 116           HB2      LEU 116 122.506  13.045  -6.608
  924    HB3  LEU 116           HB1      LEU 116 121.488  14.483  -6.577
  925    HG   LEU 116           HG       LEU 116 122.261  14.992  -4.291
  926   HD11  LEU 116          HD11      LEU 116 123.640  12.349  -4.651
  927   HD12  LEU 116          HD12      LEU 116 122.785  12.979  -3.242
  928   HD13  LEU 116          HD13      LEU 116 124.394  13.579  -3.635
  929   HD21  LEU 116          HD21      LEU 116 123.510  15.893  -6.223
  930   HD22  LEU 116          HD22      LEU 116 124.528  14.453  -6.236
  931   HD23  LEU 116          HD23      LEU 116 124.592  15.567  -4.870
  932    H    ALA 117           HN       ALA 117 118.814  14.419  -5.843
  933    HA   ALA 117           HA       ALA 117 119.011  16.093  -3.640
  934    HB1  ALA 117           HB1      ALA 117 117.826  16.866  -5.611
  935    HB2  ALA 117           HB2      ALA 117 116.701  16.913  -4.254
  936    HB3  ALA 117           HB3      ALA 117 116.610  15.602  -5.430
  937    H    LEU 118           HN       LEU 118 117.664  13.032  -3.983
  938    HA   LEU 118           HA       LEU 118 115.678  12.956  -1.947
  939    HB2  LEU 118           HB2      LEU 118 117.512  10.688  -2.766
  940    HB3  LEU 118           HB1      LEU 118 115.927  10.549  -2.005
  941    HG   LEU 118           HG       LEU 118 116.577  11.470  -4.811
  942   HD11  LEU 118          HD11      LEU 118 116.158   9.024  -4.197
  943   HD12  LEU 118          HD12      LEU 118 115.136   9.689  -5.471
  944   HD13  LEU 118          HD13      LEU 118 114.501   9.504  -3.838
  945   HD21  LEU 118          HD21      LEU 118 115.006  13.118  -4.096
  946   HD22  LEU 118          HD22      LEU 118 114.067  11.933  -3.185
  947   HD23  LEU 118          HD23      LEU 118 114.051  11.903  -4.946
  948    H    LEU 119           HN       LEU 119 119.111  12.757  -1.934
  949    HA   LEU 119           HA       LEU 119 119.552  11.824   0.704
  950    HB2  LEU 119           HB2      LEU 119 121.183  13.231  -1.290
  951    HB3  LEU 119           HB1      LEU 119 121.597  13.682   0.358
  952    HG   LEU 119           HG       LEU 119 122.844  11.674  -0.628
  953   HD11  LEU 119          HD11      LEU 119 122.854  12.149   1.761
  954   HD12  LEU 119          HD12      LEU 119 122.711  10.410   1.509
  955   HD13  LEU 119          HD13      LEU 119 121.292  11.355   1.956
  956   HD21  LEU 119          HD21      LEU 119 121.765   9.722  -1.130
  957   HD22  LEU 119          HD22      LEU 119 120.387  10.789  -1.384
  958   HD23  LEU 119          HD23      LEU 119 120.567   9.927   0.145
  959    H    VAL 120           HN       VAL 120 119.030  15.103  -0.536
  960    HA   VAL 120           HA       VAL 120 119.157  16.556   1.893
  961    HB   VAL 120           HB       VAL 120 117.238  17.052  -0.388
  962   HG11  VAL 120          HG11      VAL 120 116.864  18.515   1.480
  963   HG12  VAL 120          HG12      VAL 120 117.760  19.440   0.277
  964   HG13  VAL 120          HG13      VAL 120 118.594  18.790   1.686
  965   HG21  VAL 120          HG21      VAL 120 120.168  17.810  -0.149
  966   HG22  VAL 120          HG22      VAL 120 119.071  18.366  -1.414
  967   HG23  VAL 120          HG23      VAL 120 119.493  16.659  -1.302
  968    H    SER 121           HN       SER 121 117.047  14.065   0.996
  969    HA   SER 121           HA       SER 121 114.824  14.986   2.641
  970    HB2  SER 121           HB2      SER 121 114.802  13.483   0.433
  971    HB3  SER 121           HB1      SER 121 115.011  12.186   1.606
  972    HG   SER 121           HG       SER 121 113.034  12.490   2.263
  973    H    ALA 122           HN       ALA 122 117.604  14.441   3.610
  974    HA   ALA 122           HA       ALA 122 117.220  13.578   6.160
  975    HB1  ALA 122           HB1      ALA 122 116.450  11.429   5.749
  976    HB2  ALA 122           HB2      ALA 122 118.182  11.112   5.826
  977    HB3  ALA 122           HB3      ALA 122 117.384  11.267   4.263
  978    H    HIS 123           HN       HIS 123 119.464  11.949   6.682
  979    HA   HIS 123           HA       HIS 123 121.777  11.995   6.779
  980    HB2  HIS 123           HB2      HIS 123 122.857  12.412   4.844
  981    HB3  HIS 123           HB1      HIS 123 121.295  12.827   4.148
  982    HD2  HIS 123           HD2      HIS 123 121.223  15.447   3.252
  983    HE1  HIS 123           HE1      HIS 123 124.373  16.976   5.605
  984    HE2  HIS 123           HE2      HIS 123 122.684  17.539   3.795
  985    H    ASP 124           HN       ASP 124 120.374  15.181   6.061
  986    HA   ASP 124           HA       ASP 124 121.436  17.223   6.948
  987    HB2  ASP 124           HB2      ASP 124 119.434  16.184   8.949
  988    HB3  ASP 124           HB1      ASP 124 119.778  17.862   8.540
  989    H    ASP 125           HN       ASP 125 123.639  16.677   7.577
  990    HA   ASP 125           HA       ASP 125 123.929  16.610  10.493
  991    HB2  ASP 125           HB2      ASP 125 125.567  14.838  10.455
  992    HB3  ASP 125           HB1      ASP 125 124.101  14.243   9.680
  993   H5'1  C2E 501          H5'1      C2E 501 105.509   3.305  10.482
  994   H5'2  C2E 501          H5'2      C2E 501 104.735   1.909  11.253
  995    H4'  C2E 501           H4'      C2E 501 107.033   0.730  10.503
  996    H3'  C2E 501           H3'      C2E 501 106.811   3.120   8.689
  997    H2'  C2E 501           H2'      C2E 501 106.976   1.840   6.726
  998   HO2'  C2E 501          HO2'      C2E 501 108.498   0.340   6.939
  999    H1'  C2E 501           H1'      C2E 501 105.297  -0.148   7.365
 1000    H8   C2E 501           H8       C2E 501 103.609   2.446   9.337
 1001    HN1  C2E 501           HN1      C2E 501 103.251   3.806   3.096
 1002   HN21  C2E 501          HN21      C2E 501 104.657   2.522   1.954
 1003   HN22  C2E 501          HN22      C2E 501 105.670   1.326   2.728
 1004   H511  C2E 501          H511      C2E 501 109.889   3.522  11.551
 1005   H512  C2E 501          H512      C2E 501 108.160   3.295  11.225
 1006    H4A  C2E 501           H4A      C2E 501 109.201   5.073  13.042
 1007    H3A  C2E 501           H3A      C2E 501 106.538   5.105  11.579
 1008    H2A  C2E 501           H2A      C2E 501 106.050   7.169  12.525
 1009   HO2A  C2E 501          HO2A      C2E 501 107.295   6.273  14.601
 1010    H1A  C2E 501           H1A      C2E 501 108.552   8.292  12.254
 1011    H81  C2E 501           H81      C2E 501 108.391   6.463   9.075
 1012   HN11  C2E 501          HN11      C2E 501 104.274  11.361   9.049
 1013   HN24  C2E 501          HN24      C2E 501 104.785  11.425  12.502
 1014   HN23  C2E 501          HN23      C2E 501 103.964  12.112  11.118
 1015   H5'1  C2E 502          H5'1      C2E 502 101.632  10.355   4.608
 1016   H5'2  C2E 502          H5'2      C2E 502  99.990  10.959   4.299
 1017    H4'  C2E 502           H4'      C2E 502  99.794  11.830   6.509
 1018    H3'  C2E 502           H3'      C2E 502 102.766  11.359   6.727
 1019    H2'  C2E 502           H2'      C2E 502 102.438  11.068   9.090
 1020   HO2'  C2E 502          HO2'      C2E 502 100.150  11.334   9.855
 1021    H1'  C2E 502           H1'      C2E 502 100.292   9.441   8.859
 1022    H8   C2E 502           H8       C2E 502 102.540   8.609   5.896
 1023    HN1  C2E 502           HN1      C2E 502 104.358   5.825  11.357
 1024   HN21  C2E 502          HN21      C2E 502 103.211   6.617  13.059
 1025   HN22  C2E 502          HN22      C2E 502 101.991   7.861  12.878
 1026   H511  C2E 502          H511      C2E 502 102.871  16.336   5.934
 1027   H512  C2E 502          H512      C2E 502 102.193  14.733   5.586
 1028    H4A  C2E 502           H4A      C2E 502 103.792  15.913   3.850
 1029    H3A  C2E 502           H3A      C2E 502 103.852  12.992   4.656
 1030    H2A  C2E 502           H2A      C2E 502 105.703  12.645   3.220
 1031   HO2A  C2E 502          HO2A      C2E 502 106.255  14.049   1.594
 1032    H1A  C2E 502           H1A      C2E 502 107.073  14.924   3.852
 1033    H81  C2E 502           H81      C2E 502 105.837  14.178   7.192
 1034   HN11  C2E 502          HN11      C2E 502 109.708   9.502   5.232
 1035   HN24  C2E 502          HN24      C2E 502 110.089   9.678   3.054
 1036   HN23  C2E 502          HN23      C2E 502 109.393  10.955   2.081
  Start of MODEL    8
    1    H    MET   1           H        MET   1 109.800  27.718  10.767
    2    HA   MET   1           HA       MET   1 107.965  26.457  10.541
    3    HB2  MET   1           HB2      MET   1 107.989  28.180   8.046
    4    HB3  MET   1           HB1      MET   1 106.558  27.334   8.633
    5    HG2  MET   1           HG2      MET   1 107.977  28.958  10.669
    6    HG3  MET   1           HG1      MET   1 107.220  29.879   9.370
    7    HE1  MET   1           HE1      MET   1 105.322  28.202  13.003
    8    HE2  MET   1           HE2      MET   1 106.794  29.122  12.704
    9    HE3  MET   1           HE3      MET   1 106.745  27.401  12.325
   10    H    SER   2           HN       SER   2 107.567  24.404  10.076
   11    HA   SER   2           HA       SER   2 107.146  22.543   8.707
   12    HB2  SER   2           HB2      SER   2 107.613  22.510   6.430
   13    HB3  SER   2           HB1      SER   2 107.410  24.235   6.714
   14    HG   SER   2           HG       SER   2 109.787  24.162   7.124
   15    H    ASP   3           HN       ASP   3 109.133  22.996  10.706
   16    HA   ASP   3           HA       ASP   3 111.372  21.333   9.747
   17    HB2  ASP   3           HB2      ASP   3 112.487  21.953  11.913
   18    HB3  ASP   3           HB1      ASP   3 112.147  23.342  10.883
   19    H    GLN   4           HN       GLN   4 108.599  20.543  10.372
   20    HA   GLN   4           HA       GLN   4 109.213  18.511  12.433
   21    HB2  GLN   4           HB2      GLN   4 106.967  20.285  12.258
   22    HB3  GLN   4           HB1      GLN   4 106.377  18.644  12.006
   23    HG2  GLN   4           HG2      GLN   4 108.161  19.487  14.306
   24    HG3  GLN   4           HG1      GLN   4 106.412  19.316  14.416
   25   HE21  GLN   4          HE21      GLN   4 106.693  16.932  12.416
   26   HE22  GLN   4          HE22      GLN   4 107.182  15.651  13.416
   27    H    HIS   5           HN       HIS   5 108.307  19.128   9.195
   28    HA   HIS   5           HA       HIS   5 107.169  16.604   8.535
   29    HB2  HIS   5           HB2      HIS   5 108.697  18.505   6.746
   30    HB3  HIS   5           HB1      HIS   5 107.590  17.237   6.227
   31    HD2  HIS   5           HD2      HIS   5 105.433  18.218   8.830
   32    HE1  HIS   5           HE1      HIS   5 104.960  21.511   6.231
   33    HE2  HIS   5           HE2      HIS   5 103.962  20.287   8.219
   34    H    ASP   6           HN       ASP   6 110.084  17.186   9.811
   35    HA   ASP   6           HA       ASP   6 112.114  16.126   8.388
   36    HB2  ASP   6           HB2      ASP   6 111.337  15.517  11.243
   37    HB3  ASP   6           HB1      ASP   6 112.855  14.968  10.529
   38    H    GLU   7           HN       GLU   7 112.883  14.085   7.798
   39    HA   GLU   7           HA       GLU   7 110.804  12.161   7.290
   40    HB2  GLU   7           HB2      GLU   7 112.263  11.133   5.802
   41    HB3  GLU   7           HB1      GLU   7 112.769  12.818   5.732
   42    HG2  GLU   7           HG2      GLU   7 114.407  12.142   7.659
   43    HG3  GLU   7           HG1      GLU   7 114.111  10.496   7.102
   44    H    ARG   8           HN       ARG   8 110.428  10.280   8.250
   45    HA   ARG   8           HA       ARG   8 112.212   9.471  10.474
   46    HB2  ARG   8           HB2      ARG   8 109.216   9.594  10.306
   47    HB3  ARG   8           HB1      ARG   8 110.011   8.454  11.383
   48    HG2  ARG   8           HG2      ARG   8 109.717  10.312  12.772
   49    HG3  ARG   8           HG1      ARG   8 111.371  10.525  12.207
   50    HD2  ARG   8           HD2      ARG   8 109.986  12.614  12.101
   51    HD3  ARG   8           HD1      ARG   8 110.665  12.138  10.552
   52    HE   ARG   8           HE       ARG   8 108.251  10.986  10.417
   53   HH11  ARG   8          HH21      ARG   8 109.245  14.116  11.511
   54   HH12  ARG   8          HH22      ARG   8 107.775  14.901  11.040
   55   HH21  ARG   8          HH11      ARG   8 106.321  12.011   9.789
   56   HH22  ARG   8          HH12      ARG   8 106.119  13.709  10.066
   57    H    ARG   9           HN       ARG   9 110.722   8.601   7.534
   58    HA   ARG   9           HA       ARG   9 111.153   5.721   8.054
   59    HB2  ARG   9           HB2      ARG   9 109.765   5.589   5.801
   60    HB3  ARG   9           HB1      ARG   9 108.955   5.768   7.351
   61    HG2  ARG   9           HG2      ARG   9 108.940   8.241   7.010
   62    HG3  ARG   9           HG1      ARG   9 109.615   7.980   5.402
   63    HD2  ARG   9           HD2      ARG   9 107.667   6.924   4.625
   64    HD3  ARG   9           HD1      ARG   9 107.101   6.567   6.251
   65    HE   ARG   9           HE       ARG   9 106.477   8.883   6.495
   66   HH11  ARG   9          HH21      ARG   9 107.557   7.950   3.328
   67   HH12  ARG   9          HH22      ARG   9 106.825   9.304   2.536
   68   HH21  ARG   9          HH11      ARG   9 105.521  10.651   5.451
   69   HH22  ARG   9          HH12      ARG   9 105.676  10.830   3.735
   70    H    ARG  10           HN       ARG  10 113.421   6.416   7.773
   71    HA   ARG  10           HA       ARG  10 115.338   6.767   6.528
   72    HB2  ARG  10           HB2      ARG  10 114.491   4.746   4.537
   73    HB3  ARG  10           HB1      ARG  10 115.918   4.801   5.560
   74    HG2  ARG  10           HG2      ARG  10 114.809   3.049   6.571
   75    HG3  ARG  10           HG1      ARG  10 114.133   4.387   7.495
   76    HD2  ARG  10           HD2      ARG  10 112.487   4.198   5.222
   77    HD3  ARG  10           HD1      ARG  10 112.792   2.531   5.693
   78    HE   ARG  10           HE       ARG  10 110.995   4.194   6.969
   79   HH11  ARG  10          HH21      ARG  10 113.805   2.348   7.808
   80   HH12  ARG  10          HH22      ARG  10 113.309   2.091   9.447
   81   HH21  ARG  10          HH11      ARG  10 110.348   3.857   9.111
   82   HH22  ARG  10          HH12      ARG  10 111.358   2.951  10.185
   83    H    PHE  11           HN       PHE  11 113.067   5.975   3.867
   84    HA   PHE  11           HA       PHE  11 113.475   8.642   2.735
   85    HB2  PHE  11           HB2      PHE  11 114.662   6.139   1.663
   86    HB3  PHE  11           HB1      PHE  11 113.893   7.197   0.480
   87    HD1  PHE  11           HD1      PHE  11 116.443   7.103   3.201
   88    HD2  PHE  11           HD2      PHE  11 114.916   9.222  -0.206
   89    HE1  PHE  11           HE1      PHE  11 118.413   8.608   3.256
   90    HE2  PHE  11           HE2      PHE  11 116.887  10.729  -0.153
   91    HZ   PHE  11           HZ       PHE  11 118.635  10.420   1.579
   92    H    HIS  12           HN       HIS  12 112.169   8.851   0.651
   93    HA   HIS  12           HA       HIS  12 109.474   8.217   1.182
   94    HB2  HIS  12           HB2      HIS  12 108.966   9.295  -0.852
   95    HB3  HIS  12           HB1      HIS  12 110.439  10.094  -0.299
   96    HD2  HIS  12           HD2      HIS  12 112.742   8.128  -1.417
   97    HE1  HIS  12           HE1      HIS  12 110.766   8.317  -5.143
   98    HE2  HIS  12           HE2      HIS  12 112.947   7.721  -3.986
   99    H    ARG  13           HN       ARG  13 108.119   6.638   0.410
  100    HA   ARG  13           HA       ARG  13 109.416   4.232  -0.609
  101    HB2  ARG  13           HB2      ARG  13 106.473   4.526  -0.038
  102    HB3  ARG  13           HB1      ARG  13 107.469   3.073   0.022
  103    HG2  ARG  13           HG2      ARG  13 107.882   3.426   2.215
  104    HG3  ARG  13           HG1      ARG  13 108.589   4.996   1.846
  105    HD2  ARG  13           HD2      ARG  13 105.632   4.454   2.225
  106    HD3  ARG  13           HD1      ARG  13 106.692   5.206   3.413
  107    HE   ARG  13           HE       ARG  13 106.931   6.699   1.071
  108   HH11  ARG  13          HH21      ARG  13 104.492   5.778   3.344
  109   HH12  ARG  13          HH22      ARG  13 103.556   7.220   3.135
  110   HH21  ARG  13          HH11      ARG  13 105.711   8.595   0.791
  111   HH22  ARG  13          HH12      ARG  13 104.246   8.816   1.689
  112    H    ILE  14           HN       ILE  14 107.641   2.985  -2.121
  113    HA   ILE  14           HA       ILE  14 107.713   4.470  -4.603
  114    HB   ILE  14           HB       ILE  14 106.735   1.698  -3.919
  115   HG12  ILE  14          HG12      ILE  14 108.774   1.046  -5.226
  116   HG13  ILE  14          HG11      ILE  14 109.211   2.751  -5.323
  117   HG21  ILE  14          HG21      ILE  14 106.855   1.451  -6.479
  118   HG22  ILE  14          HG22      ILE  14 106.837   3.214  -6.527
  119   HG23  ILE  14          HG23      ILE  14 105.476   2.337  -5.827
  120   HD11  ILE  14          HD11      ILE  14 110.180   1.208  -3.391
  121   HD12  ILE  14          HD12      ILE  14 108.640   1.586  -2.621
  122   HD13  ILE  14          HD13      ILE  14 109.744   2.886  -3.072
  123    H    ALA  15           HN       ALA  15 106.212   6.112  -4.549
  124    HA   ALA  15           HA       ALA  15 103.466   5.484  -3.756
  125    HB1  ALA  15           HB1      ALA  15 104.825   8.069  -4.521
  126    HB2  ALA  15           HB2      ALA  15 104.311   7.566  -2.910
  127    HB3  ALA  15           HB3      ALA  15 103.106   7.936  -4.147
  128    H    PHE  16           HN       PHE  16 102.039   4.830  -5.141
  129    HA   PHE  16           HA       PHE  16 101.857   6.003  -7.789
  130    HB2  PHE  16           HB2      PHE  16 101.878   3.936  -9.004
  131    HB3  PHE  16           HB1      PHE  16 103.352   3.983  -8.044
  132    HD1  PHE  16           HD2      PHE  16 102.856   3.070  -5.472
  133    HD2  PHE  16           HD1      PHE  16 100.848   1.858  -9.071
  134    HE1  PHE  16           HE2      PHE  16 102.239   0.924  -4.407
  135    HE2  PHE  16           HE1      PHE  16 100.240  -0.296  -8.005
  136    HZ   PHE  16           HZ       PHE  16 100.944  -0.763  -5.673
  137    H    ASP  17           HN       ASP  17  99.715   5.561  -8.753
  138    HA   ASP  17           HA       ASP  17  97.747   5.169  -6.620
  139    HB2  ASP  17           HB2      ASP  17  97.742   7.159  -8.241
  140    HB3  ASP  17           HB1      ASP  17  97.168   6.016  -9.455
  141    H    ALA  18           HN       ALA  18  96.056   3.684  -6.761
  142    HA   ALA  18           HA       ALA  18  95.454   2.034  -8.925
  143    HB1  ALA  18           HB1      ALA  18  97.552   0.951  -8.827
  144    HB2  ALA  18           HB2      ALA  18  96.472  -0.127  -7.940
  145    HB3  ALA  18           HB3      ALA  18  97.563   0.947  -7.063
  146    H    ASP  19           HN       ASP  19  94.360  -0.078  -8.090
  147    HA   ASP  19           HA       ASP  19  92.570   0.782  -5.917
  148    HB2  ASP  19           HB2      ASP  19  92.075  -1.697  -7.510
  149    HB3  ASP  19           HB1      ASP  19  90.933  -0.503  -6.896
  150    H    SER  20           HN       SER  20  92.440  -0.224  -4.000
  151    HA   SER  20           HA       SER  20  93.802  -2.820  -3.646
  152    HB2  SER  20           HB2      SER  20  94.590  -1.910  -1.404
  153    HB3  SER  20           HB1      SER  20  95.421  -1.301  -2.832
  154    HG   SER  20           HG       SER  20  93.759  -0.017  -1.041
  155    H    GLU  21           HN       GLU  21  93.052  -3.958  -1.699
  156    HA   GLU  21           HA       GLU  21  90.644  -2.925  -0.408
  157    HB2  GLU  21           HB2      GLU  21  89.161  -4.588  -1.084
  158    HB3  GLU  21           HB1      GLU  21  90.049  -4.270  -2.572
  159    HG2  GLU  21           HG2      GLU  21  90.182  -6.573  -2.516
  160    HG3  GLU  21           HG1      GLU  21  91.645  -6.165  -1.624
  161    H    ILE  22           HN       ILE  22  90.302  -3.841   1.631
  162    HA   ILE  22           HA       ILE  22  92.482  -5.651   2.514
  163    HB   ILE  22           HB       ILE  22  91.193  -3.294   3.870
  164   HG12  ILE  22          HG12      ILE  22  94.091  -4.047   3.382
  165   HG13  ILE  22          HG11      ILE  22  93.153  -2.994   2.324
  166   HG21  ILE  22          HG21      ILE  22  92.750  -3.992   5.805
  167   HG22  ILE  22          HG22      ILE  22  92.752  -5.588   5.056
  168   HG23  ILE  22          HG23      ILE  22  91.240  -4.881   5.619
  169   HD11  ILE  22          HD11      ILE  22  92.745  -1.475   4.254
  170   HD12  ILE  22          HD12      ILE  22  94.459  -1.636   3.869
  171   HD13  ILE  22          HD13      ILE  22  93.780  -2.502   5.246
  172    H    LEU  23           HN       LEU  23  92.017  -7.404   3.657
  173    HA   LEU  23           HA       LEU  23  89.183  -7.897   4.388
  174    HB2  LEU  23           HB2      LEU  23  91.014 -10.200   3.961
  175    HB3  LEU  23           HB1      LEU  23  89.310 -10.015   3.546
  176    HG   LEU  23           HG       LEU  23  90.207  -8.242   1.836
  177   HD11  LEU  23          HD11      LEU  23  92.620  -8.918   2.951
  178   HD12  LEU  23          HD12      LEU  23  92.430  -8.229   1.342
  179   HD13  LEU  23          HD13      LEU  23  92.588  -9.974   1.542
  180   HD21  LEU  23          HD21      LEU  23  90.330 -11.253   1.595
  181   HD22  LEU  23          HD22      LEU  23  90.660 -10.215   0.208
  182   HD23  LEU  23          HD23      LEU  23  89.086 -10.155   0.999
  183    H    GLN  24           HN       GLN  24  88.831  -8.082   6.435
  184    HA   GLN  24           HA       GLN  24  90.986  -9.104   8.216
  185    HB2  GLN  24           HB2      GLN  24  90.820  -6.704   8.564
  186    HB3  GLN  24           HB1      GLN  24  89.071  -6.820   8.756
  187    HG2  GLN  24           HG2      GLN  24  89.563  -8.449  10.690
  188    HG3  GLN  24           HG1      GLN  24  91.219  -7.872  10.594
  189   HE21  GLN  24          HE21      GLN  24  90.227  -7.256  12.966
  190   HE22  GLN  24          HE22      GLN  24  89.665  -5.657  13.060
  191    H    GLY  25           HN       GLY  25  90.136 -11.179   8.546
  192    HA2  GLY  25           HA2      GLY  25  88.801 -12.678   9.695
  193    HA3  GLY  25           HA1      GLY  25  87.764 -11.340  10.188
  194    H    GLU  26           HN       GLU  26  85.758 -11.674   9.470
  195    HA   GLU  26           HA       GLU  26  85.342 -12.969   6.856
  196    HB2  GLU  26           HB2      GLU  26  83.031 -13.274   7.623
  197    HB3  GLU  26           HB1      GLU  26  84.172 -13.933   8.793
  198    HG2  GLU  26           HG2      GLU  26  83.024 -12.706  10.321
  199    HG3  GLU  26           HG1      GLU  26  83.927 -11.339   9.676
  200    H    ARG  27           HN       ARG  27  85.941  -9.985   7.796
  201    HA   ARG  27           HA       ARG  27  83.766  -8.707   6.254
  202    HB2  ARG  27           HB2      ARG  27  85.658  -7.517   8.266
  203    HB3  ARG  27           HB1      ARG  27  84.353  -6.678   7.429
  204    HG2  ARG  27           HG2      ARG  27  82.700  -7.711   8.654
  205    HG3  ARG  27           HG1      ARG  27  83.636  -9.190   8.869
  206    HD2  ARG  27           HD2      ARG  27  84.937  -8.258  10.590
  207    HD3  ARG  27           HD1      ARG  27  84.478  -6.612  10.164
  208    HE   ARG  27           HE       ARG  27  82.501  -6.889  11.382
  209   HH11  ARG  27          HH21      ARG  27  84.179  -9.880  10.935
  210   HH12  ARG  27          HH22      ARG  27  83.176 -10.768  12.033
  211   HH21  ARG  27          HH11      ARG  27  81.178  -8.045  12.823
  212   HH22  ARG  27          HH12      ARG  27  81.475  -9.729  13.102
  213    H    ARG  28           HN       ARG  28  84.237  -7.630   4.435
  214    HA   ARG  28           HA       ARG  28  87.068  -7.018   3.793
  215    HB2  ARG  28           HB2      ARG  28  86.257  -9.035   2.555
  216    HB3  ARG  28           HB1      ARG  28  84.971  -8.050   1.858
  217    HG2  ARG  28           HG2      ARG  28  86.737  -6.513   0.935
  218    HG3  ARG  28           HG1      ARG  28  87.956  -7.654   1.501
  219    HD2  ARG  28           HD2      ARG  28  87.135  -9.378   0.054
  220    HD3  ARG  28           HD1      ARG  28  85.685  -8.456  -0.327
  221    HE   ARG  28           HE       ARG  28  88.266  -8.169  -1.564
  222   HH11  ARG  28          HH21      ARG  28  85.356  -6.551  -0.620
  223   HH12  ARG  28          HH22      ARG  28  85.485  -5.319  -1.832
  224   HH21  ARG  28          HH11      ARG  28  88.437  -6.561  -3.159
  225   HH22  ARG  28          HH12      ARG  28  87.228  -5.325  -3.268
  226    H    TRP  29           HN       TRP  29  87.424  -5.206   2.533
  227    HA   TRP  29           HA       TRP  29  85.166  -3.477   1.875
  228    HB2  TRP  29           HB2      TRP  29  87.473  -2.648   3.638
  229    HB3  TRP  29           HB1      TRP  29  86.165  -1.599   3.090
  230    HD1  TRP  29           HD1      TRP  29  83.624  -2.553   3.856
  231    HE1  TRP  29           HE1      TRP  29  82.947  -3.461   6.190
  232    HE3  TRP  29           HE3      TRP  29  88.215  -3.793   5.652
  233    HZ2  TRP  29           HZ2      TRP  29  84.231  -4.571   8.513
  234    HZ3  TRP  29           HZ3      TRP  29  88.484  -4.764   7.911
  235    HH2  TRP  29           HH2      TRP  29  86.497  -5.163   9.348
  236    H    GLU  30           HN       GLU  30  85.754  -1.780   0.418
  237    HA   GLU  30           HA       GLU  30  88.168  -2.430  -1.119
  238    HB2  GLU  30           HB2      GLU  30  86.159  -0.468  -2.135
  239    HB3  GLU  30           HB1      GLU  30  87.095  -1.687  -3.004
  240    HG2  GLU  30           HG2      GLU  30  84.880  -2.524  -3.014
  241    HG3  GLU  30           HG1      GLU  30  85.690  -3.427  -1.734
  242    H    VAL  31           HN       VAL  31  89.787  -0.848  -1.441
  243    HA   VAL  31           HA       VAL  31  89.334   1.896  -0.494
  244    HB   VAL  31           HB       VAL  31  91.418   1.785   0.881
  245   HG11  VAL  31          HG11      VAL  31  89.245  -0.131   1.767
  246   HG12  VAL  31          HG12      VAL  31  89.114   1.626   1.841
  247   HG13  VAL  31          HG13      VAL  31  90.333   0.789   2.804
  248   HG21  VAL  31          HG21      VAL  31  92.529  -0.210   1.303
  249   HG22  VAL  31          HG22      VAL  31  92.004  -0.509  -0.353
  250   HG23  VAL  31          HG23      VAL  31  91.101  -1.195   0.998
  251    H    LEU  32           HN       LEU  32  90.986   3.364  -1.134
  252    HA   LEU  32           HA       LEU  32  92.366   2.489  -3.580
  253    HB2  LEU  32           HB2      LEU  32  92.717   4.927  -3.964
  254    HB3  LEU  32           HB1      LEU  32  91.012   4.503  -3.840
  255    HG   LEU  32           HG       LEU  32  92.632   5.523  -1.489
  256   HD11  LEU  32          HD11      LEU  32  91.690   7.721  -1.925
  257   HD12  LEU  32          HD12      LEU  32  90.809   7.100  -3.321
  258   HD13  LEU  32          HD13      LEU  32  92.570   7.179  -3.354
  259   HD21  LEU  32          HD21      LEU  32  89.886   4.580  -1.888
  260   HD22  LEU  32          HD22      LEU  32  89.934   6.209  -1.218
  261   HD23  LEU  32          HD23      LEU  32  90.756   4.892  -0.387
  262    H    LEU  33           HN       LEU  33  94.533   2.221  -3.598
  263    HA   LEU  33           HA       LEU  33  95.947   2.758  -1.089
  264    HB2  LEU  33           HB2      LEU  33  96.327   0.553  -1.855
  265    HB3  LEU  33           HB1      LEU  33  96.581   1.074  -3.517
  266    HG   LEU  33           HG       LEU  33  98.458   2.283  -1.561
  267   HD11  LEU  33          HD11      LEU  33  98.487  -0.692  -2.142
  268   HD12  LEU  33          HD12      LEU  33  98.279   0.066  -0.563
  269   HD13  LEU  33          HD13      LEU  33  99.818   0.204  -1.410
  270   HD21  LEU  33          HD21      LEU  33  98.587   2.456  -4.075
  271   HD22  LEU  33          HD22      LEU  33  98.913   0.724  -4.127
  272   HD23  LEU  33          HD23      LEU  33 100.051   1.812  -3.332
  273    H    HIS  34           HN       HIS  34  97.223   4.385  -0.827
  274    HA   HIS  34           HA       HIS  34  97.820   6.139  -3.086
  275    HB2  HIS  34           HB2      HIS  34  98.074   6.408  -0.085
  276    HB3  HIS  34           HB1      HIS  34  98.612   7.665  -1.209
  277    HD2  HIS  34           HD2      HIS  34  95.191   5.803  -0.372
  278    HE1  HIS  34           HE1      HIS  34  94.324   9.620  -1.945
  279    HE2  HIS  34           HE2      HIS  34  93.311   7.520  -0.947
  280    H    ASP  35           HN       ASP  35  99.556   3.874  -1.053
  281    HA   ASP  35           HA       ASP  35 101.702   3.893  -2.843
  282    HB2  ASP  35           HB2      ASP  35 103.488   4.995  -1.601
  283    HB3  ASP  35           HB1      ASP  35 102.145   6.128  -1.778
  284    H    VAL  36           HN       VAL  36 103.551   2.570  -2.150
  285    HA   VAL  36           HA       VAL  36 103.042   0.865   0.183
  286    HB   VAL  36           HB       VAL  36 101.962  -0.098  -1.966
  287   HG11  VAL  36          HG11      VAL  36 104.158   0.550  -3.247
  288   HG12  VAL  36          HG12      VAL  36 103.345  -0.964  -3.645
  289   HG13  VAL  36          HG13      VAL  36 104.769  -0.973  -2.604
  290   HG21  VAL  36          HG21      VAL  36 102.671  -1.353   0.186
  291   HG22  VAL  36          HG22      VAL  36 104.065  -1.890  -0.748
  292   HG23  VAL  36          HG23      VAL  36 102.435  -2.312  -1.273
  293    H    SER  37           HN       SER  37 104.838  -0.719   0.495
  294    HA   SER  37           HA       SER  37 107.422   0.142  -0.546
  295    HB2  SER  37           HB2      SER  37 107.043   1.409   1.587
  296    HB3  SER  37           HB1      SER  37 106.860  -0.130   2.421
  297    HG   SER  37           HG       SER  37 108.947  -0.388   2.355
  298    H    LEU  38           HN       LEU  38 109.104  -1.553   0.164
  299    HA   LEU  38           HA       LEU  38 108.075  -4.102  -0.468
  300    HB2  LEU  38           HB2      LEU  38 110.734  -3.272   0.726
  301    HB3  LEU  38           HB1      LEU  38 110.365  -4.926   0.247
  302    HG   LEU  38           HG       LEU  38 109.636  -3.175  -1.919
  303   HD11  LEU  38          HD11      LEU  38 111.210  -1.548  -1.043
  304   HD12  LEU  38          HD12      LEU  38 111.933  -2.325  -2.451
  305   HD13  LEU  38          HD13      LEU  38 112.438  -2.795  -0.829
  306   HD21  LEU  38          HD21      LEU  38 110.298  -5.597  -2.008
  307   HD22  LEU  38          HD22      LEU  38 111.960  -5.110  -1.671
  308   HD23  LEU  38          HD23      LEU  38 111.174  -4.591  -3.162
  309    H    HIS  39           HN       HIS  39 107.648  -2.403   2.307
  310    HA   HIS  39           HA       HIS  39 106.742  -4.726   3.727
  311    HB2  HIS  39           HB2      HIS  39 108.463  -3.534   5.655
  312    HB3  HIS  39           HB1      HIS  39 108.555  -5.156   4.977
  313    HD2  HIS  39           HD2      HIS  39 109.770  -1.564   3.700
  314    HE1  HIS  39           HE1      HIS  39 112.616  -4.491   2.618
  315    HE2  HIS  39           HE2      HIS  39 112.070  -2.012   2.548
  316    H    GLY  40           HN       GLY  40 105.312  -2.540   2.857
  317    HA2  GLY  40           HA2      GLY  40 103.931  -1.729   5.157
  318    HA3  GLY  40           HA1      GLY  40 105.049  -0.439   4.734
  319    H    ILE  41           HN       ILE  41 102.126  -0.349   4.688
  320    HA   ILE  41           HA       ILE  41 101.777   0.584   1.924
  321    HB   ILE  41           HB       ILE  41 100.705  -1.301   1.325
  322   HG12  ILE  41          HG12      ILE  41  98.630  -0.443   3.372
  323   HG13  ILE  41          HG11      ILE  41  98.782   0.243   1.755
  324   HG21  ILE  41          HG21      ILE  41  99.969  -3.014   2.986
  325   HG22  ILE  41          HG22      ILE  41 100.477  -1.929   4.279
  326   HG23  ILE  41          HG23      ILE  41 101.667  -2.574   3.147
  327   HD11  ILE  41          HD11      ILE  41  97.471  -2.197   2.575
  328   HD12  ILE  41          HD12      ILE  41  98.734  -2.562   1.401
  329   HD13  ILE  41          HD13      ILE  41  97.461  -1.414   0.997
  330    H    LEU  42           HN       LEU  42 100.191   2.080   1.624
  331    HA   LEU  42           HA       LEU  42  98.904   3.182   4.061
  332    HB2  LEU  42           HB2      LEU  42 100.815   4.461   2.488
  333    HB3  LEU  42           HB1      LEU  42  99.298   5.060   1.827
  334    HG   LEU  42           HG       LEU  42  99.888   5.072   4.792
  335   HD11  LEU  42          HD11      LEU  42 101.566   6.417   3.462
  336   HD12  LEU  42          HD12      LEU  42 100.590   7.376   4.573
  337   HD13  LEU  42          HD13      LEU  42 100.219   7.374   2.851
  338   HD21  LEU  42          HD21      LEU  42  97.518   5.421   3.475
  339   HD22  LEU  42          HD22      LEU  42  98.114   7.077   3.525
  340   HD23  LEU  42          HD23      LEU  42  97.902   6.170   5.023
  341    H    VAL  43           HN       VAL  43  96.725   3.546   3.889
  342    HA   VAL  43           HA       VAL  43  95.528   3.418   1.204
  343    HB   VAL  43           HB       VAL  43  93.843   1.812   1.924
  344   HG11  VAL  43          HG11      VAL  43  96.086   1.072   0.995
  345   HG12  VAL  43          HG12      VAL  43  95.244  -0.140   1.960
  346   HG13  VAL  43          HG13      VAL  43  96.588   0.765   2.657
  347   HG21  VAL  43          HG21      VAL  43  94.147   0.667   4.133
  348   HG22  VAL  43          HG22      VAL  43  93.732   2.372   4.295
  349   HG23  VAL  43          HG23      VAL  43  95.399   1.846   4.530
  350    H    GLY  44           HN       GLY  44  93.073   3.723   1.420
  351    HA2  GLY  44           HA2      GLY  44  92.631   6.161   3.054
  352    HA3  GLY  44           HA1      GLY  44  91.676   5.678   1.649
  353    H    GLN  45           HN       GLN  45  90.870   6.256   4.584
  354    HA   GLN  45           HA       GLN  45  90.033   3.675   5.552
  355    HB2  GLN  45           HB2      GLN  45  90.766   5.434   7.083
  356    HB3  GLN  45           HB1      GLN  45  89.440   6.464   6.542
  357    HG2  GLN  45           HG2      GLN  45  87.793   4.913   7.392
  358    HG3  GLN  45           HG1      GLN  45  89.034   3.718   7.757
  359   HE21  GLN  45          HE21      GLN  45  87.372   4.559   9.848
  360   HE22  GLN  45          HE22      GLN  45  88.254   5.539  10.920
  361    HA   PRO  46           HA       PRO  46  86.110   4.428   3.422
  362    HB2  PRO  46           HB2      PRO  46  85.197   1.872   3.293
  363    HB3  PRO  46           HB1      PRO  46  86.532   2.434   2.263
  364    HG2  PRO  46           HG2      PRO  46  86.623   0.808   4.759
  365    HG3  PRO  46           HG1      PRO  46  87.612   0.683   3.296
  366    HD2  PRO  46           HD2      PRO  46  88.396   1.979   5.666
  367    HD3  PRO  46           HD1      PRO  46  89.148   2.207   4.076
  368    H    GLN  47           HN       GLN  47  83.783   4.143   3.985
  369    HA   GLN  47           HA       GLN  47  83.290   4.660   6.720
  370    HB2  GLN  47           HB2      GLN  47  80.807   4.189   5.833
  371    HB3  GLN  47           HB1      GLN  47  81.681   5.673   5.463
  372    HG2  GLN  47           HG2      GLN  47  80.689   4.739   3.427
  373    HG3  GLN  47           HG1      GLN  47  82.444   4.680   3.324
  374   HE21  GLN  47          HE21      GLN  47  83.252   2.685   2.663
  375   HE22  GLN  47          HE22      GLN  47  82.450   1.202   2.853
  376    H    ASP  48           HN       ASP  48  82.795   1.726   4.775
  377    HA   ASP  48           HA       ASP  48  81.440   0.307   6.864
  378    HB2  ASP  48           HB2      ASP  48  82.633  -0.475   4.219
  379    HB3  ASP  48           HB1      ASP  48  82.034  -1.698   5.337
  380    H    TRP  49           HN       TRP  49  84.445   1.376   6.994
  381    HA   TRP  49           HA       TRP  49  86.097  -0.844   7.471
  382    HB2  TRP  49           HB2      TRP  49  86.845   1.523   7.210
  383    HB3  TRP  49           HB1      TRP  49  86.241   1.846   8.832
  384    HD1  TRP  49           HD1      TRP  49  87.560   0.917  10.836
  385    HE1  TRP  49           HE1      TRP  49  89.968  -0.093  11.084
  386    HE3  TRP  49           HE3      TRP  49  88.482  -0.109   5.987
  387    HZ2  TRP  49           HZ2      TRP  49  92.025  -1.222   9.284
  388    HZ3  TRP  49           HZ3      TRP  49  90.600  -1.149   5.254
  389    HH2  TRP  49           HH2      TRP  49  92.345  -1.712   6.907
  390    H    ASN  50           HN       ASN  50  84.292  -2.126   8.665
  391    HA   ASN  50           HA       ASN  50  84.198  -1.401  11.509
  392    HB2  ASN  50           HB2      ASN  50  82.071  -2.124  10.484
  393    HB3  ASN  50           HB1      ASN  50  82.805  -3.664  10.041
  394   HD21  ASN  50          HD21      ASN  50  84.092  -4.578  12.227
  395   HD22  ASN  50          HD22      ASN  50  83.073  -4.652  13.583
  396    H    GLY  51           HN       GLY  51  86.463  -1.753  11.819
  397    HA2  GLY  51           HA2      GLY  51  87.060  -4.583  12.374
  398    HA3  GLY  51           HA1      GLY  51  88.182  -3.659  11.382
  399    H    ASP  52           HN       ASP  52  88.461  -4.920  14.078
  400    HA   ASP  52           HA       ASP  52  88.782  -2.697  15.912
  401    HB2  ASP  52           HB2      ASP  52  88.055  -4.861  16.770
  402    HB3  ASP  52           HB1      ASP  52  89.521  -5.618  16.151
  403    HA   PRO  53           HA       PRO  53  92.831  -1.710  14.160
  404    HB2  PRO  53           HB2      PRO  53  93.056  -0.361  16.824
  405    HB3  PRO  53           HB1      PRO  53  93.417   0.278  15.212
  406    HG2  PRO  53           HG2      PRO  53  91.196   0.957  16.512
  407    HG3  PRO  53           HG1      PRO  53  91.219   0.748  14.754
  408    HD2  PRO  53           HD2      PRO  53  90.033  -1.018  16.840
  409    HD3  PRO  53           HD1      PRO  53  89.554  -0.788  15.145
  410    H    GLN  54           HN       GLN  54  92.123  -3.237  17.187
  411    HA   GLN  54           HA       GLN  54  94.846  -3.823  17.858
  412    HB2  GLN  54           HB2      GLN  54  92.277  -5.021  18.917
  413    HB3  GLN  54           HB1      GLN  54  93.877  -5.231  19.630
  414    HG2  GLN  54           HG2      GLN  54  92.692  -2.491  19.166
  415    HG3  GLN  54           HG1      GLN  54  92.385  -3.399  20.645
  416   HE21  GLN  54          HE21      GLN  54  93.643  -1.315  21.458
  417   HE22  GLN  54          HE22      GLN  54  95.329  -1.484  21.573
  418    H    ARG  55           HN       ARG  55  92.421  -5.374  15.896
  419    HA   ARG  55           HA       ARG  55  93.944  -7.885  15.891
  420    HB2  ARG  55           HB2      ARG  55  91.191  -7.080  15.022
  421    HB3  ARG  55           HB1      ARG  55  91.942  -8.453  14.213
  422    HG2  ARG  55           HG2      ARG  55  92.073  -9.711  16.191
  423    HG3  ARG  55           HG1      ARG  55  91.934  -8.288  17.221
  424    HD2  ARG  55           HD2      ARG  55  89.838  -9.594  17.219
  425    HD3  ARG  55           HD1      ARG  55  89.595  -7.993  16.528
  426    HE   ARG  55           HE       ARG  55  89.182  -8.994  14.462
  427   HH11  ARG  55          HH21      ARG  55  90.526 -11.241  16.724
  428   HH12  ARG  55          HH22      ARG  55  90.233 -12.629  15.732
  429   HH21  ARG  55          HH11      ARG  55  88.784 -10.813  13.157
  430   HH22  ARG  55          HH12      ARG  55  89.246 -12.387  13.713
  431    HA   PRO  56           HA       PRO  56  96.126  -7.059  12.216
  432    HB2  PRO  56           HB2      PRO  56  96.221  -9.557  11.059
  433    HB3  PRO  56           HB1      PRO  56  97.200  -9.079  12.461
  434    HG2  PRO  56           HG2      PRO  56  94.654 -10.630  12.374
  435    HG3  PRO  56           HG1      PRO  56  96.100 -10.890  13.366
  436    HD2  PRO  56           HD2      PRO  56  93.869  -9.704  14.364
  437    HD3  PRO  56           HD1      PRO  56  95.500  -9.264  14.915
  438    H    PHE  57           HN       PHE  57  96.059  -7.030   9.888
  439    HA   PHE  57           HA       PHE  57  93.364  -7.393   8.705
  440    HB2  PHE  57           HB2      PHE  57  95.234  -5.052   8.244
  441    HB3  PHE  57           HB1      PHE  57  93.666  -5.300   7.484
  442    HD1  PHE  57           HD1      PHE  57  95.319  -4.852  10.807
  443    HD2  PHE  57           HD2      PHE  57  91.683  -4.565   8.541
  444    HE1  PHE  57           HE1      PHE  57  94.215  -3.705  12.711
  445    HE2  PHE  57           HE2      PHE  57  90.582  -3.426  10.443
  446    HZ   PHE  57           HZ       PHE  57  91.844  -2.998  12.529
  447    H    GLU  58           HN       GLU  58  93.476  -7.757   6.328
  448    HA   GLU  58           HA       GLU  58  96.184  -8.509   5.408
  449    HB2  GLU  58           HB2      GLU  58  93.541  -9.880   4.840
  450    HB3  GLU  58           HB1      GLU  58  95.007 -10.203   3.917
  451    HG2  GLU  58           HG2      GLU  58  96.125 -11.115   5.776
  452    HG3  GLU  58           HG1      GLU  58  95.009 -10.378   6.925
  453    H    ALA  59           HN       ALA  59  96.826  -7.589   3.448
  454    HA   ALA  59           HA       ALA  59  94.797  -5.906   2.086
  455    HB1  ALA  59           HB1      ALA  59  96.270  -4.271   2.492
  456    HB2  ALA  59           HB2      ALA  59  97.332  -5.046   1.320
  457    HB3  ALA  59           HB3      ALA  59  97.497  -5.416   3.034
  458    H    ARG  60           HN       ARG  60  94.458  -6.128  -0.015
  459    HA   ARG  60           HA       ARG  60  96.260  -7.901  -1.569
  460    HB2  ARG  60           HB2      ARG  60  93.284  -7.576  -2.002
  461    HB3  ARG  60           HB1      ARG  60  94.357  -8.706  -2.815
  462    HG2  ARG  60           HG2      ARG  60  94.350  -8.906   0.145
  463    HG3  ARG  60           HG1      ARG  60  92.831  -9.342  -0.638
  464    HD2  ARG  60           HD2      ARG  60  93.925 -10.982  -2.019
  465    HD3  ARG  60           HD1      ARG  60  95.515 -10.446  -1.489
  466    HE   ARG  60           HE       ARG  60  94.417 -11.181   0.846
  467   HH11  ARG  60          HH21      ARG  60  94.434 -12.682  -2.274
  468   HH12  ARG  60          HH22      ARG  60  94.366 -14.296  -1.650
  469   HH21  ARG  60          HH11      ARG  60  94.331 -13.298   1.670
  470   HH22  ARG  60          HH12      ARG  60  94.309 -14.645   0.581
  471    H    LEU  61           HN       LEU  61  97.144  -6.866  -3.317
  472    HA   LEU  61           HA       LEU  61  95.915  -4.285  -4.090
  473    HB2  LEU  61           HB2      LEU  61  98.738  -5.316  -4.144
  474    HB3  LEU  61           HB1      LEU  61  98.254  -3.996  -5.205
  475    HG   LEU  61           HG       LEU  61  97.451  -2.723  -3.240
  476   HD11  LEU  61          HD11      LEU  61  98.199  -5.277  -1.864
  477   HD12  LEU  61          HD12      LEU  61  96.825  -4.210  -1.578
  478   HD13  LEU  61          HD13      LEU  61  98.424  -3.762  -0.989
  479   HD21  LEU  61          HD21      LEU  61  99.649  -2.125  -3.794
  480   HD22  LEU  61          HD22      LEU  61 100.293  -3.712  -3.369
  481   HD23  LEU  61          HD23      LEU  61  99.816  -2.586  -2.099
  482    H    TYR  62           HN       TYR  62  95.570  -3.783  -6.236
  483    HA   TYR  62           HA       TYR  62  95.866  -5.993  -8.178
  484    HB2  TYR  62           HB2      TYR  62  93.478  -4.151  -8.146
  485    HB3  TYR  62           HB1      TYR  62  93.676  -5.675  -9.009
  486    HD1  TYR  62           HD1      TYR  62  93.480  -4.204  -5.582
  487    HD2  TYR  62           HD2      TYR  62  93.041  -7.721  -8.011
  488    HE1  TYR  62           HE1      TYR  62  92.516  -5.423  -3.647
  489    HE2  TYR  62           HE2      TYR  62  92.077  -8.939  -6.076
  490    HH   TYR  62           HH       TYR  62  90.742  -7.894  -3.730
  491    H    LEU  63           HN       LEU  63  97.295  -5.288  -9.612
  492    HA   LEU  63           HA       LEU  63  97.255  -2.448 -10.437
  493    HB2  LEU  63           HB2      LEU  63  99.363  -3.785  -9.515
  494    HB3  LEU  63           HB1      LEU  63  99.490  -4.268 -11.205
  495    HG   LEU  63           HG       LEU  63  99.221  -1.394 -10.272
  496   HD11  LEU  63          HD11      LEU  63 101.538  -1.143 -10.490
  497   HD12  LEU  63          HD12      LEU  63 101.713  -2.633 -11.419
  498   HD13  LEU  63          HD13      LEU  63 101.393  -2.705  -9.686
  499   HD21  LEU  63          HD21      LEU  63 100.061  -1.018 -12.660
  500   HD22  LEU  63          HD22      LEU  63  98.408  -1.615 -12.511
  501   HD23  LEU  63          HD23      LEU  63  99.710  -2.722 -12.947
  502    H    GLY  64           HN       GLY  64  98.475  -5.324 -12.102
  503    HA2  GLY  64           HA2      GLY  64  97.223  -4.504 -14.586
  504    HA3  GLY  64           HA1      GLY  64  98.261  -5.910 -14.346
  505    H    LEU  65           HN       LEU  65  96.264  -6.651 -15.823
  506    HA   LEU  65           HA       LEU  65  93.881  -7.193 -14.334
  507    HB2  LEU  65           HB2      LEU  65  94.639  -8.586 -16.904
  508    HB3  LEU  65           HB1      LEU  65  93.027  -8.189 -16.308
  509    HG   LEU  65           HG       LEU  65  95.122  -6.165 -17.153
  510   HD11  LEU  65          HD11      LEU  65  92.637  -7.233 -18.512
  511   HD12  LEU  65          HD12      LEU  65  94.294  -7.277 -19.115
  512   HD13  LEU  65          HD13      LEU  65  93.437  -5.740 -19.003
  513   HD21  LEU  65          HD21      LEU  65  92.296  -5.954 -16.099
  514   HD22  LEU  65          HD22      LEU  65  93.037  -4.653 -17.033
  515   HD23  LEU  65          HD23      LEU  65  93.747  -5.152 -15.497
  516    H    ASP  66           HN       ASP  66  96.847  -8.980 -15.096
  517    HA   ASP  66           HA       ASP  66  95.846 -11.435 -13.802
  518    HB2  ASP  66           HB2      ASP  66  96.845 -11.612 -16.024
  519    HB3  ASP  66           HB1      ASP  66  98.309 -10.832 -15.429
  520    H    VAL  67           HN       VAL  67  97.145  -8.633 -12.746
  521    HA   VAL  67           HA       VAL  67  99.208  -9.919 -11.064
  522    HB   VAL  67           HB       VAL  67  98.764  -7.050 -11.875
  523   HG11  VAL  67          HG11      VAL  67  99.295  -6.787  -9.588
  524   HG12  VAL  67          HG12      VAL  67 100.865  -6.697 -10.383
  525   HG13  VAL  67          HG13      VAL  67 100.367  -8.188  -9.585
  526   HG21  VAL  67          HG21      VAL  67 101.309  -8.674 -11.949
  527   HG22  VAL  67          HG22      VAL  67 100.874  -7.263 -12.916
  528   HG23  VAL  67          HG23      VAL  67 100.108  -8.820 -13.235
  529    H    LEU  68           HN       LEU  68  98.080 -10.814  -9.460
  530    HA   LEU  68           HA       LEU  68  96.503  -9.020  -7.718
  531    HB2  LEU  68           HB2      LEU  68  94.947 -10.637  -8.333
  532    HB3  LEU  68           HB1      LEU  68  96.169 -11.889  -8.526
  533    HG   LEU  68           HG       LEU  68  96.428 -12.059  -6.102
  534   HD11  LEU  68          HD11      LEU  68  96.052 -10.037  -5.069
  535   HD12  LEU  68          HD12      LEU  68  94.437 -10.708  -4.865
  536   HD13  LEU  68          HD13      LEU  68  94.764  -9.586  -6.185
  537   HD21  LEU  68          HD21      LEU  68  93.484 -12.046  -6.832
  538   HD22  LEU  68          HD22      LEU  68  94.258 -13.017  -5.579
  539   HD23  LEU  68          HD23      LEU  68  94.608 -13.331  -7.279
  540    H    ILE  69           HN       ILE  69  97.634  -8.487  -5.957
  541    HA   ILE  69           HA       ILE  69  99.719 -10.364  -4.994
  542    HB   ILE  69           HB       ILE  69  99.528  -7.417  -4.410
  543   HG12  ILE  69          HG12      ILE  69  99.631  -7.714  -6.844
  544   HG13  ILE  69          HG11      ILE  69 101.188  -7.136  -6.247
  545   HG21  ILE  69          HG21      ILE  69 101.749  -7.628  -3.653
  546   HG22  ILE  69          HG22      ILE  69 101.978  -9.170  -4.478
  547   HG23  ILE  69          HG23      ILE  69 100.962  -9.084  -3.037
  548   HD11  ILE  69          HD11      ILE  69 100.437  -9.914  -7.149
  549   HD12  ILE  69          HD12      ILE  69 101.848  -9.635  -6.133
  550   HD13  ILE  69          HD13      ILE  69 101.747  -8.893  -7.729
  551    H    ARG  70           HN       ARG  70  99.908 -10.836  -2.817
  552    HA   ARG  70           HA       ARG  70  97.735  -9.872  -1.062
  553    HB2  ARG  70           HB2      ARG  70  97.784 -12.194  -0.024
  554    HB3  ARG  70           HB1      ARG  70  97.056 -12.082  -1.622
  555    HG2  ARG  70           HG2      ARG  70  99.987 -12.617  -1.536
  556    HG3  ARG  70           HG1      ARG  70  98.933 -13.928  -1.012
  557    HD2  ARG  70           HD2      ARG  70  97.627 -13.605  -3.158
  558    HD3  ARG  70           HD1      ARG  70  98.890 -12.497  -3.681
  559    HE   ARG  70           HE       ARG  70 100.254 -14.331  -4.082
  560   HH11  ARG  70          HH21      ARG  70  97.571 -15.185  -2.071
  561   HH12  ARG  70          HH22      ARG  70  97.878 -16.888  -2.145
  562   HH21  ARG  70          HH11      ARG  70 100.661 -16.563  -4.191
  563   HH22  ARG  70          HH12      ARG  70  99.629 -17.669  -3.346
  564    H    MET  71           HN       MET  71  98.354  -9.124   0.828
  565    HA   MET  71           HA       MET  71 100.937  -9.945   1.976
  566    HB2  MET  71           HB2      MET  71 100.279  -7.042   2.125
  567    HB3  MET  71           HB1      MET  71 101.849  -7.837   2.041
  568    HG2  MET  71           HG2      MET  71 101.031  -8.464  -0.407
  569    HG3  MET  71           HG1      MET  71  99.996  -7.056  -0.184
  570    HE1  MET  71           HE1      MET  71 102.732  -4.373   0.873
  571    HE2  MET  71           HE2      MET  71 101.990  -5.543   1.958
  572    HE3  MET  71           HE3      MET  71 100.999  -4.718   0.758
  573    H    GLU  72           HN       GLU  72 101.027  -9.754   4.225
  574    HA   GLU  72           HA       GLU  72  98.410  -9.429   5.516
  575    HB2  GLU  72           HB2      GLU  72  99.535 -11.567   5.950
  576    HB3  GLU  72           HB1      GLU  72 100.969 -10.719   6.527
  577    HG2  GLU  72           HG2      GLU  72  99.747 -11.373   8.477
  578    HG3  GLU  72           HG1      GLU  72  99.473  -9.644   8.289
  579    H    ILE  73           HN       ILE  73  98.110  -7.566   6.820
  580    HA   ILE  73           HA       ILE  73 100.562  -6.161   7.687
  581    HB   ILE  73           HB       ILE  73  99.284  -4.026   7.036
  582   HG12  ILE  73          HG12      ILE  73  97.872  -6.010   5.233
  583   HG13  ILE  73          HG11      ILE  73  97.139  -5.341   6.690
  584   HG21  ILE  73          HG21      ILE  73  99.872  -4.604   4.486
  585   HG22  ILE  73          HG22      ILE  73 100.662  -5.980   5.242
  586   HG23  ILE  73          HG23      ILE  73 101.132  -4.341   5.687
  587   HD11  ILE  73          HD11      ILE  73  96.494  -4.073   4.655
  588   HD12  ILE  73          HD12      ILE  73  98.192  -3.690   4.376
  589   HD13  ILE  73          HD13      ILE  73  97.373  -3.080   5.806
  590    H    SER  74           HN       SER  74 100.290  -4.660   9.364
  591    HA   SER  74           HA       SER  74  97.828  -4.972  10.998
  592    HB2  SER  74           HB2      SER  74  99.159  -5.819  12.613
  593    HB3  SER  74           HB1      SER  74 100.603  -5.498  11.660
  594    HG   SER  74           HG       SER  74 100.675  -3.442  12.488
  595    H    LEU  75           HN       LEU  75  97.145  -3.126  12.160
  596    HA   LEU  75           HA       LEU  75  97.555  -0.659  10.788
  597    HB2  LEU  75           HB2      LEU  75  95.531  -1.522  12.293
  598    HB3  LEU  75           HB1      LEU  75  96.432  -0.700  13.565
  599    HG   LEU  75           HG       LEU  75  96.529   1.317  12.007
  600   HD11  LEU  75          HD11      LEU  75  94.408   1.219  10.428
  601   HD12  LEU  75          HD12      LEU  75  94.720  -0.514  10.470
  602   HD13  LEU  75          HD13      LEU  75  95.959   0.591   9.874
  603   HD21  LEU  75          HD21      LEU  75  94.171   1.977  12.553
  604   HD22  LEU  75          HD22      LEU  75  95.051   1.302  13.923
  605   HD23  LEU  75          HD23      LEU  75  93.876   0.312  13.054
  606    H    ALA  76           HN       ALA  76  99.029   0.776  10.956
  607    HA   ALA  76           HA       ALA  76 100.904   0.668  13.211
  608    HB1  ALA  76           HB1      ALA  76 101.967   0.457  11.045
  609    HB2  ALA  76           HB2      ALA  76 102.402   2.007  11.757
  610    HB3  ALA  76           HB3      ALA  76 101.184   1.932  10.482
  611    H    TRP  77           HN       TRP  77  98.926   2.894  11.345
  612    HA   TRP  77           HA       TRP  77  98.372   4.575  13.630
  613    HB2  TRP  77           HB2      TRP  77  99.461   6.622  12.762
  614    HB3  TRP  77           HB1      TRP  77 100.664   5.363  13.065
  615    HD1  TRP  77           HD1      TRP  77 101.891   4.305  11.009
  616    HE1  TRP  77           HE1      TRP  77 101.799   4.702   8.468
  617    HE3  TRP  77           HE3      TRP  77  98.041   7.652  10.760
  618    HZ2  TRP  77           HZ2      TRP  77 100.483   6.395   6.626
  619    HZ3  TRP  77           HZ3      TRP  77  97.396   8.657   8.587
  620    HH2  TRP  77           HH2      TRP  77  98.597   8.025   6.512
  621    H    ALA  78           HN       ALA  78  97.125   6.603  12.884
  622    HA   ALA  78           HA       ALA  78  95.855   6.371  10.244
  623    HB1  ALA  78           HB1      ALA  78  94.312   6.159  12.833
  624    HB2  ALA  78           HB2      ALA  78  94.478   4.908  11.601
  625    HB3  ALA  78           HB3      ALA  78  93.591   6.389  11.240
  626    H    ARG  79           HN       ARG  79  95.731   8.450   9.460
  627    HA   ARG  79           HA       ARG  79  94.848  10.567  11.244
  628    HB2  ARG  79           HB2      ARG  79  97.430  10.323  11.380
  629    HB3  ARG  79           HB1      ARG  79  97.429  11.045   9.772
  630    HG2  ARG  79           HG2      ARG  79  96.385  13.046  10.569
  631    HG3  ARG  79           HG1      ARG  79  95.999  12.308  12.125
  632    HD2  ARG  79           HD2      ARG  79  98.123  12.597  12.936
  633    HD3  ARG  79           HD1      ARG  79  98.873  12.318  11.367
  634    HE   ARG  79           HE       ARG  79  98.667  14.606  10.896
  635   HH11  ARG  79          HH21      ARG  79  97.005  13.711  13.799
  636   HH12  ARG  79          HH22      ARG  79  96.766  15.342  14.328
  637   HH21  ARG  79          HH11      ARG  79  98.355  16.747  11.586
  638   HH22  ARG  79          HH12      ARG  79  97.530  17.061  13.077
  639    H    ASP  80           HN       ASP  80  93.649  12.082  10.255
  640    HA   ASP  80           HA       ASP  80  92.537  13.207   8.606
  641    HB2  ASP  80           HB2      ASP  80  94.966  13.960   8.337
  642    HB3  ASP  80           HB1      ASP  80  95.018  12.891   6.937
  643    H    GLY  81           HN       GLY  81  91.759  10.536   8.516
  644    HA2  GLY  81           HA2      GLY  81  90.613   9.148   7.102
  645    HA3  GLY  81           HA1      GLY  81  90.819  10.368   5.851
  646    H    LEU  82           HN       LEU  82  93.755   9.370   7.231
  647    HA   LEU  82           HA       LEU  82  94.237   7.497   4.987
  648    HB2  LEU  82           HB2      LEU  82  96.265   9.299   6.345
  649    HB3  LEU  82           HB1      LEU  82  96.554   8.245   4.961
  650    HG   LEU  82           HG       LEU  82  94.719  10.658   5.039
  651   HD11  LEU  82          HD11      LEU  82  97.144  10.150   3.303
  652   HD12  LEU  82          HD12      LEU  82  97.240  10.994   4.849
  653   HD13  LEU  82          HD13      LEU  82  96.278  11.669   3.534
  654   HD21  LEU  82          HD21      LEU  82  94.691  10.065   2.473
  655   HD22  LEU  82          HD22      LEU  82  93.604   9.216   3.568
  656   HD23  LEU  82          HD23      LEU  82  95.096   8.443   3.035
  657    H    LEU  83           HN       LEU  83  95.173   5.546   5.498
  658    HA   LEU  83           HA       LEU  83  95.689   5.059   8.397
  659    HB2  LEU  83           HB2      LEU  83  94.672   3.077   6.373
  660    HB3  LEU  83           HB1      LEU  83  94.808   2.864   8.116
  661    HG   LEU  83           HG       LEU  83  93.026   4.912   6.765
  662   HD11  LEU  83          HD11      LEU  83  92.547   2.123   7.813
  663   HD12  LEU  83          HD12      LEU  83  92.044   2.822   6.275
  664   HD13  LEU  83          HD13      LEU  83  91.243   3.305   7.769
  665   HD21  LEU  83          HD21      LEU  83  93.535   4.091   9.631
  666   HD22  LEU  83          HD22      LEU  83  92.016   4.848   9.156
  667   HD23  LEU  83          HD23      LEU  83  93.535   5.714   8.940
  668    H    GLY  84           HN       GLY  84  97.663   4.162   8.879
  669    HA2  GLY  84           HA2      GLY  84  99.383   3.410   6.633
  670    HA3  GLY  84           HA1      GLY  84  99.893   3.737   8.287
  671    H    PHE  85           HN       PHE  85 100.519   1.439   6.682
  672    HA   PHE  85           HA       PHE  85  99.576  -0.617   8.544
  673    HB2  PHE  85           HB2      PHE  85  99.109  -0.536   5.585
  674    HB3  PHE  85           HB1      PHE  85  99.334  -2.085   6.385
  675    HD1  PHE  85           HD2      PHE  85  97.914  -2.528   8.514
  676    HD2  PHE  85           HD1      PHE  85  97.005   0.511   5.619
  677    HE1  PHE  85           HE2      PHE  85  95.575  -2.450   9.331
  678    HE2  PHE  85           HE1      PHE  85  94.665   0.590   6.436
  679    HZ   PHE  85           HZ       PHE  85  93.957  -0.888   8.292
  680    H    GLU  86           HN       GLU  86 101.184  -1.968   9.136
  681    HA   GLU  86           HA       GLU  86 103.711  -1.771   7.634
  682    HB2  GLU  86           HB2      GLU  86 103.766  -1.205  10.056
  683    HB3  GLU  86           HB1      GLU  86 103.193  -2.831  10.428
  684    HG2  GLU  86           HG2      GLU  86 105.178  -3.817   9.447
  685    HG3  GLU  86           HG1      GLU  86 105.722  -2.244   8.866
  686    H    CYS  87           HN       CYS  87 104.385  -3.498   6.472
  687    HA   CYS  87           HA       CYS  87 102.723  -5.839   6.335
  688    HB2  CYS  87           HB2      CYS  87 104.357  -4.580   4.557
  689    HB3  CYS  87           HB1      CYS  87 105.378  -5.933   5.044
  690    HG   CYS  87           HG       CYS  87 103.977  -7.362   3.597
  691    H    GLN  88           HN       GLN  88 102.886  -7.647   7.435
  692    HA   GLN  88           HA       GLN  88 105.313  -8.137   9.036
  693    HB2  GLN  88           HB2      GLN  88 103.443  -9.967   9.897
  694    HB3  GLN  88           HB1      GLN  88 103.734  -8.397  10.641
  695    HG2  GLN  88           HG2      GLN  88 102.014  -7.395   9.150
  696    HG3  GLN  88           HG1      GLN  88 101.692  -8.995   8.480
  697   HE21  GLN  88          HE21      GLN  88 100.216  -6.946  10.448
  698   HE22  GLN  88          HE22      GLN  88  99.608  -7.994  11.638
  699    H    HIS  89           HN       HIS  89 103.282  -9.449   6.496
  700    HA   HIS  89           HA       HIS  89 105.352 -11.322   5.775
  701    HB2  HIS  89           HB2      HIS  89 104.562 -13.132   6.851
  702    HB3  HIS  89           HB1      HIS  89 103.204 -12.201   7.480
  703    HD2  HIS  89           HD2      HIS  89 100.864 -13.380   6.645
  704    HE1  HIS  89           HE1      HIS  89 102.171 -14.759   2.874
  705    HE2  HIS  89           HE2      HIS  89 100.191 -14.641   4.459
  706    H    ILE  90           HN       ILE  90 105.236 -11.892   3.661
  707    HA   ILE  90           HA       ILE  90 102.808 -11.427   2.064
  708    HB   ILE  90           HB       ILE  90 103.899  -9.247   1.982
  709   HG12  ILE  90          HG12      ILE  90 104.529 -10.858  -0.515
  710   HG13  ILE  90          HG11      ILE  90 102.950 -10.182  -0.121
  711   HG21  ILE  90          HG21      ILE  90 106.267  -9.154   1.056
  712   HG22  ILE  90          HG22      ILE  90 106.358 -10.891   1.343
  713   HG23  ILE  90          HG23      ILE  90 106.124  -9.785   2.695
  714   HD11  ILE  90          HD11      ILE  90 104.454  -7.957   0.148
  715   HD12  ILE  90          HD12      ILE  90 103.727  -8.436  -1.385
  716   HD13  ILE  90          HD13      ILE  90 105.417  -8.814  -1.055
  717    H    ASP  91           HN       ASP  91 102.592 -12.632   0.350
  718    HA   ASP  91           HA       ASP  91 103.915 -15.089   0.259
  719    HB2  ASP  91           HB2      ASP  91 101.855 -15.161  -0.770
  720    HB3  ASP  91           HB1      ASP  91 102.089 -13.626  -1.597
  721    H    LEU  92           HN       LEU  92 105.556 -15.927  -0.819
  722    HA   LEU  92           HA       LEU  92 107.756 -14.399  -1.595
  723    HB2  LEU  92           HB2      LEU  92 107.761 -16.855  -1.050
  724    HB3  LEU  92           HB1      LEU  92 107.098 -17.156  -2.653
  725    HG   LEU  92           HG       LEU  92 109.417 -15.390  -2.801
  726   HD11  LEU  92          HD11      LEU  92 110.161 -16.563  -0.790
  727   HD12  LEU  92          HD12      LEU  92 111.100 -17.112  -2.178
  728   HD13  LEU  92          HD13      LEU  92 109.801 -18.119  -1.538
  729   HD21  LEU  92          HD21      LEU  92 108.487 -16.625  -4.709
  730   HD22  LEU  92          HD22      LEU  92 108.814 -18.157  -3.896
  731   HD23  LEU  92          HD23      LEU  92 110.152 -17.132  -4.416
  732    H    ASP  93           HN       ASP  93 105.161 -15.763  -3.586
  733    HA   ASP  93           HA       ASP  93 106.228 -14.916  -6.082
  734    HB2  ASP  93           HB2      ASP  93 104.588 -16.323  -6.722
  735    HB3  ASP  93           HB1      ASP  93 103.862 -16.277  -5.118
  736    H    SER  94           HN       SER  94 104.104 -13.469  -3.683
  737    HA   SER  94           HA       SER  94 103.321 -11.202  -5.226
  738    HB2  SER  94           HB2      SER  94 103.288 -11.911  -2.312
  739    HB3  SER  94           HB1      SER  94 102.954 -10.258  -2.801
  740    HG   SER  94           HG       SER  94 101.063 -10.896  -3.439
  741    H    ILE  95           HN       ILE  95 105.969 -11.913  -3.023
  742    HA   ILE  95           HA       ILE  95 107.009  -9.334  -2.702
  743    HB   ILE  95           HB       ILE  95 108.305 -12.061  -2.685
  744   HG12  ILE  95          HG12      ILE  95 107.735 -10.050  -0.486
  745   HG13  ILE  95          HG11      ILE  95 106.706 -11.427  -0.866
  746   HG21  ILE  95          HG21      ILE  95 110.188 -10.683  -1.484
  747   HG22  ILE  95          HG22      ILE  95 109.523  -9.323  -2.387
  748   HG23  ILE  95          HG23      ILE  95 110.148 -10.731  -3.244
  749   HD11  ILE  95          HD11      ILE  95 107.993 -12.431   0.752
  750   HD12  ILE  95          HD12      ILE  95 109.367 -11.363   0.466
  751   HD13  ILE  95          HD13      ILE  95 109.064 -12.719  -0.619
  752    H    SER  96           HN       SER  96 107.515 -11.741  -5.257
  753    HA   SER  96           HA       SER  96 109.575 -10.245  -6.508
  754    HB2  SER  96           HB2      SER  96 108.528 -12.811  -6.809
  755    HB3  SER  96           HB1      SER  96 108.072 -12.008  -8.312
  756    HG   SER  96           HG       SER  96 110.336 -13.057  -7.896
  757    H    HIS  97           HN       HIS  97 106.075 -10.426  -7.078
  758    HA   HIS  97           HA       HIS  97 106.153  -8.848  -9.419
  759    HB2  HIS  97           HB2      HIS  97 104.005  -9.394  -7.368
  760    HB3  HIS  97           HB1      HIS  97 103.740  -8.252  -8.675
  761    HD2  HIS  97           HD2      HIS  97 103.178 -11.902  -8.126
  762    HE1  HIS  97           HE1      HIS  97 103.826 -11.538 -12.278
  763    HE2  HIS  97           HE2      HIS  97 102.990 -13.084 -10.447
  764    H    LEU  98           HN       LEU  98 106.067  -8.025  -5.999
  765    HA   LEU  98           HA       LEU  98 105.780  -5.188  -6.402
  766    HB2  LEU  98           HB2      LEU  98 105.339  -6.506  -4.231
  767    HB3  LEU  98           HB1      LEU  98 107.088  -6.526  -4.026
  768    HG   LEU  98           HG       LEU  98 105.870  -3.870  -4.639
  769   HD11  LEU  98          HD11      LEU  98 104.221  -4.579  -3.065
  770   HD12  LEU  98          HD12      LEU  98 105.371  -3.604  -2.150
  771   HD13  LEU  98          HD13      LEU  98 105.428  -5.363  -2.046
  772   HD21  LEU  98          HD21      LEU  98 107.961  -4.872  -2.677
  773   HD22  LEU  98          HD22      LEU  98 107.544  -3.177  -2.929
  774   HD23  LEU  98          HD23      LEU  98 108.278  -4.106  -4.234
  775    H    ARG  99           HN       ARG  99 108.544  -7.375  -6.321
  776    HA   ARG  99           HA       ARG  99 110.552  -5.399  -6.117
  777    HB2  ARG  99           HB2      ARG  99 110.413  -8.190  -7.164
  778    HB3  ARG  99           HB1      ARG  99 111.794  -7.211  -7.655
  779    HG2  ARG  99           HG2      ARG  99 112.616  -7.028  -5.491
  780    HG3  ARG  99           HG1      ARG  99 111.025  -7.234  -4.755
  781    HD2  ARG  99           HD2      ARG  99 112.789  -9.200  -4.678
  782    HD3  ARG  99           HD1      ARG  99 111.083  -9.541  -4.941
  783    HE   ARG  99           HE       ARG  99 111.563 -10.089  -7.169
  784   HH11  ARG  99          HH21      ARG  99 114.292  -8.743  -5.523
  785   HH12  ARG  99          HH22      ARG  99 115.428  -9.194  -6.749
  786   HH21  ARG  99          HH11      ARG  99 113.046 -10.684  -8.783
  787   HH22  ARG  99          HH12      ARG  99 114.723 -10.293  -8.596
  788    H    ARG 100           HN       ARG 100 108.698  -6.629  -8.840
  789    HA   ARG 100           HA       ARG 100 110.039  -5.415 -11.003
  790    HB2  ARG 100           HB2      ARG 100 107.157  -6.152 -10.553
  791    HB3  ARG 100           HB1      ARG 100 107.735  -5.466 -12.067
  792    HG2  ARG 100           HG2      ARG 100 109.144  -7.838 -10.862
  793    HG3  ARG 100           HG1      ARG 100 107.667  -8.072 -11.794
  794    HD2  ARG 100           HD2      ARG 100 108.679  -7.548 -13.775
  795    HD3  ARG 100           HD1      ARG 100 109.674  -6.288 -13.052
  796    HE   ARG 100           HE       ARG 100 110.377  -9.062 -12.419
  797   HH11  ARG 100          HH21      ARG 100 110.938  -6.174 -14.252
  798   HH12  ARG 100          HH22      ARG 100 112.555  -6.608 -14.695
  799   HH21  ARG 100          HH11      ARG 100 112.494  -9.631 -12.999
  800   HH22  ARG 100          HH12      ARG 100 113.434  -8.562 -13.987
  801    H    LEU 101           HN       LEU 101 107.396  -4.248  -8.958
  802    HA   LEU 101           HA       LEU 101 107.065  -1.753 -10.273
  803    HB2  LEU 101           HB2      LEU 101 106.269  -2.773  -7.553
  804    HB3  LEU 101           HB1      LEU 101 105.989  -1.095  -8.005
  805    HG   LEU 101           HG       LEU 101 103.977  -2.271  -8.520
  806   HD11  LEU 101          HD11      LEU 101 103.682  -1.683 -10.739
  807   HD12  LEU 101          HD12      LEU 101 105.246  -2.307 -11.237
  808   HD13  LEU 101          HD13      LEU 101 105.139  -0.775 -10.364
  809   HD21  LEU 101          HD21      LEU 101 103.927  -4.318  -9.865
  810   HD22  LEU 101          HD22      LEU 101 104.949  -4.545  -8.448
  811   HD23  LEU 101          HD23      LEU 101 105.682  -4.274 -10.030
  812    H    VAL 102           HN       VAL 102 109.071  -2.769  -7.561
  813    HA   VAL 102           HA       VAL 102 109.932  -0.171  -6.816
  814    HB   VAL 102           HB       VAL 102 111.142  -2.914  -6.440
  815   HG11  VAL 102          HG11      VAL 102 113.031  -1.503  -6.319
  816   HG12  VAL 102          HG12      VAL 102 112.500  -1.631  -4.642
  817   HG13  VAL 102          HG13      VAL 102 112.113  -0.189  -5.581
  818   HG21  VAL 102          HG21      VAL 102 109.981  -1.038  -4.375
  819   HG22  VAL 102          HG22      VAL 102 110.228  -2.780  -4.256
  820   HG23  VAL 102          HG23      VAL 102 108.955  -2.141  -5.294
  821    H    GLU 103           HN       GLU 103 111.361  -2.654  -8.919
  822    HA   GLU 103           HA       GLU 103 113.649  -1.155  -9.655
  823    HB2  GLU 103           HB2      GLU 103 113.424  -3.622  -9.898
  824    HB3  GLU 103           HB1      GLU 103 112.281  -3.358 -11.213
  825    HG2  GLU 103           HG2      GLU 103 115.036  -2.122 -11.246
  826    HG3  GLU 103           HG1      GLU 103 114.752  -3.752 -11.852
  827    H    LEU 104           HN       LEU 104 110.430  -1.474 -11.108
  828    HA   LEU 104           HA       LEU 104 111.083  -0.001 -13.466
  829    HB2  LEU 104           HB2      LEU 104 108.521  -0.935 -12.206
  830    HB3  LEU 104           HB1      LEU 104 108.487   0.148 -13.595
  831    HG   LEU 104           HG       LEU 104 110.208  -2.318 -13.697
  832   HD11  LEU 104          HD11      LEU 104 108.109  -3.262 -13.015
  833   HD12  LEU 104          HD12      LEU 104 108.197  -3.462 -14.765
  834   HD13  LEU 104          HD13      LEU 104 107.206  -2.178 -14.073
  835   HD21  LEU 104          HD21      LEU 104 110.125  -0.412 -15.453
  836   HD22  LEU 104          HD22      LEU 104 108.537  -1.049 -15.873
  837   HD23  LEU 104          HD23      LEU 104 109.968  -2.065 -16.043
  838    H    ASN 105           HN       ASN 105 109.470   0.906 -10.409
  839    HA   ASN 105           HA       ASN 105 108.874   3.561 -11.274
  840    HB2  ASN 105           HB2      ASN 105 107.903   3.848  -9.223
  841    HB3  ASN 105           HB1      ASN 105 107.976   2.088  -9.223
  842   HD21  ASN 105          HD21      ASN 105 110.213   1.223  -8.303
  843   HD22  ASN 105          HD22      ASN 105 110.792   2.029  -6.925
  844    H    LEU 106           HN       LEU 106 111.574   2.111  -9.524
  845    HA   LEU 106           HA       LEU 106 112.861   4.425  -8.641
  846    HB2  LEU 106           HB2      LEU 106 113.634   1.631  -9.191
  847    HB3  LEU 106           HB1      LEU 106 114.963   2.783  -9.288
  848    HG   LEU 106           HG       LEU 106 113.070   2.875  -6.946
  849   HD11  LEU 106          HD11      LEU 106 115.424   1.011  -7.342
  850   HD12  LEU 106          HD12      LEU 106 113.754   0.562  -7.005
  851   HD13  LEU 106          HD13      LEU 106 114.715   1.369  -5.767
  852   HD21  LEU 106          HD21      LEU 106 116.048   3.414  -7.147
  853   HD22  LEU 106          HD22      LEU 106 114.957   3.898  -5.849
  854   HD23  LEU 106          HD23      LEU 106 114.831   4.656  -7.437
  855    H    GLY 107           HN       GLY 107 112.646   3.033 -11.831
  856    HA2  GLY 107           HA2      GLY 107 113.470   3.701 -13.877
  857    HA3  GLY 107           HA1      GLY 107 113.345   5.333 -13.221
  858    H    ASP 108           HN       ASP 108 115.409   2.509 -12.533
  859    HA   ASP 108           HA       ASP 108 117.677   3.606 -11.631
  860    HB2  ASP 108           HB2      ASP 108 117.409   1.200 -12.101
  861    HB3  ASP 108           HB1      ASP 108 117.598   1.525 -13.824
  862    H    GLU 109           HN       GLU 109 117.424   2.991 -15.132
  863    HA   GLU 109           HA       GLU 109 119.498   4.865 -15.740
  864    HB2  GLU 109           HB2      GLU 109 118.847   4.418 -18.104
  865    HB3  GLU 109           HB1      GLU 109 119.150   2.949 -17.178
  866    HG2  GLU 109           HG2      GLU 109 117.089   2.224 -17.741
  867    HG3  GLU 109           HG1      GLU 109 116.408   3.543 -16.793
  868    H    GLU 110           HN       GLU 110 119.089   6.951 -15.234
  869    HA   GLU 110           HA       GLU 110 118.169   9.051 -15.340
  870    HB2  GLU 110           HB2      GLU 110 116.839   7.968 -17.836
  871    HB3  GLU 110           HB1      GLU 110 117.049   9.669 -17.421
  872    HG2  GLU 110           HG2      GLU 110 119.450   7.858 -17.543
  873    HG3  GLU 110           HG1      GLU 110 118.774   8.514 -19.030
  874    H    LEU 111           HN       LEU 111 115.400   9.089 -16.886
  875    HA   LEU 111           HA       LEU 111 113.197   9.242 -16.266
  876    HB2  LEU 111           HB2      LEU 111 114.144   6.743 -14.935
  877    HB3  LEU 111           HB1      LEU 111 112.580   7.384 -14.442
  878    HG   LEU 111           HG       LEU 111 112.499   5.719 -16.352
  879   HD11  LEU 111          HD11      LEU 111 110.885   7.800 -15.867
  880   HD12  LEU 111          HD12      LEU 111 110.669   6.771 -17.281
  881   HD13  LEU 111          HD13      LEU 111 111.495   8.320 -17.438
  882   HD21  LEU 111          HD21      LEU 111 113.426   6.199 -18.434
  883   HD22  LEU 111          HD22      LEU 111 114.643   6.892 -17.366
  884   HD23  LEU 111          HD23      LEU 111 113.456   7.938 -18.140
  885    H    LEU 112           HN       LEU 112 113.209  11.230 -15.322
  886    HA   LEU 112           HA       LEU 112 113.580  12.813 -13.613
  887    HB2  LEU 112           HB2      LEU 112 111.691  12.523 -11.966
  888    HB3  LEU 112           HB1      LEU 112 111.220  12.491 -13.664
  889    HG   LEU 112           HG       LEU 112 111.907   9.871 -12.398
  890   HD11  LEU 112          HD11      LEU 112 109.450  11.503 -11.754
  891   HD12  LEU 112          HD12      LEU 112 110.555  10.710 -10.632
  892   HD13  LEU 112          HD13      LEU 112 109.467   9.744 -11.629
  893   HD21  LEU 112          HD21      LEU 112 109.546  10.605 -14.134
  894   HD22  LEU 112          HD22      LEU 112 110.325   9.033 -13.953
  895   HD23  LEU 112          HD23      LEU 112 111.142  10.326 -14.829
  896    H    GLU 113           HN       GLU 113 112.397  11.075 -11.023
  897    HA   GLU 113           HA       GLU 113 113.310  10.228  -9.094
  898    HB2  GLU 113           HB2      GLU 113 115.069   9.300 -11.137
  899    HB3  GLU 113           HB1      GLU 113 116.069   9.858  -9.800
  900    HG2  GLU 113           HG2      GLU 113 115.520   7.522  -9.437
  901    HG3  GLU 113           HG1      GLU 113 114.654   8.493  -8.247
  902    H    ARG 114           HN       ARG 114 116.169  11.811 -10.506
  903    HA   ARG 114           HA       ARG 114 117.623  13.311  -9.489
  904    HB2  ARG 114           HB2      ARG 114 115.967  15.435  -8.875
  905    HB3  ARG 114           HB1      ARG 114 116.653  15.105 -10.464
  906    HG2  ARG 114           HG2      ARG 114 114.639  13.720 -11.001
  907    HG3  ARG 114           HG1      ARG 114 113.943  14.197  -9.450
  908    HD2  ARG 114           HD2      ARG 114 114.018  16.548 -10.103
  909    HD3  ARG 114           HD1      ARG 114 114.803  16.125 -11.622
  910    HE   ARG 114           HE       ARG 114 112.473  14.671 -11.632
  911   HH11  ARG 114          HH21      ARG 114 113.343  17.997 -11.229
  912   HH12  ARG 114          HH22      ARG 114 111.871  18.607 -11.909
  913   HH21  ARG 114          HH11      ARG 114 110.543  15.465 -12.526
  914   HH22  ARG 114          HH12      ARG 114 110.287  17.174 -12.642
  915    H    GLU 115           HN       GLU 115 118.411  12.573  -7.589
  916    HA   GLU 115           HA       GLU 115 117.094  12.088  -5.215
  917    HB2  GLU 115           HB2      GLU 115 119.845  13.304  -5.231
  918    HB3  GLU 115           HB1      GLU 115 119.197  12.048  -4.178
  919    HG2  GLU 115           HG2      GLU 115 118.952  10.620  -6.299
  920    HG3  GLU 115           HG1      GLU 115 119.975  11.820  -7.089
  921    H    LEU 116           HN       LEU 116 117.605  15.118  -6.712
  922    HA   LEU 116           HA       LEU 116 117.875  16.869  -4.573
  923    HB2  LEU 116           HB2      LEU 116 116.601  17.079  -7.277
  924    HB3  LEU 116           HB1      LEU 116 116.380  18.397  -6.126
  925    HG   LEU 116           HG       LEU 116 118.812  18.604  -5.866
  926   HD11  LEU 116          HD11      LEU 116 120.267  17.284  -7.454
  927   HD12  LEU 116          HD12      LEU 116 118.853  16.303  -7.838
  928   HD13  LEU 116          HD13      LEU 116 119.500  16.314  -6.197
  929   HD21  LEU 116          HD21      LEU 116 118.198  18.484  -8.825
  930   HD22  LEU 116          HD22      LEU 116 119.257  19.614  -7.980
  931   HD23  LEU 116          HD23      LEU 116 117.507  19.724  -7.778
  932    H    ALA 117           HN       ALA 117 114.934  15.482  -5.970
  933    HA   ALA 117           HA       ALA 117 112.980  16.768  -4.402
  934    HB1  ALA 117           HB1      ALA 117 113.037  13.987  -5.568
  935    HB2  ALA 117           HB2      ALA 117 112.412  15.444  -6.341
  936    HB3  ALA 117           HB3      ALA 117 111.603  14.784  -4.919
  937    H    LEU 118           HN       LEU 118 114.510  13.585  -3.904
  938    HA   LEU 118           HA       LEU 118 113.274  12.992  -1.478
  939    HB2  LEU 118           HB2      LEU 118 116.054  12.091  -2.203
  940    HB3  LEU 118           HB1      LEU 118 114.837  11.231  -1.261
  941    HG   LEU 118           HG       LEU 118 114.768  11.841  -4.226
  942   HD11  LEU 118          HD11      LEU 118 114.518   9.333  -4.324
  943   HD12  LEU 118          HD12      LEU 118 114.816   9.291  -2.586
  944   HD13  LEU 118          HD13      LEU 118 116.068   9.875  -3.681
  945   HD21  LEU 118          HD21      LEU 118 112.558  10.505  -4.052
  946   HD22  LEU 118          HD22      LEU 118 112.526  12.188  -3.527
  947   HD23  LEU 118          HD23      LEU 118 112.610  10.894  -2.332
  948    H    LEU 119           HN       LEU 119 116.492  14.482  -1.997
  949    HA   LEU 119           HA       LEU 119 116.968  14.730   0.819
  950    HB2  LEU 119           HB2      LEU 119 118.316  15.634  -1.679
  951    HB3  LEU 119           HB1      LEU 119 118.703  16.509  -0.201
  952    HG   LEU 119           HG       LEU 119 120.218  14.546  -0.686
  953   HD11  LEU 119          HD11      LEU 119 119.461  15.514   1.685
  954   HD12  LEU 119          HD12      LEU 119 120.501  14.098   1.560
  955   HD13  LEU 119          HD13      LEU 119 118.775  13.898   1.856
  956   HD21  LEU 119          HD21      LEU 119 118.094  13.183  -1.469
  957   HD22  LEU 119          HD22      LEU 119 117.984  12.759   0.239
  958   HD23  LEU 119          HD23      LEU 119 119.432  12.351  -0.679
  959    H    VAL 120           HN       VAL 120 116.159  17.145  -1.693
  960    HA   VAL 120           HA       VAL 120 116.098  19.328  -0.073
  961    HB   VAL 120           HB       VAL 120 114.339  18.759  -2.466
  962   HG11  VAL 120          HG11      VAL 120 114.798  21.263  -0.846
  963   HG12  VAL 120          HG12      VAL 120 113.271  20.574  -1.397
  964   HG13  VAL 120          HG13      VAL 120 114.356  21.349  -2.551
  965   HG21  VAL 120          HG21      VAL 120 116.058  19.736  -3.743
  966   HG22  VAL 120          HG22      VAL 120 116.957  18.796  -2.554
  967   HG23  VAL 120          HG23      VAL 120 116.773  20.537  -2.344
  968    H    SER 121           HN       SER 121 114.046  16.679   0.199
  969    HA   SER 121           HA       SER 121 111.732  18.120   1.228
  970    HB2  SER 121           HB2      SER 121 111.593  15.883   0.031
  971    HB3  SER 121           HB1      SER 121 112.331  15.162   1.459
  972    HG   SER 121           HG       SER 121 109.915  15.292   1.292
  973    H    ALA 122           HN       ALA 122 114.452  16.234   2.400
  974    HA   ALA 122           HA       ALA 122 114.026  17.332   5.115
  975    HB1  ALA 122           HB1      ALA 122 115.119  14.562   4.651
  976    HB2  ALA 122           HB2      ALA 122 113.386  14.846   4.802
  977    HB3  ALA 122           HB3      ALA 122 114.465  15.255   6.135
  978    H    HIS 123           HN       HIS 123 116.426  15.664   5.898
  979    HA   HIS 123           HA       HIS 123 118.721  16.079   4.527
  980    HB2  HIS 123           HB2      HIS 123 119.603  18.265   5.356
  981    HB3  HIS 123           HB1      HIS 123 118.201  18.472   4.315
  982    HD2  HIS 123           HD2      HIS 123 117.874  20.935   6.010
  983    HE1  HIS 123           HE1      HIS 123 116.137  18.702   9.147
  984    HE2  HIS 123           HE2      HIS 123 116.514  21.047   8.240
  985    H    ASP 124           HN       ASP 124 120.345  17.348   6.622
  986    HA   ASP 124           HA       ASP 124 120.018  15.328   8.762
  987    HB2  ASP 124           HB2      ASP 124 122.606  16.644   7.944
  988    HB3  ASP 124           HB1      ASP 124 122.384  15.224   8.964
  989    H    ASP 125           HN       ASP 125 118.831  18.019   8.668
  990    HA   ASP 125           HA       ASP 125 120.019  19.059  11.160
  991    HB2  ASP 125           HB2      ASP 125 119.183  20.793   8.823
  992    HB3  ASP 125           HB1      ASP 125 119.836  21.350  10.364
  993   H5'1  C2E 501          H5'1      C2E 501 105.374   3.184  10.587
  994   H5'2  C2E 501          H5'2      C2E 501 104.588   1.781  11.331
  995    H4'  C2E 501           H4'      C2E 501 106.860   0.577  10.613
  996    H3'  C2E 501           H3'      C2E 501 106.742   3.026   8.863
  997    H2'  C2E 501           H2'      C2E 501 106.980   1.820   6.872
  998   HO2'  C2E 501          HO2'      C2E 501 107.206  -0.707   7.479
  999    H1'  C2E 501           H1'      C2E 501 105.232  -0.141   7.374
 1000    H8   C2E 501           H8       C2E 501 103.583   2.454   9.398
 1001    HN1  C2E 501           HN1      C2E 501 103.294   3.949   3.190
 1002   HN21  C2E 501          HN21      C2E 501 104.690   2.668   2.033
 1003   HN22  C2E 501          HN22      C2E 501 105.682   1.441   2.788
 1004   H511  C2E 501          H511      C2E 501 108.213   4.327  10.359
 1005   H512  C2E 501          H512      C2E 501 109.875   4.292  10.981
 1006    H4A  C2E 501           H4A      C2E 501 108.950   4.961  13.239
 1007    H3A  C2E 501           H3A      C2E 501 106.334   5.090  11.728
 1008    H2A  C2E 501           H2A      C2E 501 105.777   7.084  12.766
 1009   HO2A  C2E 501          HO2A      C2E 501 107.773   6.309  14.616
 1010    H1A  C2E 501           H1A      C2E 501 108.208   8.322  12.631
 1011    H81  C2E 501           H81      C2E 501 108.326   6.454   9.442
 1012   HN11  C2E 501          HN11      C2E 501 104.338  11.450   9.056
 1013   HN24  C2E 501          HN24      C2E 501 104.540  11.507  12.536
 1014   HN23  C2E 501          HN23      C2E 501 103.868  12.214  11.083
 1015   H5'1  C2E 502          H5'1      C2E 502 101.580  10.925   4.950
 1016   H5'2  C2E 502          H5'2      C2E 502  99.938  11.553   4.699
 1017    H4'  C2E 502           H4'      C2E 502  99.717  12.149   7.003
 1018    H3'  C2E 502           H3'      C2E 502 102.674  11.579   7.195
 1019    H2'  C2E 502           H2'      C2E 502 102.301  11.023   9.507
 1020   HO2'  C2E 502          HO2'      C2E 502 100.591  12.819   9.605
 1021    H1'  C2E 502           H1'      C2E 502 100.133   9.472   9.024
 1022    H8   C2E 502           H8       C2E 502 102.371   8.851   6.029
 1023    HN1  C2E 502           HN1      C2E 502 104.204   5.758  11.320
 1024   HN21  C2E 502          HN21      C2E 502 103.090   6.498  13.076
 1025   HN22  C2E 502          HN22      C2E 502 101.889   7.766  12.962
 1026   H511  C2E 502          H511      C2E 502 105.275  15.379   7.502
 1027   H512  C2E 502          H512      C2E 502 104.447  16.844   6.939
 1028    H4A  C2E 502           H4A      C2E 502 104.716  16.314   4.731
 1029    H3A  C2E 502           H3A      C2E 502 104.364  13.422   5.551
 1030    H2A  C2E 502           H2A      C2E 502 105.638  12.713   3.702
 1031   HO2A  C2E 502          HO2A      C2E 502 105.977  13.973   1.899
 1032    H1A  C2E 502           H1A      C2E 502 107.568  14.676   3.764
 1033    H81  C2E 502           H81      C2E 502 106.881  13.742   7.328
 1034   HN11  C2E 502          HN11      C2E 502 110.602   9.573   4.204
 1035   HN24  C2E 502          HN24      C2E 502 110.495   9.955   2.014
 1036   HN23  C2E 502          HN23      C2E 502 109.517  11.236   1.335
  Start of MODEL    9
    1    H    MET   1           H        MET   1 114.484  25.135   0.441
    2    HA   MET   1           HA       MET   1 112.489  24.742  -0.583
    3    HB2  MET   1           HB2      MET   1 113.943  22.406  -1.831
    4    HB3  MET   1           HB1      MET   1 112.188  22.564  -1.922
    5    HG2  MET   1           HG2      MET   1 112.340  24.640  -3.099
    6    HG3  MET   1           HG1      MET   1 114.065  24.783  -2.761
    7    HE1  MET   1           HE1      MET   1 113.976  25.470  -5.159
    8    HE2  MET   1           HE2      MET   1 112.503  24.807  -5.861
    9    HE3  MET   1           HE3      MET   1 114.068  24.370  -6.541
   10    H    SER   2           HN       SER   2 110.703  23.289   0.022
   11    HA   SER   2           HA       SER   2 111.108  22.227   2.661
   12    HB2  SER   2           HB2      SER   2 108.719  22.349   0.823
   13    HB3  SER   2           HB1      SER   2 108.659  21.584   2.408
   14    HG   SER   2           HG       SER   2 109.438  23.606   3.257
   15    H    ASP   3           HN       ASP   3 112.707  20.846   0.806
   16    HA   ASP   3           HA       ASP   3 111.406  18.308   0.222
   17    HB2  ASP   3           HB2      ASP   3 114.256  19.262  -0.133
   18    HB3  ASP   3           HB1      ASP   3 113.675  17.670  -0.618
   19    H    GLN   4           HN       GLN   4 111.876  19.405   3.009
   20    HA   GLN   4           HA       GLN   4 113.451  17.154   4.115
   21    HB2  GLN   4           HB2      GLN   4 114.391  19.282   4.713
   22    HB3  GLN   4           HB1      GLN   4 112.827  19.882   5.257
   23    HG2  GLN   4           HG2      GLN   4 113.821  17.349   6.492
   24    HG3  GLN   4           HG1      GLN   4 114.634  18.839   6.958
   25   HE21  GLN   4          HE21      GLN   4 111.304  19.231   6.054
   26   HE22  GLN   4          HE22      GLN   4 110.683  19.371   7.627
   27    H    HIS   5           HN       HIS   5 110.394  18.751   3.990
   28    HA   HIS   5           HA       HIS   5 108.638  18.503   5.696
   29    HB2  HIS   5           HB2      HIS   5 107.478  16.410   4.528
   30    HB3  HIS   5           HB1      HIS   5 107.598  17.973   3.727
   31    HD2  HIS   5           HD2      HIS   5 110.696  15.519   3.920
   32    HE1  HIS   5           HE1      HIS   5 109.501  15.865  -0.113
   33    HE2  HIS   5           HE2      HIS   5 111.263  14.912   1.447
   34    H    ASP   6           HN       ASP   6 110.292  17.819   7.466
   35    HA   ASP   6           HA       ASP   6 111.125  16.171   8.939
   36    HB2  ASP   6           HB2      ASP   6 108.112  16.136   9.090
   37    HB3  ASP   6           HB1      ASP   6 109.153  15.361  10.282
   38    H    GLU   7           HN       GLU   7 112.112  14.512   7.711
   39    HA   GLU   7           HA       GLU   7 110.366  12.340   6.797
   40    HB2  GLU   7           HB2      GLU   7 111.785  12.744   5.040
   41    HB3  GLU   7           HB1      GLU   7 113.098  13.274   6.090
   42    HG2  GLU   7           HG2      GLU   7 113.796  11.087   6.552
   43    HG3  GLU   7           HG1      GLU   7 112.234  10.391   6.135
   44    H    ARG   8           HN       ARG   8 110.161  10.497   7.875
   45    HA   ARG   8           HA       ARG   8 112.133   9.883   9.995
   46    HB2  ARG   8           HB2      ARG   8 109.135   9.646  10.058
   47    HB3  ARG   8           HB1      ARG   8 110.195   8.821  11.193
   48    HG2  ARG   8           HG2      ARG   8 109.646  10.815  12.313
   49    HG3  ARG   8           HG1      ARG   8 111.242  11.128  11.646
   50    HD2  ARG   8           HD2      ARG   8 109.225  12.862  11.364
   51    HD3  ARG   8           HD1      ARG   8 110.460  12.672  10.133
   52    HE   ARG   8           HE       ARG   8 108.713  10.952   9.195
   53   HH11  ARG   8          HH21      ARG   8 108.093  13.969  10.784
   54   HH12  ARG   8          HH22      ARG   8 106.654  14.299   9.881
   55   HH21  ARG   8          HH11      ARG   8 106.847  11.400   7.999
   56   HH22  ARG   8          HH12      ARG   8 105.947  12.846   8.311
   57    H    ARG   9           HN       ARG   9 110.839   8.813   7.102
   58    HA   ARG   9           HA       ARG   9 111.227   5.968   7.851
   59    HB2  ARG   9           HB2      ARG   9 110.085   5.751   5.416
   60    HB3  ARG   9           HB1      ARG   9 109.155   5.831   6.907
   61    HG2  ARG   9           HG2      ARG   9 109.005   8.307   6.628
   62    HG3  ARG   9           HG1      ARG   9 109.810   8.133   5.072
   63    HD2  ARG   9           HD2      ARG   9 107.996   7.039   4.102
   64    HD3  ARG   9           HD1      ARG   9 107.350   6.513   5.653
   65    HE   ARG   9           HE       ARG   9 106.914   9.047   5.980
   66   HH11  ARG   9          HH21      ARG   9 106.798   7.330   2.962
   67   HH12  ARG   9          HH22      ARG   9 105.669   8.422   2.235
   68   HH21  ARG   9          HH11      ARG   9 105.438  10.473   5.015
   69   HH22  ARG   9          HH12      ARG   9 104.898  10.192   3.393
   70    H    ARG  10           HN       ARG  10 113.454   6.137   7.742
   71    HA   ARG  10           HA       ARG  10 115.516   6.614   6.645
   72    HB2  ARG  10           HB2      ARG  10 115.635   4.485   4.977
   73    HB3  ARG  10           HB1      ARG  10 115.778   4.356   6.725
   74    HG2  ARG  10           HG2      ARG  10 113.027   4.290   5.529
   75    HG3  ARG  10           HG1      ARG  10 114.038   2.856   5.389
   76    HD2  ARG  10           HD2      ARG  10 114.159   2.551   7.707
   77    HD3  ARG  10           HD1      ARG  10 113.740   4.225   8.050
   78    HE   ARG  10           HE       ARG  10 111.475   3.676   7.795
   79   HH11  ARG  10          HH21      ARG  10 113.573   1.104   6.821
   80   HH12  ARG  10          HH22      ARG  10 112.311  -0.078   6.729
   81   HH21  ARG  10          HH11      ARG  10 109.810   2.130   7.675
   82   HH22  ARG  10          HH12      ARG  10 110.181   0.502   7.214
   83    H    PHE  11           HN       PHE  11 113.991   5.130   3.836
   84    HA   PHE  11           HA       PHE  11 114.521   7.614   2.315
   85    HB2  PHE  11           HB2      PHE  11 115.755   5.157   1.969
   86    HB3  PHE  11           HB1      PHE  11 114.482   5.126   0.752
   87    HD1  PHE  11           HD1      PHE  11 117.353   7.138   2.035
   88    HD2  PHE  11           HD2      PHE  11 114.640   6.439  -1.222
   89    HE1  PHE  11           HE1      PHE  11 118.699   8.645   0.591
   90    HE2  PHE  11           HE2      PHE  11 115.983   7.942  -2.663
   91    HZ   PHE  11           HZ       PHE  11 118.012   9.047  -1.756
   92    H    HIS  12           HN       HIS  12 113.102   8.051   0.550
   93    HA   HIS  12           HA       HIS  12 110.414   7.936   1.061
   94    HB2  HIS  12           HB2      HIS  12 111.622   7.888  -1.710
   95    HB3  HIS  12           HB1      HIS  12 110.055   8.551  -1.244
   96    HD2  HIS  12           HD2      HIS  12 111.831  10.868  -2.436
   97    HE1  HIS  12           HE1      HIS  12 113.096  11.765   1.491
   98    HE2  HIS  12           HE2      HIS  12 112.954  12.645  -0.887
   99    H    ARG  13           HN       ARG  13 108.733   6.854  -0.413
  100    HA   ARG  13           HA       ARG  13 109.374   3.971  -0.654
  101    HB2  ARG  13           HB2      ARG  13 106.525   4.706  -0.325
  102    HB3  ARG  13           HB1      ARG  13 107.452   3.409   0.424
  103    HG2  ARG  13           HG2      ARG  13 108.404   4.916   2.047
  104    HG3  ARG  13           HG1      ARG  13 107.734   6.321   1.216
  105    HD2  ARG  13           HD2      ARG  13 105.919   4.139   2.213
  106    HD3  ARG  13           HD1      ARG  13 106.484   5.399   3.307
  107    HE   ARG  13           HE       ARG  13 105.342   6.384   0.827
  108   HH11  ARG  13          HH21      ARG  13 104.816   5.405   4.102
  109   HH12  ARG  13          HH22      ARG  13 103.366   6.334   4.291
  110   HH21  ARG  13          HH11      ARG  13 103.445   7.605   1.065
  111   HH22  ARG  13          HH12      ARG  13 102.590   7.581   2.570
  112    H    ILE  14           HN       ILE  14 107.463   2.933  -2.042
  113    HA   ILE  14           HA       ILE  14 107.634   4.248  -4.651
  114    HB   ILE  14           HB       ILE  14 106.680   1.514  -3.796
  115   HG12  ILE  14          HG12      ILE  14 108.709   0.791  -5.067
  116   HG13  ILE  14          HG11      ILE  14 109.135   2.487  -5.293
  117   HG21  ILE  14          HG21      ILE  14 106.311   3.012  -6.302
  118   HG22  ILE  14          HG22      ILE  14 105.506   1.548  -5.742
  119   HG23  ILE  14          HG23      ILE  14 107.075   1.442  -6.535
  120   HD11  ILE  14          HD11      ILE  14 108.596   1.529  -2.505
  121   HD12  ILE  14          HD12      ILE  14 109.701   2.783  -3.067
  122   HD13  ILE  14          HD13      ILE  14 110.125   1.084  -3.259
  123    H    ALA  15           HN       ALA  15 106.131   5.912  -4.532
  124    HA   ALA  15           HA       ALA  15 103.391   5.251  -3.748
  125    HB1  ALA  15           HB1      ALA  15 104.820   7.829  -4.359
  126    HB2  ALA  15           HB2      ALA  15 104.084   7.313  -2.841
  127    HB3  ALA  15           HB3      ALA  15 103.064   7.753  -4.213
  128    H    PHE  16           HN       PHE  16 101.976   4.607  -5.142
  129    HA   PHE  16           HA       PHE  16 101.773   5.821  -7.765
  130    HB2  PHE  16           HB2      PHE  16 101.839   3.798  -9.030
  131    HB3  PHE  16           HB1      PHE  16 103.301   3.827  -8.052
  132    HD1  PHE  16           HD2      PHE  16 102.520   2.900  -5.432
  133    HD2  PHE  16           HD1      PHE  16 101.096   1.612  -9.277
  134    HE1  PHE  16           HE2      PHE  16 101.926   0.696  -4.477
  135    HE2  PHE  16           HE1      PHE  16 100.514  -0.597  -8.319
  136    HZ   PHE  16           HZ       PHE  16 100.935  -1.056  -5.920
  137    H    ASP  17           HN       ASP  17  99.636   5.397  -8.724
  138    HA   ASP  17           HA       ASP  17  97.684   4.932  -6.591
  139    HB2  ASP  17           HB2      ASP  17  97.698   6.385  -9.191
  140    HB3  ASP  17           HB1      ASP  17  96.160   5.700  -8.668
  141    H    ALA  18           HN       ALA  18  95.985   3.473  -6.770
  142    HA   ALA  18           HA       ALA  18  95.365   1.872  -8.954
  143    HB1  ALA  18           HB1      ALA  18  96.363  -0.321  -8.005
  144    HB2  ALA  18           HB2      ALA  18  97.475   0.731  -7.128
  145    HB3  ALA  18           HB3      ALA  18  97.445   0.755  -8.891
  146    H    ASP  19           HN       ASP  19  94.301  -0.296  -8.080
  147    HA   ASP  19           HA       ASP  19  92.507   0.599  -5.909
  148    HB2  ASP  19           HB2      ASP  19  91.551  -0.180  -8.095
  149    HB3  ASP  19           HB1      ASP  19  92.196  -1.784  -7.753
  150    H    SER  20           HN       SER  20  92.431  -0.361  -3.959
  151    HA   SER  20           HA       SER  20  93.816  -2.941  -3.608
  152    HB2  SER  20           HB2      SER  20  94.629  -2.032  -1.379
  153    HB3  SER  20           HB1      SER  20  95.427  -1.389  -2.811
  154    HG   SER  20           HG       SER  20  94.201  -0.042  -0.932
  155    H    GLU  21           HN       GLU  21  93.075  -4.166  -1.823
  156    HA   GLU  21           HA       GLU  21  90.545  -3.270  -0.576
  157    HB2  GLU  21           HB2      GLU  21  90.997  -6.013  -1.791
  158    HB3  GLU  21           HB1      GLU  21  89.537  -5.453  -0.973
  159    HG2  GLU  21           HG2      GLU  21  89.353  -3.637  -2.705
  160    HG3  GLU  21           HG1      GLU  21  90.686  -4.399  -3.568
  161    H    ILE  22           HN       ILE  22  90.206  -4.055   1.486
  162    HA   ILE  22           HA       ILE  22  92.446  -5.634   2.616
  163    HB   ILE  22           HB       ILE  22  90.977  -3.293   3.846
  164   HG12  ILE  22          HG12      ILE  22  93.137  -3.271   2.090
  165   HG13  ILE  22          HG11      ILE  22  92.697  -1.970   3.189
  166   HG21  ILE  22          HG21      ILE  22  93.082  -5.155   4.980
  167   HG22  ILE  22          HG22      ILE  22  91.439  -4.911   5.571
  168   HG23  ILE  22          HG23      ILE  22  92.632  -3.622   5.726
  169   HD11  ILE  22          HD11      ILE  22  94.556  -4.247   3.923
  170   HD12  ILE  22          HD12      ILE  22  94.216  -2.806   4.883
  171   HD13  ILE  22          HD13      ILE  22  95.097  -2.664   3.364
  172    H    LEU  23           HN       LEU  23  91.991  -7.267   3.888
  173    HA   LEU  23           HA       LEU  23  89.152  -7.757   4.602
  174    HB2  LEU  23           HB2      LEU  23  91.058 -10.018   4.163
  175    HB3  LEU  23           HB1      LEU  23  89.310  -9.958   3.948
  176    HG   LEU  23           HG       LEU  23  90.002  -8.159   2.079
  177   HD11  LEU  23          HD11      LEU  23  92.370  -8.223   2.331
  178   HD12  LEU  23          HD12      LEU  23  92.017  -9.155   0.877
  179   HD13  LEU  23          HD13      LEU  23  92.391  -9.985   2.386
  180   HD21  LEU  23          HD21      LEU  23  89.795  -9.959   0.430
  181   HD22  LEU  23          HD22      LEU  23  88.678 -10.261   1.760
  182   HD23  LEU  23          HD23      LEU  23  90.189 -11.161   1.656
  183    H    GLN  24           HN       GLN  24  88.804  -7.908   6.661
  184    HA   GLN  24           HA       GLN  24  90.952  -8.935   8.437
  185    HB2  GLN  24           HB2      GLN  24  90.719  -6.435   8.591
  186    HB3  GLN  24           HB1      GLN  24  89.066  -6.672   9.149
  187    HG2  GLN  24           HG2      GLN  24  91.125  -8.264  10.583
  188    HG3  GLN  24           HG1      GLN  24  91.224  -6.523  10.820
  189   HE21  GLN  24          HE21      GLN  24  90.271  -6.213  12.863
  190   HE22  GLN  24          HE22      GLN  24  88.733  -6.793  13.291
  191    H    GLY  25           HN       GLY  25  90.071 -10.950   8.846
  192    HA2  GLY  25           HA2      GLY  25  88.707 -12.402  10.029
  193    HA3  GLY  25           HA1      GLY  25  87.673 -11.041  10.460
  194    H    GLU  26           HN       GLU  26  85.671 -11.425   9.732
  195    HA   GLU  26           HA       GLU  26  85.290 -12.789   7.145
  196    HB2  GLU  26           HB2      GLU  26  82.968 -13.065   7.882
  197    HB3  GLU  26           HB1      GLU  26  84.088 -13.696   9.091
  198    HG2  GLU  26           HG2      GLU  26  83.934 -11.313  10.138
  199    HG3  GLU  26           HG1      GLU  26  82.472 -11.156   9.166
  200    H    ARG  27           HN       ARG  27  85.904  -9.782   7.932
  201    HA   ARG  27           HA       ARG  27  83.706  -8.564   6.367
  202    HB2  ARG  27           HB2      ARG  27  85.646  -7.122   8.143
  203    HB3  ARG  27           HB1      ARG  27  84.128  -6.537   7.467
  204    HG2  ARG  27           HG2      ARG  27  83.093  -7.233   9.349
  205    HG3  ARG  27           HG1      ARG  27  83.454  -8.893   8.870
  206    HD2  ARG  27           HD2      ARG  27  85.724  -8.591   9.924
  207    HD3  ARG  27           HD1      ARG  27  85.144  -7.065  10.580
  208    HE   ARG  27           HE       ARG  27  83.259  -8.744  11.471
  209   HH11  ARG  27          HH21      ARG  27  86.709  -9.017  11.353
  210   HH12  ARG  27          HH22      ARG  27  86.814 -10.036  12.749
  211   HH21  ARG  27          HH11      ARG  27  83.390 -10.080  13.301
  212   HH22  ARG  27          HH12      ARG  27  84.934 -10.638  13.853
  213    H    ARG  28           HN       ARG  28  84.156  -7.603   4.475
  214    HA   ARG  28           HA       ARG  28  86.978  -7.015   3.782
  215    HB2  ARG  28           HB2      ARG  28  86.041  -9.076   2.617
  216    HB3  ARG  28           HB1      ARG  28  84.878  -8.006   1.837
  217    HG2  ARG  28           HG2      ARG  28  87.111  -6.632   1.253
  218    HG3  ARG  28           HG1      ARG  28  87.830  -8.225   1.417
  219    HD2  ARG  28           HD2      ARG  28  85.635  -8.801  -0.120
  220    HD3  ARG  28           HD1      ARG  28  86.027  -7.178  -0.677
  221    HE   ARG  28           HE       ARG  28  88.104  -7.990  -1.487
  222   HH11  ARG  28          HH21      ARG  28  86.222 -10.401   0.151
  223   HH12  ARG  28          HH22      ARG  28  87.140 -11.732  -0.470
  224   HH21  ARG  28          HH11      ARG  28  89.307  -9.736  -2.296
  225   HH22  ARG  28          HH12      ARG  28  88.883 -11.356  -1.852
  226    H    TRP  29           HN       TRP  29  87.344  -5.215   2.544
  227    HA   TRP  29           HA       TRP  29  85.078  -3.498   1.844
  228    HB2  TRP  29           HB2      TRP  29  87.393  -2.648   3.583
  229    HB3  TRP  29           HB1      TRP  29  86.089  -1.604   3.019
  230    HD1  TRP  29           HD1      TRP  29  83.532  -2.527   3.825
  231    HE1  TRP  29           HE1      TRP  29  82.873  -3.385   6.171
  232    HE3  TRP  29           HE3      TRP  29  88.136  -3.771   5.620
  233    HZ2  TRP  29           HZ2      TRP  29  84.152  -4.453   8.504
  234    HZ3  TRP  29           HZ3      TRP  29  88.396  -4.700   7.902
  235    HH2  TRP  29           HH2      TRP  29  86.410  -5.047   9.344
  236    H    GLU  30           HN       GLU  30  85.666  -1.811   0.375
  237    HA   GLU  30           HA       GLU  30  88.066  -2.457  -1.189
  238    HB2  GLU  30           HB2      GLU  30  85.507  -0.991  -1.822
  239    HB3  GLU  30           HB1      GLU  30  86.920  -0.874  -2.872
  240    HG2  GLU  30           HG2      GLU  30  85.527  -2.667  -3.702
  241    HG3  GLU  30           HG1      GLU  30  86.962  -3.389  -2.975
  242    H    VAL  31           HN       VAL  31  89.723  -0.935  -1.430
  243    HA   VAL  31           HA       VAL  31  89.281   1.813  -0.483
  244    HB   VAL  31           HB       VAL  31  91.401   1.657   0.865
  245   HG11  VAL  31          HG11      VAL  31  89.132   1.592   1.886
  246   HG12  VAL  31          HG12      VAL  31  90.305   0.640   2.797
  247   HG13  VAL  31          HG13      VAL  31  89.143  -0.167   1.746
  248   HG21  VAL  31          HG21      VAL  31  92.110  -0.503  -0.304
  249   HG22  VAL  31          HG22      VAL  31  90.918  -1.327   0.701
  250   HG23  VAL  31          HG23      VAL  31  92.278  -0.493   1.452
  251    H    LEU  32           HN       LEU  32  90.928   3.278  -1.118
  252    HA   LEU  32           HA       LEU  32  92.296   2.465  -3.601
  253    HB2  LEU  32           HB2      LEU  32  91.056   4.448  -3.953
  254    HB3  LEU  32           HB1      LEU  32  91.474   5.104  -2.375
  255    HG   LEU  32           HG       LEU  32  93.795   5.443  -3.101
  256   HD11  LEU  32          HD11      LEU  32  94.441   3.902  -4.671
  257   HD12  LEU  32          HD12      LEU  32  93.937   5.163  -5.792
  258   HD13  LEU  32          HD13      LEU  32  92.845   3.830  -5.417
  259   HD21  LEU  32          HD21      LEU  32  91.997   7.157  -3.567
  260   HD22  LEU  32          HD22      LEU  32  91.893   6.510  -5.204
  261   HD23  LEU  32          HD23      LEU  32  93.390   7.253  -4.644
  262    H    LEU  33           HN       LEU  33  94.482   2.203  -3.613
  263    HA   LEU  33           HA       LEU  33  95.891   2.687  -1.089
  264    HB2  LEU  33           HB2      LEU  33  96.310   0.514  -1.945
  265    HB3  LEU  33           HB1      LEU  33  96.575   1.113  -3.579
  266    HG   LEU  33           HG       LEU  33  98.402   2.297  -1.571
  267   HD11  LEU  33          HD11      LEU  33  98.129  -0.060  -0.720
  268   HD12  LEU  33          HD12      LEU  33  99.763   0.336  -1.244
  269   HD13  LEU  33          HD13      LEU  33  98.716  -0.630  -2.282
  270   HD21  LEU  33          HD21      LEU  33  98.642   2.598  -4.012
  271   HD22  LEU  33          HD22      LEU  33  98.815   0.855  -4.211
  272   HD23  LEU  33          HD23      LEU  33 100.046   1.769  -3.339
  273    H    HIS  34           HN       HIS  34  97.110   4.369  -0.782
  274    HA   HIS  34           HA       HIS  34  97.657   6.176  -3.005
  275    HB2  HIS  34           HB2      HIS  34  97.796   6.380  -0.003
  276    HB3  HIS  34           HB1      HIS  34  98.465   7.646  -1.041
  277    HD2  HIS  34           HD2      HIS  34  94.947   6.125  -0.106
  278    HE1  HIS  34           HE1      HIS  34  94.305   9.619  -2.382
  279    HE2  HIS  34           HE2      HIS  34  93.172   7.813  -1.005
  280    H    ASP  35           HN       ASP  35  99.463   3.975  -0.947
  281    HA   ASP  35           HA       ASP  35 101.604   4.059  -2.753
  282    HB2  ASP  35           HB2      ASP  35 103.358   5.204  -1.514
  283    HB3  ASP  35           HB1      ASP  35 101.975   6.294  -1.636
  284    H    VAL  36           HN       VAL  36 103.498   2.777  -2.066
  285    HA   VAL  36           HA       VAL  36 103.026   1.023   0.226
  286    HB   VAL  36           HB       VAL  36 101.923   0.081  -1.904
  287   HG11  VAL  36          HG11      VAL  36 103.941   0.769  -3.321
  288   HG12  VAL  36          HG12      VAL  36 103.337  -0.870  -3.571
  289   HG13  VAL  36          HG13      VAL  36 104.784  -0.603  -2.602
  290   HG21  VAL  36          HG21      VAL  36 102.473  -2.147  -1.291
  291   HG22  VAL  36          HG22      VAL  36 102.669  -1.215   0.190
  292   HG23  VAL  36          HG23      VAL  36 104.085  -1.686  -0.748
  293    H    SER  37           HN       SER  37 104.845  -0.547   0.487
  294    HA   SER  37           HA       SER  37 107.418   0.387  -0.540
  295    HB2  SER  37           HB2      SER  37 107.022   1.551   1.651
  296    HB3  SER  37           HB1      SER  37 106.863  -0.027   2.413
  297    HG   SER  37           HG       SER  37 109.003  -0.451   1.457
  298    H    LEU  38           HN       LEU  38 109.138  -1.308   0.132
  299    HA   LEU  38           HA       LEU  38 108.143  -3.837  -0.622
  300    HB2  LEU  38           HB2      LEU  38 110.467  -3.167  -1.080
  301    HB3  LEU  38           HB1      LEU  38 110.806  -3.121   0.648
  302    HG   LEU  38           HG       LEU  38 110.507  -5.501   0.853
  303   HD11  LEU  38          HD11      LEU  38 109.380  -5.261  -1.935
  304   HD12  LEU  38          HD12      LEU  38 108.666  -6.041  -0.522
  305   HD13  LEU  38          HD13      LEU  38 110.023  -6.796  -1.355
  306   HD21  LEU  38          HD21      LEU  38 112.647  -4.584  -0.194
  307   HD22  LEU  38          HD22      LEU  38 111.993  -5.096  -1.750
  308   HD23  LEU  38          HD23      LEU  38 112.317  -6.291  -0.494
  309    H    HIS  39           HN       HIS  39 107.721  -2.275   2.233
  310    HA   HIS  39           HA       HIS  39 106.904  -4.703   3.558
  311    HB2  HIS  39           HB2      HIS  39 108.317  -4.196   5.609
  312    HB3  HIS  39           HB1      HIS  39 109.177  -4.860   4.221
  313    HD2  HIS  39           HD2      HIS  39 108.471  -1.157   5.552
  314    HE1  HIS  39           HE1      HIS  39 112.298  -1.307   3.778
  315    HE2  HIS  39           HE2      HIS  39 110.640   0.184   4.993
  316    H    GLY  40           HN       GLY  40 105.462  -2.403   2.737
  317    HA2  GLY  40           HA2      GLY  40 104.000  -1.821   5.081
  318    HA3  GLY  40           HA1      GLY  40 105.073  -0.471   4.739
  319    H    ILE  41           HN       ILE  41 102.178  -0.399   4.684
  320    HA   ILE  41           HA       ILE  41 101.802   0.577   1.934
  321    HB   ILE  41           HB       ILE  41 100.704  -1.289   1.335
  322   HG12  ILE  41          HG12      ILE  41  98.665  -0.454   3.426
  323   HG13  ILE  41          HG11      ILE  41  98.804   0.274   1.826
  324   HG21  ILE  41          HG21      ILE  41 100.000  -3.023   2.966
  325   HG22  ILE  41          HG22      ILE  41 100.488  -1.954   4.281
  326   HG23  ILE  41          HG23      ILE  41 101.693  -2.571   3.149
  327   HD11  ILE  41          HD11      ILE  41  97.136  -1.362   1.539
  328   HD12  ILE  41          HD12      ILE  41  97.980  -2.531   2.552
  329   HD13  ILE  41          HD13      ILE  41  98.591  -2.157   0.940
  330    H    LEU  42           HN       LEU  42 100.253   2.092   1.656
  331    HA   LEU  42           HA       LEU  42  98.972   3.194   4.095
  332    HB2  LEU  42           HB2      LEU  42 100.934   4.454   2.661
  333    HB3  LEU  42           HB1      LEU  42  99.498   5.027   1.821
  334    HG   LEU  42           HG       LEU  42  99.813   5.163   4.828
  335   HD11  LEU  42          HD11      LEU  42 100.173   7.426   2.852
  336   HD12  LEU  42          HD12      LEU  42 101.531   6.513   3.509
  337   HD13  LEU  42          HD13      LEU  42 100.495   7.449   4.585
  338   HD21  LEU  42          HD21      LEU  42  97.913   6.428   2.838
  339   HD22  LEU  42          HD22      LEU  42  98.016   6.887   4.538
  340   HD23  LEU  42          HD23      LEU  42  97.509   5.260   4.096
  341    H    VAL  43           HN       VAL  43  96.785   3.490   3.925
  342    HA   VAL  43           HA       VAL  43  95.590   3.446   1.228
  343    HB   VAL  43           HB       VAL  43  93.877   1.846   1.972
  344   HG11  VAL  43          HG11      VAL  43  96.142   1.168   0.939
  345   HG12  VAL  43          HG12      VAL  43  95.222  -0.093   1.761
  346   HG13  VAL  43          HG13      VAL  43  96.594   0.668   2.569
  347   HG21  VAL  43          HG21      VAL  43  93.792   2.206   4.331
  348   HG22  VAL  43          HG22      VAL  43  95.523   1.913   4.508
  349   HG23  VAL  43          HG23      VAL  43  94.437   0.577   4.128
  350    H    GLY  44           HN       GLY  44  93.131   3.757   1.448
  351    HA2  GLY  44           HA2      GLY  44  92.688   6.147   3.147
  352    HA3  GLY  44           HA1      GLY  44  91.740   5.707   1.724
  353    H    GLN  45           HN       GLN  45  90.924   6.190   4.682
  354    HA   GLN  45           HA       GLN  45  90.097   3.568   5.523
  355    HB2  GLN  45           HB2      GLN  45  89.307   4.642   7.505
  356    HB3  GLN  45           HB1      GLN  45  90.856   5.359   7.082
  357    HG2  GLN  45           HG2      GLN  45  89.681   7.297   7.444
  358    HG3  GLN  45           HG1      GLN  45  89.275   7.063   5.747
  359   HE21  GLN  45          HE21      GLN  45  88.012   5.370   8.669
  360   HE22  GLN  45          HE22      GLN  45  86.389   5.781   8.385
  361    HA   PRO  46           HA       PRO  46  86.135   4.398   3.507
  362    HB2  PRO  46           HB2      PRO  46  85.184   1.861   3.349
  363    HB3  PRO  46           HB1      PRO  46  86.532   2.404   2.326
  364    HG2  PRO  46           HG2      PRO  46  86.587   0.752   4.803
  365    HG3  PRO  46           HG1      PRO  46  87.582   0.628   3.344
  366    HD2  PRO  46           HD2      PRO  46  88.361   1.896   5.741
  367    HD3  PRO  46           HD1      PRO  46  89.145   2.099   4.160
  368    H    GLN  47           HN       GLN  47  83.808   4.163   4.121
  369    HA   GLN  47           HA       GLN  47  83.387   4.650   6.875
  370    HB2  GLN  47           HB2      GLN  47  81.219   3.862   4.942
  371    HB3  GLN  47           HB1      GLN  47  81.118   4.957   6.321
  372    HG2  GLN  47           HG2      GLN  47  82.622   5.429   3.733
  373    HG3  GLN  47           HG1      GLN  47  81.194   6.292   4.301
  374   HE21  GLN  47          HE21      GLN  47  81.566   8.145   5.552
  375   HE22  GLN  47          HE22      GLN  47  83.068   8.561   6.225
  376    H    ASP  48           HN       ASP  48  82.791   1.770   4.889
  377    HA   ASP  48           HA       ASP  48  81.440   0.310   6.937
  378    HB2  ASP  48           HB2      ASP  48  82.689  -0.444   4.307
  379    HB3  ASP  48           HB1      ASP  48  82.004  -1.662   5.382
  380    H    TRP  49           HN       TRP  49  84.451   1.353   7.128
  381    HA   TRP  49           HA       TRP  49  86.095  -0.878   7.576
  382    HB2  TRP  49           HB2      TRP  49  86.840   1.497   7.390
  383    HB3  TRP  49           HB1      TRP  49  86.214   1.773   9.012
  384    HD1  TRP  49           HD1      TRP  49  87.544   0.832  11.008
  385    HE1  TRP  49           HE1      TRP  49  89.952  -0.172  11.244
  386    HE3  TRP  49           HE3      TRP  49  88.473  -0.133   6.143
  387    HZ2  TRP  49           HZ2      TRP  49  92.020  -1.273   9.423
  388    HZ3  TRP  49           HZ3      TRP  49  90.594  -1.153   5.401
  389    HH2  TRP  49           HH2      TRP  49  92.342  -1.727   7.048
  390    H    ASN  50           HN       ASN  50  84.236  -2.175   8.710
  391    HA   ASN  50           HA       ASN  50  84.133  -1.553  11.579
  392    HB2  ASN  50           HB2      ASN  50  81.983  -2.140  10.745
  393    HB3  ASN  50           HB1      ASN  50  82.621  -3.503   9.834
  394   HD21  ASN  50          HD21      ASN  50  84.043  -3.248  12.959
  395   HD22  ASN  50          HD22      ASN  50  83.102  -4.436  13.723
  396    H    GLY  51           HN       GLY  51  86.425  -1.977  11.840
  397    HA2  GLY  51           HA2      GLY  51  86.925  -4.831  12.346
  398    HA3  GLY  51           HA1      GLY  51  88.058  -3.958  11.323
  399    H    ASP  52           HN       ASP  52  88.330  -5.252  13.991
  400    HA   ASP  52           HA       ASP  52  88.780  -3.151  15.899
  401    HB2  ASP  52           HB2      ASP  52  88.140  -5.441  16.578
  402    HB3  ASP  52           HB1      ASP  52  89.675  -6.038  15.952
  403    HA   PRO  53           HA       PRO  53  92.779  -2.021  14.204
  404    HB2  PRO  53           HB2      PRO  53  93.570  -0.479  16.364
  405    HB3  PRO  53           HB1      PRO  53  92.538   0.096  15.043
  406    HG2  PRO  53           HG2      PRO  53  91.783  -0.829  17.763
  407    HG3  PRO  53           HG1      PRO  53  91.109   0.488  16.788
  408    HD2  PRO  53           HD2      PRO  53  89.851  -1.895  17.053
  409    HD3  PRO  53           HD1      PRO  53  89.746  -0.939  15.556
  410    H    GLN  54           HN       GLN  54  92.209  -3.596  17.233
  411    HA   GLN  54           HA       GLN  54  94.987  -4.076  17.797
  412    HB2  GLN  54           HB2      GLN  54  92.508  -5.358  18.966
  413    HB3  GLN  54           HB1      GLN  54  94.144  -5.512  19.608
  414    HG2  GLN  54           HG2      GLN  54  94.234  -3.271  20.283
  415    HG3  GLN  54           HG1      GLN  54  92.960  -2.781  19.170
  416   HE21  GLN  54          HE21      GLN  54  90.717  -3.262  19.780
  417   HE22  GLN  54          HE22      GLN  54  90.317  -3.643  21.385
  418    H    ARG  55           HN       ARG  55  92.523  -5.657  15.933
  419    HA   ARG  55           HA       ARG  55  94.051  -8.156  15.835
  420    HB2  ARG  55           HB2      ARG  55  91.418  -7.435  14.514
  421    HB3  ARG  55           HB1      ARG  55  92.127  -9.046  14.599
  422    HG2  ARG  55           HG2      ARG  55  92.009  -8.968  17.066
  423    HG3  ARG  55           HG1      ARG  55  91.287  -7.362  16.977
  424    HD2  ARG  55           HD2      ARG  55  89.378  -8.674  17.135
  425    HD3  ARG  55           HD1      ARG  55  89.555  -8.578  15.386
  426    HE   ARG  55           HE       ARG  55  89.962 -10.854  15.384
  427   HH11  ARG  55          HH21      ARG  55  90.564  -9.506  18.513
  428   HH12  ARG  55          HH22      ARG  55  90.884 -11.033  19.263
  429   HH21  ARG  55          HH11      ARG  55  90.384 -12.863  16.360
  430   HH22  ARG  55          HH12      ARG  55  90.783 -12.935  18.044
  431    HA   PRO  56           HA       PRO  56  96.224  -7.190  12.165
  432    HB2  PRO  56           HB2      PRO  56  96.238  -9.681  10.931
  433    HB3  PRO  56           HB1      PRO  56  97.338  -9.183  12.229
  434    HG2  PRO  56           HG2      PRO  56  94.865 -10.828  12.369
  435    HG3  PRO  56           HG1      PRO  56  96.382 -10.985  13.272
  436    HD2  PRO  56           HD2      PRO  56  94.151  -9.910  14.380
  437    HD3  PRO  56           HD1      PRO  56  95.782  -9.371  14.831
  438    H    PHE  57           HN       PHE  57  96.117  -7.073   9.854
  439    HA   PHE  57           HA       PHE  57  93.411  -7.402   8.692
  440    HB2  PHE  57           HB2      PHE  57  95.288  -5.047   8.324
  441    HB3  PHE  57           HB1      PHE  57  93.751  -5.273   7.495
  442    HD1  PHE  57           HD2      PHE  57  95.248  -4.987  10.916
  443    HD2  PHE  57           HD1      PHE  57  91.749  -4.515   8.474
  444    HE1  PHE  57           HE2      PHE  57  94.058  -3.922  12.817
  445    HE2  PHE  57           HE1      PHE  57  90.560  -3.461  10.370
  446    HZ   PHE  57           HZ       PHE  57  91.709  -3.167  12.542
  447    H    GLU  58           HN       GLU  58  93.496  -7.674   6.297
  448    HA   GLU  58           HA       GLU  58  96.187  -8.421   5.340
  449    HB2  GLU  58           HB2      GLU  58  93.570  -9.821   4.708
  450    HB3  GLU  58           HB1      GLU  58  95.122 -10.205   3.961
  451    HG2  GLU  58           HG2      GLU  58  96.012 -10.555   6.335
  452    HG3  GLU  58           HG1      GLU  58  94.330 -10.513   6.862
  453    H    ALA  59           HN       ALA  59  96.765  -7.628   3.297
  454    HA   ALA  59           HA       ALA  59  94.728  -5.944   1.942
  455    HB1  ALA  59           HB1      ALA  59  97.397  -5.405   2.914
  456    HB2  ALA  59           HB2      ALA  59  96.192  -4.289   2.272
  457    HB3  ALA  59           HB3      ALA  59  97.294  -5.117   1.179
  458    H    ARG  60           HN       ARG  60  94.400  -6.185  -0.155
  459    HA   ARG  60           HA       ARG  60  96.208  -7.948  -1.707
  460    HB2  ARG  60           HB2      ARG  60  93.200  -7.796  -1.669
  461    HB3  ARG  60           HB1      ARG  60  94.048  -8.326  -3.119
  462    HG2  ARG  60           HG2      ARG  60  93.362 -10.215  -1.624
  463    HG3  ARG  60           HG1      ARG  60  95.098 -10.149  -1.912
  464    HD2  ARG  60           HD2      ARG  60  95.569  -9.554   0.254
  465    HD3  ARG  60           HD1      ARG  60  94.063  -8.672   0.461
  466    HE   ARG  60           HE       ARG  60  92.970 -10.943   0.566
  467   HH11  ARG  60          HH21      ARG  60  96.323 -10.480   1.355
  468   HH12  ARG  60          HH22      ARG  60  96.398 -11.857   2.400
  469   HH21  ARG  60          HH11      ARG  60  93.083 -12.740   1.935
  470   HH22  ARG  60          HH12      ARG  60  94.571 -13.132   2.728
  471    H    LEU  61           HN       LEU  61  97.118  -6.888  -3.417
  472    HA   LEU  61           HA       LEU  61  95.921  -4.298  -4.190
  473    HB2  LEU  61           HB2      LEU  61  98.736  -5.163  -4.803
  474    HB3  LEU  61           HB1      LEU  61  98.076  -3.532  -4.720
  475    HG   LEU  61           HG       LEU  61  98.362  -5.411  -2.355
  476   HD11  LEU  61          HD11      LEU  61 100.557  -4.718  -2.967
  477   HD12  LEU  61          HD12      LEU  61 100.070  -3.621  -1.675
  478   HD13  LEU  61          HD13      LEU  61 100.015  -3.085  -3.355
  479   HD21  LEU  61          HD21      LEU  61  97.896  -3.236  -1.107
  480   HD22  LEU  61          HD22      LEU  61  96.522  -3.912  -1.981
  481   HD23  LEU  61          HD23      LEU  61  97.415  -2.550  -2.658
  482    H    TYR  62           HN       TYR  62  95.799  -3.721  -6.375
  483    HA   TYR  62           HA       TYR  62  96.133  -5.926  -8.308
  484    HB2  TYR  62           HB2      TYR  62  93.759  -4.044  -8.225
  485    HB3  TYR  62           HB1      TYR  62  94.008  -5.379  -9.349
  486    HD1  TYR  62           HD1      TYR  62  93.210  -4.460  -5.866
  487    HD2  TYR  62           HD2      TYR  62  93.748  -7.693  -8.645
  488    HE1  TYR  62           HE1      TYR  62  92.153  -6.031  -4.249
  489    HE2  TYR  62           HE2      TYR  62  92.696  -9.257  -7.032
  490    HH   TYR  62           HH       TYR  62  90.921  -8.251  -4.390
  491    H    LEU  63           HN       LEU  63  97.709  -5.250  -9.583
  492    HA   LEU  63           HA       LEU  63  97.786  -2.421 -10.445
  493    HB2  LEU  63           HB2      LEU  63  99.812  -3.635  -9.361
  494    HB3  LEU  63           HB1      LEU  63  99.980  -4.430 -10.923
  495    HG   LEU  63           HG       LEU  63  99.875  -1.423 -10.521
  496   HD11  LEU  63          HD11      LEU  63 102.274  -3.092 -11.299
  497   HD12  LEU  63          HD12      LEU  63 101.925  -2.669  -9.622
  498   HD13  LEU  63          HD13      LEU  63 102.239  -1.399 -10.804
  499   HD21  LEU  63          HD21      LEU  63 100.167  -3.237 -12.914
  500   HD22  LEU  63          HD22      LEU  63 100.892  -1.630 -12.931
  501   HD23  LEU  63          HD23      LEU  63  99.152  -1.807 -12.724
  502    H    GLY  64           HN       GLY  64  99.103  -5.279 -12.058
  503    HA2  GLY  64           HA2      GLY  64  97.968  -4.468 -14.591
  504    HA3  GLY  64           HA1      GLY  64  98.952  -5.904 -14.292
  505    H    LEU  65           HN       LEU  65  96.876  -6.415 -15.890
  506    HA   LEU  65           HA       LEU  65  94.480  -6.974 -14.456
  507    HB2  LEU  65           HB2      LEU  65  94.449  -6.568 -16.881
  508    HB3  LEU  65           HB1      LEU  65  95.439  -7.995 -17.152
  509    HG   LEU  65           HG       LEU  65  92.925  -8.258 -17.545
  510   HD11  LEU  65          HD11      LEU  65  94.810 -10.066 -16.636
  511   HD12  LEU  65          HD12      LEU  65  93.197 -10.474 -17.213
  512   HD13  LEU  65          HD13      LEU  65  93.488 -10.280 -15.489
  513   HD21  LEU  65          HD21      LEU  65  92.406  -6.952 -15.383
  514   HD22  LEU  65          HD22      LEU  65  92.761  -8.458 -14.537
  515   HD23  LEU  65          HD23      LEU  65  91.445  -8.392 -15.706
  516    H    ASP  66           HN       ASP  66  97.370  -8.819 -15.326
  517    HA   ASP  66           HA       ASP  66  96.358 -11.297 -14.110
  518    HB2  ASP  66           HB2      ASP  66  97.589 -11.064 -16.375
  519    HB3  ASP  66           HB1      ASP  66  99.033 -10.861 -15.387
  520    H    VAL  67           HN       VAL  67  97.578  -8.553 -12.879
  521    HA   VAL  67           HA       VAL  67  99.578  -9.901 -11.164
  522    HB   VAL  67           HB       VAL  67  99.225  -7.034 -11.999
  523   HG11  VAL  67          HG11      VAL  67 101.227  -6.719 -10.317
  524   HG12  VAL  67          HG12      VAL  67 100.526  -8.125  -9.514
  525   HG13  VAL  67          HG13      VAL  67  99.572  -6.656  -9.715
  526   HG21  VAL  67          HG21      VAL  67 101.455  -7.273 -12.790
  527   HG22  VAL  67          HG22      VAL  67 100.673  -8.794 -13.220
  528   HG23  VAL  67          HG23      VAL  67 101.734  -8.715 -11.813
  529    H    LEU  68           HN       LEU  68  98.391 -10.820  -9.630
  530    HA   LEU  68           HA       LEU  68  96.750  -9.049  -7.922
  531    HB2  LEU  68           HB2      LEU  68  95.207 -10.668  -8.406
  532    HB3  LEU  68           HB1      LEU  68  96.432 -11.848  -8.854
  533    HG   LEU  68           HG       LEU  68  96.503 -11.218  -5.991
  534   HD11  LEU  68          HD11      LEU  68  94.385 -12.616  -5.580
  535   HD12  LEU  68          HD12      LEU  68  93.946 -12.216  -7.241
  536   HD13  LEU  68          HD13      LEU  68  94.154 -10.932  -6.050
  537   HD21  LEU  68          HD21      LEU  68  96.014 -13.814  -7.480
  538   HD22  LEU  68          HD22      LEU  68  96.569 -13.644  -5.816
  539   HD23  LEU  68          HD23      LEU  68  97.613 -13.152  -7.146
  540    H    ILE  69           HN       ILE  69  97.790  -8.475  -6.106
  541    HA   ILE  69           HA       ILE  69  99.869 -10.307  -5.059
  542    HB   ILE  69           HB       ILE  69  99.639  -7.297  -4.995
  543   HG12  ILE  69          HG12      ILE  69 102.196  -8.473  -5.760
  544   HG13  ILE  69          HG11      ILE  69 100.894  -9.134  -6.746
  545   HG21  ILE  69          HG21      ILE  69 100.574  -7.460  -2.919
  546   HG22  ILE  69          HG22      ILE  69 102.046  -7.859  -3.808
  547   HG23  ILE  69          HG23      ILE  69 101.034  -9.144  -3.153
  548   HD11  ILE  69          HD11      ILE  69 101.749  -7.133  -7.823
  549   HD12  ILE  69          HD12      ILE  69 101.537  -6.201  -6.340
  550   HD13  ILE  69          HD13      ILE  69 100.128  -6.799  -7.216
  551    H    ARG  70           HN       ARG  70  99.975 -10.785  -2.911
  552    HA   ARG  70           HA       ARG  70  97.769  -9.831  -1.195
  553    HB2  ARG  70           HB2      ARG  70  97.818 -12.190  -0.186
  554    HB3  ARG  70           HB1      ARG  70  97.065 -12.021  -1.772
  555    HG2  ARG  70           HG2      ARG  70 100.000 -12.620  -1.665
  556    HG3  ARG  70           HG1      ARG  70  98.874 -13.925  -1.301
  557    HD2  ARG  70           HD2      ARG  70  97.927 -13.887  -3.438
  558    HD3  ARG  70           HD1      ARG  70  98.448 -12.235  -3.753
  559    HE   ARG  70           HE       ARG  70 100.814 -13.415  -3.623
  560   HH11  ARG  70          HH21      ARG  70  97.865 -14.532  -5.058
  561   HH12  ARG  70          HH22      ARG  70  98.657 -15.484  -6.268
  562   HH21  ARG  70          HH11      ARG  70 101.851 -14.666  -5.210
  563   HH22  ARG  70          HH12      ARG  70 100.907 -15.562  -6.352
  564    H    MET  71           HN       MET  71  98.325  -9.143   0.729
  565    HA   MET  71           HA       MET  71 100.885  -9.950   1.934
  566    HB2  MET  71           HB2      MET  71 100.453  -7.107   2.304
  567    HB3  MET  71           HB1      MET  71 101.874  -7.941   1.686
  568    HG2  MET  71           HG2      MET  71 101.154  -7.784  -0.541
  569    HG3  MET  71           HG1      MET  71  99.465  -7.565  -0.084
  570    HE1  MET  71           HE1      MET  71 102.973  -6.181   0.487
  571    HE2  MET  71           HE2      MET  71 102.209  -5.610   1.968
  572    HE3  MET  71           HE3      MET  71 102.742  -4.446   0.756
  573    H    GLU  72           HN       GLU  72 100.930  -9.704   4.195
  574    HA   GLU  72           HA       GLU  72  98.284  -9.280   5.409
  575    HB2  GLU  72           HB2      GLU  72  99.206 -11.486   5.891
  576    HB3  GLU  72           HB1      GLU  72 100.715 -10.765   6.454
  577    HG2  GLU  72           HG2      GLU  72  99.642  -9.767   8.344
  578    HG3  GLU  72           HG1      GLU  72  98.038 -10.127   7.709
  579    H    ILE  73           HN       ILE  73  98.039  -7.440   6.662
  580    HA   ILE  73           HA       ILE  73 100.515  -6.132   7.614
  581    HB   ILE  73           HB       ILE  73  99.354  -3.958   7.002
  582   HG12  ILE  73          HG12      ILE  73  97.756  -5.800   5.204
  583   HG13  ILE  73          HG11      ILE  73  97.116  -5.131   6.705
  584   HG21  ILE  73          HG21      ILE  73  99.777  -4.652   4.393
  585   HG22  ILE  73          HG22      ILE  73 100.637  -5.946   5.217
  586   HG23  ILE  73          HG23      ILE  73 101.072  -4.265   5.522
  587   HD11  ILE  73          HD11      ILE  73  96.776  -3.891   4.369
  588   HD12  ILE  73          HD12      ILE  73  98.353  -3.223   4.768
  589   HD13  ILE  73          HD13      ILE  73  96.992  -2.995   5.861
  590    H    SER  74           HN       SER  74 100.257  -4.633   9.315
  591    HA   SER  74           HA       SER  74  97.800  -4.981  10.938
  592    HB2  SER  74           HB2      SER  74  99.057  -5.202  12.888
  593    HB3  SER  74           HB1      SER  74 100.045  -6.084  11.727
  594    HG   SER  74           HG       SER  74 101.503  -4.727  12.475
  595    H    LEU  75           HN       LEU  75  97.237  -3.149  12.288
  596    HA   LEU  75           HA       LEU  75  97.444  -0.643  10.995
  597    HB2  LEU  75           HB2      LEU  75  95.773  -1.718  12.812
  598    HB3  LEU  75           HB1      LEU  75  96.769  -0.733  13.879
  599    HG   LEU  75           HG       LEU  75  96.323   1.244  12.446
  600   HD11  LEU  75          HD11      LEU  75  94.974  -0.839  10.788
  601   HD12  LEU  75          HD12      LEU  75  95.852   0.604  10.280
  602   HD13  LEU  75          HD13      LEU  75  94.199   0.743  10.874
  603   HD21  LEU  75          HD21      LEU  75  94.804   0.440  14.385
  604   HD22  LEU  75          HD22      LEU  75  93.685  -0.054  13.114
  605   HD23  LEU  75          HD23      LEU  75  94.143   1.641  13.275
  606    H    ALA  76           HN       ALA  76  99.105   0.703  10.958
  607    HA   ALA  76           HA       ALA  76 101.072   0.594  13.132
  608    HB1  ALA  76           HB1      ALA  76 102.055   0.335  10.926
  609    HB2  ALA  76           HB2      ALA  76 102.545   1.887  11.596
  610    HB3  ALA  76           HB3      ALA  76 101.275   1.815  10.371
  611    H    TRP  77           HN       TRP  77  99.012   2.809  11.349
  612    HA   TRP  77           HA       TRP  77  98.550   4.493  13.623
  613    HB2  TRP  77           HB2      TRP  77  99.656   6.533  12.783
  614    HB3  TRP  77           HB1      TRP  77 100.852   5.256  13.036
  615    HD1  TRP  77           HD1      TRP  77 102.042   4.247  10.942
  616    HE1  TRP  77           HE1      TRP  77 101.923   4.707   8.418
  617    HE3  TRP  77           HE3      TRP  77  98.206   7.624  10.816
  618    HZ2  TRP  77           HZ2      TRP  77 100.608   6.459   6.630
  619    HZ3  TRP  77           HZ3      TRP  77  97.553   8.691   8.675
  620    HH2  TRP  77           HH2      TRP  77  98.733   8.103   6.571
  621    H    ALA  78           HN       ALA  78  97.288   6.514  12.909
  622    HA   ALA  78           HA       ALA  78  96.016   6.317  10.268
  623    HB1  ALA  78           HB1      ALA  78  94.488   6.033  12.860
  624    HB2  ALA  78           HB2      ALA  78  94.639   4.824  11.586
  625    HB3  ALA  78           HB3      ALA  78  93.751   6.318  11.282
  626    H    ARG  79           HN       ARG  79  95.874   8.415   9.530
  627    HA   ARG  79           HA       ARG  79  95.000  10.480  11.374
  628    HB2  ARG  79           HB2      ARG  79  97.103  11.121  11.895
  629    HB3  ARG  79           HB1      ARG  79  97.802  10.166  10.592
  630    HG2  ARG  79           HG2      ARG  79  97.335  11.920   8.976
  631    HG3  ARG  79           HG1      ARG  79  96.446  12.850  10.183
  632    HD2  ARG  79           HD2      ARG  79  98.394  13.380  11.390
  633    HD3  ARG  79           HD1      ARG  79  99.318  12.077  10.647
  634    HE   ARG  79           HE       ARG  79  99.767  13.486   8.850
  635   HH11  ARG  79          HH21      ARG  79  97.198  14.725  10.808
  636   HH12  ARG  79          HH22      ARG  79  97.118  16.246   9.985
  637   HH21  ARG  79          HH11      ARG  79  99.670  15.479   7.765
  638   HH22  ARG  79          HH12      ARG  79  98.517  16.673   8.262
  639    H    ASP  80           HN       ASP  80  93.796  12.009  10.455
  640    HA   ASP  80           HA       ASP  80  92.667  13.195   8.865
  641    HB2  ASP  80           HB2      ASP  80  95.364  12.933   7.550
  642    HB3  ASP  80           HB1      ASP  80  94.069  13.949   6.916
  643    H    GLY  81           HN       GLY  81  91.855  10.530   8.675
  644    HA2  GLY  81           HA2      GLY  81  90.487   9.445   7.170
  645    HA3  GLY  81           HA1      GLY  81  91.079  10.498   5.899
  646    H    LEU  82           HN       LEU  82  93.948   9.760   6.518
  647    HA   LEU  82           HA       LEU  82  93.920   7.328   4.910
  648    HB2  LEU  82           HB2      LEU  82  96.421   8.712   5.820
  649    HB3  LEU  82           HB1      LEU  82  96.101   7.849   4.317
  650    HG   LEU  82           HG       LEU  82  94.953  10.537   5.115
  651   HD11  LEU  82          HD11      LEU  82  97.299  10.619   4.374
  652   HD12  LEU  82          HD12      LEU  82  96.244  11.328   3.152
  653   HD13  LEU  82          HD13      LEU  82  96.883   9.699   2.927
  654   HD21  LEU  82          HD21      LEU  82  93.257   9.404   3.869
  655   HD22  LEU  82          HD22      LEU  82  94.438   8.701   2.764
  656   HD23  LEU  82          HD23      LEU  82  94.091  10.429   2.700
  657    H    LEU  83           HN       LEU  83  95.282   5.507   5.434
  658    HA   LEU  83           HA       LEU  83  95.646   5.080   8.366
  659    HB2  LEU  83           HB2      LEU  83  94.691   3.077   6.336
  660    HB3  LEU  83           HB1      LEU  83  94.869   2.833   8.072
  661    HG   LEU  83           HG       LEU  83  93.032   4.886   6.815
  662   HD11  LEU  83          HD11      LEU  83  91.264   3.231   7.720
  663   HD12  LEU  83          HD12      LEU  83  92.580   2.061   7.789
  664   HD13  LEU  83          HD13      LEU  83  92.114   2.771   6.243
  665   HD21  LEU  83          HD21      LEU  83  92.043   4.666   9.226
  666   HD22  LEU  83          HD22      LEU  83  93.506   5.623   9.007
  667   HD23  LEU  83          HD23      LEU  83  93.615   3.979   9.636
  668    H    GLY  84           HN       GLY  84  97.663   4.221   8.900
  669    HA2  GLY  84           HA2      GLY  84  99.422   3.451   6.689
  670    HA3  GLY  84           HA1      GLY  84  99.904   3.798   8.346
  671    H    PHE  85           HN       PHE  85 100.532   1.467   6.727
  672    HA   PHE  85           HA       PHE  85  99.604  -0.563   8.632
  673    HB2  PHE  85           HB2      PHE  85  99.085  -0.505   5.684
  674    HB3  PHE  85           HB1      PHE  85  99.336  -2.050   6.483
  675    HD1  PHE  85           HD2      PHE  85  97.917  -2.614   8.526
  676    HD2  PHE  85           HD1      PHE  85  97.028   0.637   5.868
  677    HE1  PHE  85           HE2      PHE  85  95.594  -2.552   9.383
  678    HE2  PHE  85           HE1      PHE  85  94.701   0.699   6.724
  679    HZ   PHE  85           HZ       PHE  85  93.989  -0.890   8.486
  680    H    GLU  86           HN       GLU  86 101.211  -1.922   9.211
  681    HA   GLU  86           HA       GLU  86 103.704  -1.763   7.654
  682    HB2  GLU  86           HB2      GLU  86 103.740  -1.175  10.104
  683    HB3  GLU  86           HB1      GLU  86 103.307  -2.850  10.455
  684    HG2  GLU  86           HG2      GLU  86 105.359  -3.461   8.981
  685    HG3  GLU  86           HG1      GLU  86 105.839  -1.781   9.218
  686    H    CYS  87           HN       CYS  87 104.317  -3.491   6.485
  687    HA   CYS  87           HA       CYS  87 102.661  -5.791   6.281
  688    HB2  CYS  87           HB2      CYS  87 103.891  -5.008   4.356
  689    HB3  CYS  87           HB1      CYS  87 105.424  -5.227   5.202
  690    HG   CYS  87           HG       CYS  87 104.554  -7.882   5.320
  691    H    GLN  88           HN       GLN  88 102.605  -7.538   7.494
  692    HA   GLN  88           HA       GLN  88 104.838  -8.137   9.306
  693    HB2  GLN  88           HB2      GLN  88 102.202  -9.597   9.194
  694    HB3  GLN  88           HB1      GLN  88 103.320  -9.448  10.549
  695    HG2  GLN  88           HG2      GLN  88 101.702  -7.191   9.335
  696    HG3  GLN  88           HG1      GLN  88 101.367  -7.987  10.871
  697   HE21  GLN  88          HE21      GLN  88 102.255  -5.105  10.174
  698   HE22  GLN  88          HE22      GLN  88 103.594  -4.846  11.185
  699    H    HIS  89           HN       HIS  89 103.067  -9.430   6.557
  700    HA   HIS  89           HA       HIS  89 105.230 -11.213   5.911
  701    HB2  HIS  89           HB2      HIS  89 104.465 -13.107   6.858
  702    HB3  HIS  89           HB1      HIS  89 103.114 -12.215   7.552
  703    HD2  HIS  89           HD2      HIS  89 100.703 -13.135   6.602
  704    HE1  HIS  89           HE1      HIS  89 102.053 -14.736   2.932
  705    HE2  HIS  89           HE2      HIS  89 100.025 -14.425   4.431
  706    H    ILE  90           HN       ILE  90 105.199 -11.773   3.772
  707    HA   ILE  90           HA       ILE  90 102.798 -11.298   2.138
  708    HB   ILE  90           HB       ILE  90 103.894  -9.125   2.125
  709   HG12  ILE  90          HG12      ILE  90 104.581 -10.633  -0.417
  710   HG13  ILE  90          HG11      ILE  90 102.962 -10.074  -0.004
  711   HG21  ILE  90          HG21      ILE  90 106.107  -9.558   2.814
  712   HG22  ILE  90          HG22      ILE  90 106.282  -9.084   1.125
  713   HG23  ILE  90          HG23      ILE  90 106.350 -10.787   1.576
  714   HD11  ILE  90          HD11      ILE  90 103.457  -8.054  -0.856
  715   HD12  ILE  90          HD12      ILE  90 105.093  -8.596  -1.223
  716   HD13  ILE  90          HD13      ILE  90 104.737  -7.866   0.342
  717    H    ASP  91           HN       ASP  91 102.640 -12.498   0.382
  718    HA   ASP  91           HA       ASP  91 104.030 -14.928   0.309
  719    HB2  ASP  91           HB2      ASP  91 102.264 -13.532  -1.684
  720    HB3  ASP  91           HB1      ASP  91 102.991 -15.097  -2.036
  721    H    LEU  92           HN       LEU  92 105.629 -15.750  -0.847
  722    HA   LEU  92           HA       LEU  92 107.825 -14.204  -1.597
  723    HB2  LEU  92           HB2      LEU  92 107.714 -16.727  -1.149
  724    HB3  LEU  92           HB1      LEU  92 107.228 -16.887  -2.835
  725    HG   LEU  92           HG       LEU  92 109.301 -15.526  -3.432
  726   HD11  LEU  92          HD11      LEU  92 111.105 -15.922  -1.532
  727   HD12  LEU  92          HD12      LEU  92 109.694 -15.902  -0.478
  728   HD13  LEU  92          HD13      LEU  92 110.062 -14.503  -1.485
  729   HD21  LEU  92          HD21      LEU  92 109.449 -18.267  -2.165
  730   HD22  LEU  92          HD22      LEU  92 110.831 -17.542  -2.986
  731   HD23  LEU  92          HD23      LEU  92 109.345 -17.866  -3.879
  732    H    ASP  93           HN       ASP  93 105.223 -15.500  -3.631
  733    HA   ASP  93           HA       ASP  93 106.283 -14.610  -6.105
  734    HB2  ASP  93           HB2      ASP  93 103.682 -15.641  -5.116
  735    HB3  ASP  93           HB1      ASP  93 103.602 -14.641  -6.565
  736    H    SER  94           HN       SER  94 104.121 -13.171  -3.713
  737    HA   SER  94           HA       SER  94 103.534 -10.808  -5.204
  738    HB2  SER  94           HB2      SER  94 102.000 -11.180  -3.492
  739    HB3  SER  94           HB1      SER  94 103.249 -11.658  -2.346
  740    HG   SER  94           HG       SER  94 103.180  -9.666  -1.713
  741    H    ILE  95           HN       ILE  95 106.025 -11.750  -2.911
  742    HA   ILE  95           HA       ILE  95 107.113  -9.231  -2.345
  743    HB   ILE  95           HB       ILE  95 108.295 -12.006  -2.450
  744   HG12  ILE  95          HG12      ILE  95 107.916 -10.070  -0.150
  745   HG13  ILE  95          HG11      ILE  95 106.714 -11.271  -0.615
  746   HG21  ILE  95          HG21      ILE  95 110.268 -10.846  -1.219
  747   HG22  ILE  95          HG22      ILE  95 109.682  -9.368  -1.981
  748   HG23  ILE  95          HG23      ILE  95 110.203 -10.726  -2.976
  749   HD11  ILE  95          HD11      ILE  95 109.398 -12.418  -0.341
  750   HD12  ILE  95          HD12      ILE  95 107.869 -12.956   0.356
  751   HD13  ILE  95          HD13      ILE  95 108.806 -11.694   1.154
  752    H    SER  96           HN       SER  96 107.626 -11.446  -5.053
  753    HA   SER  96           HA       SER  96 109.747  -9.911  -6.152
  754    HB2  SER  96           HB2      SER  96 108.655 -12.426  -6.662
  755    HB3  SER  96           HB1      SER  96 108.230 -11.499  -8.103
  756    HG   SER  96           HG       SER  96 110.836 -11.429  -7.004
  757    H    HIS  97           HN       HIS  97 106.246  -9.919  -6.675
  758    HA   HIS  97           HA       HIS  97 106.351  -8.205  -8.928
  759    HB2  HIS  97           HB2      HIS  97 104.207  -8.835  -6.902
  760    HB3  HIS  97           HB1      HIS  97 103.970  -7.583  -8.104
  761    HD2  HIS  97           HD2      HIS  97 103.880 -11.433  -7.870
  762    HE1  HIS  97           HE1      HIS  97 103.457 -10.413 -11.943
  763    HE2  HIS  97           HE2      HIS  97 103.330 -12.316 -10.266
  764    H    LEU  98           HN       LEU  98 106.381  -7.639  -5.472
  765    HA   LEU  98           HA       LEU  98 106.142  -4.772  -5.618
  766    HB2  LEU  98           HB2      LEU  98 106.794  -6.795  -3.537
  767    HB3  LEU  98           HB1      LEU  98 107.507  -5.200  -3.304
  768    HG   LEU  98           HG       LEU  98 105.241  -4.187  -3.576
  769   HD11  LEU  98          HD11      LEU  98 103.278  -5.669  -3.517
  770   HD12  LEU  98          HD12      LEU  98 104.334  -7.083  -3.537
  771   HD13  LEU  98          HD13      LEU  98 104.266  -6.014  -4.938
  772   HD21  LEU  98          HD21      LEU  98 104.334  -5.078  -1.393
  773   HD22  LEU  98          HD22      LEU  98 106.032  -4.607  -1.327
  774   HD23  LEU  98          HD23      LEU  98 105.594  -6.311  -1.441
  775    H    ARG  99           HN       ARG  99 108.824  -7.041  -5.850
  776    HA   ARG  99           HA       ARG  99 110.904  -5.135  -5.606
  777    HB2  ARG  99           HB2      ARG  99 110.652  -7.864  -6.806
  778    HB3  ARG  99           HB1      ARG  99 112.062  -6.899  -7.234
  779    HG2  ARG  99           HG2      ARG  99 112.916  -6.930  -5.085
  780    HG3  ARG  99           HG1      ARG  99 111.324  -7.045  -4.339
  781    HD2  ARG  99           HD2      ARG  99 111.261  -9.335  -4.501
  782    HD3  ARG  99           HD1      ARG  99 112.173  -9.366  -6.005
  783    HE   ARG  99           HE       ARG  99 113.278  -9.332  -3.298
  784   HH11  ARG  99          HH21      ARG  99 113.753  -9.056  -6.716
  785   HH12  ARG  99          HH22      ARG  99 115.449  -9.398  -6.646
  786   HH21  ARG  99          HH11      ARG  99 115.500  -9.780  -3.201
  787   HH22  ARG  99          HH12      ARG  99 116.439  -9.807  -4.655
  788    H    ARG 100           HN       ARG 100 108.936  -6.219  -8.326
  789    HA   ARG 100           HA       ARG 100 110.248  -4.930 -10.452
  790    HB2  ARG 100           HB2      ARG 100 107.293  -5.435 -10.063
  791    HB3  ARG 100           HB1      ARG 100 108.072  -5.027 -11.589
  792    HG2  ARG 100           HG2      ARG 100 109.590  -7.082 -11.123
  793    HG3  ARG 100           HG1      ARG 100 108.356  -7.542  -9.951
  794    HD2  ARG 100           HD2      ARG 100 107.916  -8.593 -12.131
  795    HD3  ARG 100           HD1      ARG 100 106.637  -7.457 -11.715
  796    HE   ARG 100           HE       ARG 100 108.394  -5.961 -13.191
  797   HH11  ARG 100          HH21      ARG 100 106.733  -8.969 -13.610
  798   HH12  ARG 100          HH22      ARG 100 106.618  -8.824 -15.333
  799   HH21  ARG 100          HH11      ARG 100 108.246  -5.763 -15.452
  800   HH22  ARG 100          HH12      ARG 100 107.475  -7.011 -16.375
  801    H    LEU 101           HN       LEU 101 107.677  -3.800  -8.295
  802    HA   LEU 101           HA       LEU 101 107.369  -1.241  -9.487
  803    HB2  LEU 101           HB2      LEU 101 106.539  -2.493  -6.902
  804    HB3  LEU 101           HB1      LEU 101 106.514  -0.733  -6.992
  805    HG   LEU 101           HG       LEU 101 105.020  -0.773  -8.880
  806   HD11  LEU 101          HD11      LEU 101 104.197  -3.185  -9.571
  807   HD12  LEU 101          HD12      LEU 101 105.761  -3.685  -8.929
  808   HD13  LEU 101          HD13      LEU 101 105.681  -2.531 -10.261
  809   HD21  LEU 101          HD21      LEU 101 104.143  -1.279  -6.504
  810   HD22  LEU 101          HD22      LEU 101 103.977  -2.946  -7.057
  811   HD23  LEU 101          HD23      LEU 101 103.073  -1.658  -7.854
  812    H    VAL 102           HN       VAL 102 109.502  -2.502  -7.014
  813    HA   VAL 102           HA       VAL 102 110.552   0.008  -6.157
  814    HB   VAL 102           HB       VAL 102 111.694  -2.794  -6.029
  815   HG11  VAL 102          HG11      VAL 102 113.138  -1.764  -4.217
  816   HG12  VAL 102          HG12      VAL 102 112.610  -0.184  -4.796
  817   HG13  VAL 102          HG13      VAL 102 113.532  -1.249  -5.857
  818   HG21  VAL 102          HG21      VAL 102 109.508  -2.112  -4.785
  819   HG22  VAL 102          HG22      VAL 102 110.576  -1.160  -3.754
  820   HG23  VAL 102          HG23      VAL 102 110.781  -2.908  -3.862
  821    H    GLU 103           HN       GLU 103 111.492  -2.369  -8.597
  822    HA   GLU 103           HA       GLU 103 113.946  -1.179  -9.346
  823    HB2  GLU 103           HB2      GLU 103 112.051  -3.033 -10.786
  824    HB3  GLU 103           HB1      GLU 103 113.580  -2.500 -11.486
  825    HG2  GLU 103           HG2      GLU 103 114.838  -3.477  -9.685
  826    HG3  GLU 103           HG1      GLU 103 113.371  -3.807  -8.764
  827    H    LEU 104           HN       LEU 104 110.689  -0.921 -10.795
  828    HA   LEU 104           HA       LEU 104 111.506   0.870 -12.843
  829    HB2  LEU 104           HB2      LEU 104 108.843   0.073 -11.693
  830    HB3  LEU 104           HB1      LEU 104 108.950   1.385 -12.865
  831    HG   LEU 104           HG       LEU 104 110.348  -0.314 -14.283
  832   HD11  LEU 104          HD11      LEU 104 110.523  -1.989 -12.437
  833   HD12  LEU 104          HD12      LEU 104 109.785  -2.653 -13.894
  834   HD13  LEU 104          HD13      LEU 104 108.775  -2.211 -12.517
  835   HD21  LEU 104          HD21      LEU 104 107.362  -0.529 -13.821
  836   HD22  LEU 104          HD22      LEU 104 108.192  -1.299 -15.172
  837   HD23  LEU 104          HD23      LEU 104 108.189   0.458 -15.025
  838    H    ASN 105           HN       ASN 105 110.035   1.414  -9.633
  839    HA   ASN 105           HA       ASN 105 109.752   4.209  -9.923
  840    HB2  ASN 105           HB2      ASN 105 109.893   2.350  -7.569
  841    HB3  ASN 105           HB1      ASN 105 109.870   4.095  -7.322
  842   HD21  ASN 105          HD21      ASN 105 108.037   1.489  -8.998
  843   HD22  ASN 105          HD22      ASN 105 106.534   2.267  -8.874
  844    H    LEU 106           HN       LEU 106 112.464   2.198  -8.905
  845    HA   LEU 106           HA       LEU 106 114.089   4.170  -7.763
  846    HB2  LEU 106           HB2      LEU 106 114.587   1.555  -9.122
  847    HB3  LEU 106           HB1      LEU 106 115.966   2.622  -8.871
  848    HG   LEU 106           HG       LEU 106 114.069   2.025  -6.604
  849   HD11  LEU 106          HD11      LEU 106 114.797  -0.153  -7.496
  850   HD12  LEU 106          HD12      LEU 106 115.560   0.168  -5.942
  851   HD13  LEU 106          HD13      LEU 106 116.477   0.374  -7.435
  852   HD21  LEU 106          HD21      LEU 106 115.663   3.815  -6.217
  853   HD22  LEU 106          HD22      LEU 106 116.990   2.825  -6.825
  854   HD23  LEU 106          HD23      LEU 106 116.199   2.406  -5.306
  855    H    GLY 107           HN       GLY 107 113.053   3.735 -10.990
  856    HA2  GLY 107           HA2      GLY 107 115.157   5.522 -12.041
  857    HA3  GLY 107           HA1      GLY 107 114.114   4.487 -13.014
  858    H    ASP 108           HN       ASP 108 111.914   5.458 -11.009
  859    HA   ASP 108           HA       ASP 108 110.190   6.976 -11.111
  860    HB2  ASP 108           HB2      ASP 108 112.491   8.852 -11.709
  861    HB3  ASP 108           HB1      ASP 108 110.863   9.355 -11.259
  862    H    GLU 109           HN       GLU 109 109.622   9.129 -12.656
  863    HA   GLU 109           HA       GLU 109 108.907   7.944 -15.143
  864    HB2  GLU 109           HB2      GLU 109 108.880  10.899 -14.506
  865    HB3  GLU 109           HB1      GLU 109 107.856  10.027 -15.645
  866    HG2  GLU 109           HG2      GLU 109 106.441  10.262 -13.795
  867    HG3  GLU 109           HG1      GLU 109 107.116   8.653 -13.546
  868    H    GLU 110           HN       GLU 110 109.694  10.957 -16.082
  869    HA   GLU 110           HA       GLU 110 111.530  10.289 -18.021
  870    HB2  GLU 110           HB2      GLU 110 111.424  12.931 -16.542
  871    HB3  GLU 110           HB1      GLU 110 112.062  12.658 -18.165
  872    HG2  GLU 110           HG2      GLU 110 109.819  11.906 -18.903
  873    HG3  GLU 110           HG1      GLU 110 109.190  12.237 -17.291
  874    H    LEU 111           HN       LEU 111 112.884  12.574 -15.796
  875    HA   LEU 111           HA       LEU 111 114.664  10.863 -14.411
  876    HB2  LEU 111           HB2      LEU 111 115.634  10.547 -16.661
  877    HB3  LEU 111           HB1      LEU 111 115.839  12.290 -16.814
  878    HG   LEU 111           HG       LEU 111 117.268  12.224 -14.729
  879   HD11  LEU 111          HD11      LEU 111 116.681  10.223 -13.634
  880   HD12  LEU 111          HD12      LEU 111 118.249   9.844 -14.342
  881   HD13  LEU 111          HD13      LEU 111 116.771   9.274 -15.118
  882   HD21  LEU 111          HD21      LEU 111 118.359  12.347 -16.878
  883   HD22  LEU 111          HD22      LEU 111 118.093  10.628 -17.169
  884   HD23  LEU 111          HD23      LEU 111 119.224  11.145 -15.920
  885    H    LEU 112           HN       LEU 112 115.832  13.792 -15.924
  886    HA   LEU 112           HA       LEU 112 116.359  15.857 -15.073
  887    HB2  LEU 112           HB2      LEU 112 114.023  15.405 -13.208
  888    HB3  LEU 112           HB1      LEU 112 114.700  16.949 -13.719
  889    HG   LEU 112           HG       LEU 112 114.031  15.406 -16.068
  890   HD11  LEU 112          HD11      LEU 112 112.415  14.222 -14.666
  891   HD12  LEU 112          HD12      LEU 112 111.563  15.328 -15.744
  892   HD13  LEU 112          HD13      LEU 112 111.795  15.752 -14.048
  893   HD21  LEU 112          HD21      LEU 112 112.909  17.946 -14.842
  894   HD22  LEU 112          HD22      LEU 112 112.552  17.387 -16.477
  895   HD23  LEU 112          HD23      LEU 112 114.201  17.835 -16.039
  896    H    GLU 113           HN       GLU 113 117.789  16.636 -13.612
  897    HA   GLU 113           HA       GLU 113 119.169  15.020 -11.871
  898    HB2  GLU 113           HB2      GLU 113 118.707  17.989 -11.494
  899    HB3  GLU 113           HB1      GLU 113 120.061  17.049 -10.867
  900    HG2  GLU 113           HG2      GLU 113 120.632  16.445 -13.252
  901    HG3  GLU 113           HG1      GLU 113 119.410  17.604 -13.771
  902    H    ARG 114           HN       ARG 114 118.116  13.752 -10.420
  903    HA   ARG 114           HA       ARG 114 117.041  15.014  -8.063
  904    HB2  ARG 114           HB2      ARG 114 115.164  14.764  -9.948
  905    HB3  ARG 114           HB1      ARG 114 115.096  13.122  -9.310
  906    HG2  ARG 114           HG2      ARG 114 114.680  13.959  -7.062
  907    HG3  ARG 114           HG1      ARG 114 114.897  15.623  -7.606
  908    HD2  ARG 114           HD2      ARG 114 112.746  13.735  -8.603
  909    HD3  ARG 114           HD1      ARG 114 112.498  15.016  -7.418
  910    HE   ARG 114           HE       ARG 114 113.613  16.279  -9.599
  911   HH11  ARG 114          HH21      ARG 114 110.873  14.260  -8.978
  912   HH12  ARG 114          HH22      ARG 114 109.896  14.969 -10.222
  913   HH21  ARG 114          HH11      ARG 114 112.337  17.213 -11.232
  914   HH22  ARG 114          HH12      ARG 114 110.725  16.639 -11.497
  915    H    GLU 115           HN       GLU 115 117.894  13.879  -6.478
  916    HA   GLU 115           HA       GLU 115 117.467  11.296  -5.760
  917    HB2  GLU 115           HB2      GLU 115 118.379  10.224  -7.607
  918    HB3  GLU 115           HB1      GLU 115 119.594  11.475  -7.863
  919    HG2  GLU 115           HG2      GLU 115 120.962  10.668  -6.115
  920    HG3  GLU 115           HG1      GLU 115 119.651   9.730  -5.404
  921    H    LEU 116           HN       LEU 116 120.220  13.457  -6.285
  922    HA   LEU 116           HA       LEU 116 121.572  12.853  -3.863
  923    HB2  LEU 116           HB2      LEU 116 122.630  13.893  -5.863
  924    HB3  LEU 116           HB1      LEU 116 121.729  15.370  -5.534
  925    HG   LEU 116           HG       LEU 116 123.211  14.315  -3.198
  926   HD11  LEU 116          HD11      LEU 116 124.871  13.743  -4.856
  927   HD12  LEU 116          HD12      LEU 116 125.388  15.236  -4.073
  928   HD13  LEU 116          HD13      LEU 116 124.656  15.289  -5.676
  929   HD21  LEU 116          HD21      LEU 116 123.817  16.710  -3.006
  930   HD22  LEU 116          HD22      LEU 116 122.077  16.504  -3.212
  931   HD23  LEU 116          HD23      LEU 116 123.072  17.018  -4.574
  932    H    ALA 117           HN       ALA 117 119.121  15.215  -4.750
  933    HA   ALA 117           HA       ALA 117 119.392  16.785  -2.453
  934    HB1  ALA 117           HB1      ALA 117 117.374  16.567  -4.618
  935    HB2  ALA 117           HB2      ALA 117 118.157  18.002  -3.958
  936    HB3  ALA 117           HB3      ALA 117 116.788  17.278  -3.114
  937    H    LEU 118           HN       LEU 118 117.950  13.770  -2.993
  938    HA   LEU 118           HA       LEU 118 115.954  13.657  -0.975
  939    HB2  LEU 118           HB2      LEU 118 117.756  11.376  -1.833
  940    HB3  LEU 118           HB1      LEU 118 116.151  11.253  -1.113
  941    HG   LEU 118           HG       LEU 118 116.828  12.421  -3.827
  942   HD11  LEU 118          HD11      LEU 118 115.530  10.561  -4.692
  943   HD12  LEU 118          HD12      LEU 118 115.100  10.053  -3.059
  944   HD13  LEU 118          HD13      LEU 118 116.769   9.919  -3.614
  945   HD21  LEU 118          HD21      LEU 118 114.312  12.449  -2.168
  946   HD22  LEU 118          HD22      LEU 118 114.217  12.458  -3.929
  947   HD23  LEU 118          HD23      LEU 118 115.046  13.765  -3.085
  948    H    LEU 119           HN       LEU 119 119.397  13.124  -0.968
  949    HA   LEU 119           HA       LEU 119 119.729  12.275   1.707
  950    HB2  LEU 119           HB2      LEU 119 121.546  13.763  -0.182
  951    HB3  LEU 119           HB1      LEU 119 122.037  13.471   1.486
  952    HG   LEU 119           HG       LEU 119 122.790  11.696  -0.156
  953   HD11  LEU 119          HD11      LEU 119 122.139  11.412   2.421
  954   HD12  LEU 119          HD12      LEU 119 122.597  10.029   1.431
  955   HD13  LEU 119          HD13      LEU 119 120.895  10.363   1.739
  956   HD21  LEU 119          HD21      LEU 119 121.201  10.221  -1.139
  957   HD22  LEU 119          HD22      LEU 119 120.570  11.841  -1.436
  958   HD23  LEU 119          HD23      LEU 119 119.887  10.852  -0.146
  959    H    VAL 120           HN       VAL 120 119.736  15.527   0.287
  960    HA   VAL 120           HA       VAL 120 119.951  17.047   2.684
  961    HB   VAL 120           HB       VAL 120 118.408  17.783   0.189
  962   HG11  VAL 120          HG11      VAL 120 119.649  19.293   2.486
  963   HG12  VAL 120          HG12      VAL 120 118.015  19.420   1.836
  964   HG13  VAL 120          HG13      VAL 120 119.377  20.076   0.929
  965   HG21  VAL 120          HG21      VAL 120 120.532  18.722  -0.642
  966   HG22  VAL 120          HG22      VAL 120 120.676  16.981  -0.398
  967   HG23  VAL 120          HG23      VAL 120 121.369  18.097   0.780
  968    H    SER 121           HN       SER 121 117.698  14.788   2.006
  969    HA   SER 121           HA       SER 121 115.511  16.258   3.356
  970    HB2  SER 121           HB2      SER 121 115.237  14.709   1.218
  971    HB3  SER 121           HB1      SER 121 115.232  13.421   2.420
  972    HG   SER 121           HG       SER 121 113.165  14.004   2.392
  973    H    ALA 122           HN       ALA 122 117.525  13.377   3.522
  974    HA   ALA 122           HA       ALA 122 117.042  13.216   6.442
  975    HB1  ALA 122           HB1      ALA 122 117.211  10.758   6.231
  976    HB2  ALA 122           HB2      ALA 122 117.292  10.932   4.478
  977    HB3  ALA 122           HB3      ALA 122 115.835  11.414   5.346
  978    H    HIS 123           HN       HIS 123 119.142  14.661   6.006
  979    HA   HIS 123           HA       HIS 123 121.510  13.505   5.115
  980    HB2  HIS 123           HB2      HIS 123 122.484  15.460   5.756
  981    HB3  HIS 123           HB1      HIS 123 120.820  15.972   6.016
  982    HD2  HIS 123           HD2      HIS 123 120.438  14.335   8.956
  983    HE1  HIS 123           HE1      HIS 123 123.638  16.800  10.180
  984    HE2  HIS 123           HE2      HIS 123 121.739  15.324  10.993
  985    H    ASP 124           HN       ASP 124 123.286  13.891   7.319
  986    HA   ASP 124           HA       ASP 124 122.987  12.634   9.670
  987    HB2  ASP 124           HB2      ASP 124 121.951  10.682   8.798
  988    HB3  ASP 124           HB1      ASP 124 123.122  10.548   7.489
  989    H    ASP 125           HN       ASP 125 124.835  12.958   6.771
  990    HA   ASP 125           HA       ASP 125 127.367  12.163   7.899
  991    HB2  ASP 125           HB2      ASP 125 126.974  13.880   5.452
  992    HB3  ASP 125           HB1      ASP 125 128.302  12.779   5.815
  993   H5'1  C2E 501          H5'1      C2E 501 105.489   3.262  10.362
  994   H5'2  C2E 501          H5'2      C2E 501 104.765   1.886  11.213
  995    H4'  C2E 501           H4'      C2E 501 107.020   0.676  10.471
  996    H3'  C2E 501           H3'      C2E 501 106.853   3.055   8.634
  997    H2'  C2E 501           H2'      C2E 501 106.969   1.794   6.672
  998   HO2'  C2E 501          HO2'      C2E 501 107.272  -0.676   7.137
  999    H1'  C2E 501           H1'      C2E 501 105.266  -0.167   7.314
 1000    H8   C2E 501           H8       C2E 501 103.630   2.435   9.317
 1001    HN1  C2E 501           HN1      C2E 501 103.163   3.801   3.088
 1002   HN21  C2E 501          HN21      C2E 501 104.520   2.496   1.917
 1003   HN22  C2E 501          HN22      C2E 501 105.537   1.288   2.668
 1004   H511  C2E 501          H511      C2E 501 108.238   4.416   9.982
 1005   H512  C2E 501          H512      C2E 501 109.941   4.437  10.490
 1006    H4A  C2E 501           H4A      C2E 501 109.116   5.147  12.795
 1007    H3A  C2E 501           H3A      C2E 501 106.445   5.238  11.385
 1008    H2A  C2E 501           H2A      C2E 501 105.931   7.285  12.312
 1009   HO2A  C2E 501          HO2A      C2E 501 106.483   7.088  14.419
 1010    H1A  C2E 501           H1A      C2E 501 108.343   8.517  12.052
 1011    H81  C2E 501           H81      C2E 501 108.401   6.436   8.996
 1012   HN11  C2E 501          HN11      C2E 501 104.406  11.385   8.360
 1013   HN24  C2E 501          HN24      C2E 501 104.682  11.667  11.829
 1014   HN23  C2E 501          HN23      C2E 501 103.970  12.274  10.351
 1015   H5'1  C2E 502          H5'1      C2E 502 101.296   9.986   4.240
 1016   H5'2  C2E 502          H5'2      C2E 502 100.019  11.176   3.910
 1017    H4'  C2E 502           H4'      C2E 502  99.838  11.780   6.105
 1018    H3'  C2E 502           H3'      C2E 502 102.821  11.325   6.297
 1019    H2'  C2E 502           H2'      C2E 502 102.561  11.128   8.671
 1020   HO2'  C2E 502          HO2'      C2E 502 101.034  12.857   8.903
 1021    H1'  C2E 502           H1'      C2E 502 100.402   9.507   8.585
 1022    H8   C2E 502           H8       C2E 502 102.602   8.622   5.594
 1023    HN1  C2E 502           HN1      C2E 502 104.337   5.798  11.063
 1024   HN21  C2E 502          HN21      C2E 502 103.217   6.644  12.763
 1025   HN22  C2E 502          HN22      C2E 502 102.034   7.921  12.566
 1026   H511  C2E 502          H511      C2E 502 103.662  16.304   5.515
 1027   H512  C2E 502          H512      C2E 502 102.480  15.070   5.036
 1028    H4A  C2E 502           H4A      C2E 502 104.053  15.756   3.201
 1029    H3A  C2E 502           H3A      C2E 502 104.016  12.857   4.125
 1030    H2A  C2E 502           H2A      C2E 502 105.642  12.345   2.512
 1031   HO2A  C2E 502          HO2A      C2E 502 105.798  13.398   0.656
 1032    H1A  C2E 502           H1A      C2E 502 107.185  14.604   2.789
 1033    H81  C2E 502           H81      C2E 502 106.465  13.910   6.306
 1034   HN11  C2E 502          HN11      C2E 502 110.480   9.637   3.752
 1035   HN24  C2E 502          HN24      C2E 502 110.402   9.746   1.539
 1036   HN23  C2E 502          HN23      C2E 502 109.369  10.876   0.692
  Start of MODEL   10
    1    H    MET   1           H        MET   1 110.259  22.112  19.316
    2    HA   MET   1           HA       MET   1 109.148  20.484  20.292
    3    HB2  MET   1           HB2      MET   1 107.601  22.768  21.540
    4    HB3  MET   1           HB1      MET   1 107.276  21.077  21.923
    5    HG2  MET   1           HG2      MET   1 109.453  20.754  22.827
    6    HG3  MET   1           HG1      MET   1 110.049  22.258  22.128
    7    HE1  MET   1           HE1      MET   1 109.280  20.672  25.297
    8    HE2  MET   1           HE2      MET   1 109.649  22.124  26.226
    9    HE3  MET   1           HE3      MET   1 110.717  21.630  24.915
   10    H    SER   2           HN       SER   2 107.985  22.425  17.966
   11    HA   SER   2           HA       SER   2 105.410  21.008  17.665
   12    HB2  SER   2           HB2      SER   2 104.739  22.780  16.204
   13    HB3  SER   2           HB1      SER   2 105.458  23.534  17.624
   14    HG   SER   2           HG       SER   2 106.136  24.179  15.347
   15    H    ASP   3           HN       ASP   3 106.318  19.057  16.899
   16    HA   ASP   3           HA       ASP   3 107.635  19.248  14.273
   17    HB2  ASP   3           HB2      ASP   3 107.307  16.694  15.858
   18    HB3  ASP   3           HB1      ASP   3 108.483  17.051  14.593
   19    H    GLN   4           HN       GLN   4 106.155  19.445  12.766
   20    HA   GLN   4           HA       GLN   4 103.746  17.737  12.880
   21    HB2  GLN   4           HB2      GLN   4 103.681  19.796  10.827
   22    HB3  GLN   4           HB1      GLN   4 102.560  19.505  12.155
   23    HG2  GLN   4           HG2      GLN   4 103.432  21.660  12.582
   24    HG3  GLN   4           HG1      GLN   4 104.338  20.607  13.664
   25   HE21  GLN   4          HE21      GLN   4 105.978  19.494  11.403
   26   HE22  GLN   4          HE22      GLN   4 107.075  20.721  10.993
   27    H    HIS   5           HN       HIS   5 106.476  18.687  10.868
   28    HA   HIS   5           HA       HIS   5 105.651  16.683   8.857
   29    HB2  HIS   5           HB2      HIS   5 107.531  19.037   8.554
   30    HB3  HIS   5           HB1      HIS   5 107.046  17.923   7.274
   31    HD2  HIS   5           HD2      HIS   5 103.779  18.086   8.638
   32    HE1  HIS   5           HE1      HIS   5 104.043  21.923   6.897
   33    HE2  HIS   5           HE2      HIS   5 102.449  20.187   7.840
   34    H    ASP   6           HN       ASP   6 108.838  17.835   8.622
   35    HA   ASP   6           HA       ASP   6 110.853  16.800   8.766
   36    HB2  ASP   6           HB2      ASP   6 109.520  16.036  11.350
   37    HB3  ASP   6           HB1      ASP   6 111.124  15.408  10.965
   38    H    GLU   7           HN       GLU   7 111.957  14.603   8.740
   39    HA   GLU   7           HA       GLU   7 110.120  12.632   7.554
   40    HB2  GLU   7           HB2      GLU   7 111.795  13.282   5.999
   41    HB3  GLU   7           HB1      GLU   7 113.071  13.091   7.204
   42    HG2  GLU   7           HG2      GLU   7 111.419  10.675   6.698
   43    HG3  GLU   7           HG1      GLU   7 112.457  11.176   5.371
   44    H    ARG   8           HN       ARG   8 109.713  10.765   8.519
   45    HA   ARG   8           HA       ARG   8 111.518   9.861  10.686
   46    HB2  ARG   8           HB2      ARG   8 108.521   9.987  10.574
   47    HB3  ARG   8           HB1      ARG   8 109.331   8.799  11.579
   48    HG2  ARG   8           HG2      ARG   8 109.065  10.577  13.066
   49    HG3  ARG   8           HG1      ARG   8 110.706  10.825  12.483
   50    HD2  ARG   8           HD2      ARG   8 109.197  12.882  12.543
   51    HD3  ARG   8           HD1      ARG   8 110.038  12.579  11.034
   52    HE   ARG   8           HE       ARG   8 107.821  11.468  10.345
   53   HH11  ARG   8          HH21      ARG   8 108.085  14.092  12.608
   54   HH12  ARG   8          HH22      ARG   8 106.544  14.766  12.201
   55   HH21  ARG   8          HH11      ARG   8 105.813  12.372   9.814
   56   HH22  ARG   8          HH12      ARG   8 105.265  13.798  10.628
   57    H    ARG   9           HN       ARG   9 110.036   9.085   7.712
   58    HA   ARG   9           HA       ARG   9 110.553   6.192   8.138
   59    HB2  ARG   9           HB2      ARG   9 109.016   5.987   6.026
   60    HB3  ARG   9           HB1      ARG   9 108.285   6.204   7.608
   61    HG2  ARG   9           HG2      ARG   9 108.190   8.653   7.184
   62    HG3  ARG   9           HG1      ARG   9 108.806   8.366   5.562
   63    HD2  ARG   9           HD2      ARG   9 106.863   7.156   4.931
   64    HD3  ARG   9           HD1      ARG   9 106.333   6.991   6.600
   65    HE   ARG   9           HE       ARG   9 105.753   9.340   6.596
   66   HH11  ARG   9          HH21      ARG   9 106.698   8.018   3.527
   67   HH12  ARG   9          HH22      ARG   9 105.922   9.263   2.607
   68   HH21  ARG   9          HH11      ARG   9 104.743  10.961   5.386
   69   HH22  ARG   9          HH12      ARG   9 104.817  10.926   3.657
   70    H    ARG  10           HN       ARG  10 112.729   6.525   7.630
   71    HA   ARG  10           HA       ARG  10 114.506   7.201   6.186
   72    HB2  ARG  10           HB2      ARG  10 114.310   5.230   4.311
   73    HB3  ARG  10           HB1      ARG  10 114.913   4.985   5.945
   74    HG2  ARG  10           HG2      ARG  10 111.952   4.792   5.484
   75    HG3  ARG  10           HG1      ARG  10 112.974   3.458   4.967
   76    HD2  ARG  10           HD2      ARG  10 113.839   3.144   7.186
   77    HD3  ARG  10           HD1      ARG  10 113.087   4.630   7.754
   78    HE   ARG  10           HE       ARG  10 111.027   3.512   7.860
   79   HH11  ARG  10          HH21      ARG  10 113.487   1.609   6.340
   80   HH12  ARG  10          HH22      ARG  10 112.567   0.143   6.373
   81   HH21  ARG  10          HH11      ARG  10 109.815   1.590   7.902
   82   HH22  ARG  10          HH12      ARG  10 110.489   0.131   7.258
   83    H    PHE  11           HN       PHE  11 112.335   5.925   3.680
   84    HA   PHE  11           HA       PHE  11 112.588   8.521   2.277
   85    HB2  PHE  11           HB2      PHE  11 113.484   6.010   1.431
   86    HB3  PHE  11           HB1      PHE  11 111.988   6.260   0.534
   87    HD1  PHE  11           HD1      PHE  11 114.934   8.315   1.649
   88    HD2  PHE  11           HD2      PHE  11 112.213   7.331  -1.528
   89    HE1  PHE  11           HE1      PHE  11 116.104   9.908   0.154
   90    HE2  PHE  11           HE2      PHE  11 113.384   8.923  -3.024
   91    HZ   PHE  11           HZ       PHE  11 115.330  10.216  -2.181
   92    H    HIS  12           HN       HIS  12 110.824   8.769   0.560
   93    HA   HIS  12           HA       HIS  12 108.289   8.716   1.891
   94    HB2  HIS  12           HB2      HIS  12 107.454   9.827  -0.099
   95    HB3  HIS  12           HB1      HIS  12 109.014  10.524   0.338
   96    HD2  HIS  12           HD2      HIS  12 108.746  10.973  -2.706
   97    HE1  HIS  12           HE1      HIS  12 110.506   7.201  -3.408
   98    HE2  HIS  12           HE2      HIS  12 109.905   9.430  -4.466
   99    H    ARG  13           HN       ARG  13 109.904   6.283   0.378
  100    HA   ARG  13           HA       ARG  13 109.260   4.202  -0.350
  101    HB2  ARG  13           HB2      ARG  13 106.385   4.939   0.206
  102    HB3  ARG  13           HB1      ARG  13 107.135   3.349   0.229
  103    HG2  ARG  13           HG2      ARG  13 107.902   3.596   2.362
  104    HG3  ARG  13           HG1      ARG  13 108.364   5.276   2.108
  105    HD2  ARG  13           HD2      ARG  13 105.549   4.259   2.583
  106    HD3  ARG  13           HD1      ARG  13 106.542   5.134   3.743
  107    HE   ARG  13           HE       ARG  13 106.403   6.754   1.497
  108   HH11  ARG  13          HH21      ARG  13 104.224   5.268   3.736
  109   HH12  ARG  13          HH22      ARG  13 103.025   6.511   3.609
  110   HH21  ARG  13          HH11      ARG  13 104.832   8.390   1.324
  111   HH22  ARG  13          HH12      ARG  13 103.370   8.278   2.246
  112    H    ILE  14           HN       ILE  14 107.557   3.172  -1.970
  113    HA   ILE  14           HA       ILE  14 107.724   4.794  -4.376
  114    HB   ILE  14           HB       ILE  14 106.923   1.951  -3.808
  115   HG12  ILE  14          HG12      ILE  14 108.885   1.444  -5.151
  116   HG13  ILE  14          HG11      ILE  14 109.097   3.147  -5.551
  117   HG21  ILE  14          HG21      ILE  14 105.438   2.457  -5.560
  118   HG22  ILE  14          HG22      ILE  14 106.857   1.850  -6.413
  119   HG23  ILE  14          HG23      ILE  14 106.565   3.586  -6.313
  120   HD11  ILE  14          HD11      ILE  14 110.562   2.178  -3.653
  121   HD12  ILE  14          HD12      ILE  14 109.089   2.205  -2.684
  122   HD13  ILE  14          HD13      ILE  14 109.738   3.706  -3.345
  123    H    ALA  15           HN       ALA  15 106.186   6.330  -4.553
  124    HA   ALA  15           HA       ALA  15 103.441   5.692  -3.738
  125    HB1  ALA  15           HB1      ALA  15 104.828   8.261  -4.482
  126    HB2  ALA  15           HB2      ALA  15 104.130   7.806  -2.928
  127    HB3  ALA  15           HB3      ALA  15 103.077   8.155  -4.300
  128    H    PHE  16           HN       PHE  16 102.070   4.945  -5.115
  129    HA   PHE  16           HA       PHE  16 101.848   6.044  -7.787
  130    HB2  PHE  16           HB2      PHE  16 102.037   4.012  -8.989
  131    HB3  PHE  16           HB1      PHE  16 103.444   4.058  -7.934
  132    HD1  PHE  16           HD2      PHE  16 102.494   3.183  -5.344
  133    HD2  PHE  16           HD1      PHE  16 101.342   1.813  -9.251
  134    HE1  PHE  16           HE2      PHE  16 101.846   0.992  -4.390
  135    HE2  PHE  16           HE1      PHE  16 100.706  -0.380  -8.292
  136    HZ   PHE  16           HZ       PHE  16 100.968  -0.794  -5.865
  137    H    ASP  17           HN       ASP  17  99.720   5.554  -8.723
  138    HA   ASP  17           HA       ASP  17  97.795   5.105  -6.569
  139    HB2  ASP  17           HB2      ASP  17  96.144   5.941  -8.285
  140    HB3  ASP  17           HB1      ASP  17  97.401   7.094  -7.840
  141    H    ALA  18           HN       ALA  18  96.155   3.576  -6.658
  142    HA   ALA  18           HA       ALA  18  95.551   1.919  -8.823
  143    HB1  ALA  18           HB1      ALA  18  97.678   0.875  -6.962
  144    HB2  ALA  18           HB2      ALA  18  97.648   0.848  -8.725
  145    HB3  ALA  18           HB3      ALA  18  96.591  -0.226  -7.810
  146    H    ASP  19           HN       ASP  19  94.432  -0.187  -7.981
  147    HA   ASP  19           HA       ASP  19  92.667   0.698  -5.793
  148    HB2  ASP  19           HB2      ASP  19  92.010  -0.293  -8.204
  149    HB3  ASP  19           HB1      ASP  19  92.108  -1.805  -7.311
  150    H    SER  20           HN       SER  20  92.564  -0.291  -3.856
  151    HA   SER  20           HA       SER  20  93.910  -2.896  -3.541
  152    HB2  SER  20           HB2      SER  20  94.764  -2.067  -1.319
  153    HB3  SER  20           HB1      SER  20  95.522  -1.312  -2.719
  154    HG   SER  20           HG       SER  20  94.597   0.023  -0.849
  155    H    GLU  21           HN       GLU  21  93.140  -4.164  -1.835
  156    HA   GLU  21           HA       GLU  21  90.588  -3.295  -0.596
  157    HB2  GLU  21           HB2      GLU  21  91.068  -6.111  -1.595
  158    HB3  GLU  21           HB1      GLU  21  89.550  -5.384  -1.071
  159    HG2  GLU  21           HG2      GLU  21  91.081  -4.337  -3.458
  160    HG3  GLU  21           HG1      GLU  21  89.894  -5.631  -3.600
  161    H    ILE  22           HN       ILE  22  90.161  -4.266   1.446
  162    HA   ILE  22           HA       ILE  22  92.442  -5.753   2.591
  163    HB   ILE  22           HB       ILE  22  91.105  -3.329   3.794
  164   HG12  ILE  22          HG12      ILE  22  93.896  -3.935   2.778
  165   HG13  ILE  22          HG11      ILE  22  92.761  -2.755   2.128
  166   HG21  ILE  22          HG21      ILE  22  93.305  -5.073   4.954
  167   HG22  ILE  22          HG22      ILE  22  91.621  -5.148   5.466
  168   HG23  ILE  22          HG23      ILE  22  92.554  -3.677   5.720
  169   HD11  ILE  22          HD11      ILE  22  94.209  -2.669   4.779
  170   HD12  ILE  22          HD12      ILE  22  92.834  -1.625   4.414
  171   HD13  ILE  22          HD13      ILE  22  94.307  -1.514   3.450
  172    H    LEU  23           HN       LEU  23  91.952  -7.365   3.906
  173    HA   LEU  23           HA       LEU  23  89.114  -7.765   4.687
  174    HB2  LEU  23           HB2      LEU  23  90.964 -10.058   4.177
  175    HB3  LEU  23           HB1      LEU  23  89.208  -9.971   4.043
  176    HG   LEU  23           HG       LEU  23  89.861  -8.158   2.159
  177   HD11  LEU  23          HD11      LEU  23  92.257  -8.354   2.383
  178   HD12  LEU  23          HD12      LEU  23  91.786  -9.110   0.863
  179   HD13  LEU  23          HD13      LEU  23  92.172 -10.113   2.258
  180   HD21  LEU  23          HD21      LEU  23  88.464 -10.244   1.924
  181   HD22  LEU  23          HD22      LEU  23  89.955 -11.147   1.651
  182   HD23  LEU  23          HD23      LEU  23  89.462  -9.896   0.512
  183    H    GLN  24           HN       GLN  24  88.825  -7.857   6.755
  184    HA   GLN  24           HA       GLN  24  90.980  -8.965   8.482
  185    HB2  GLN  24           HB2      GLN  24  91.016  -6.610   8.897
  186    HB3  GLN  24           HB1      GLN  24  89.257  -6.532   8.985
  187    HG2  GLN  24           HG2      GLN  24  89.190  -7.666  11.057
  188    HG3  GLN  24           HG1      GLN  24  90.833  -8.278  10.874
  189   HE21  GLN  24          HE21      GLN  24  88.938  -5.659  12.116
  190   HE22  GLN  24          HE22      GLN  24  90.233  -4.672  12.591
  191    H    GLY  25           HN       GLY  25  90.107 -10.967   8.886
  192    HA2  GLY  25           HA2      GLY  25  88.778 -12.416  10.122
  193    HA3  GLY  25           HA1      GLY  25  87.730 -11.061  10.543
  194    H    GLU  26           HN       GLU  26  85.735 -11.407   9.806
  195    HA   GLU  26           HA       GLU  26  85.336 -12.845   7.262
  196    HB2  GLU  26           HB2      GLU  26  82.955 -12.949   8.045
  197    HB3  GLU  26           HB1      GLU  26  84.095 -13.756   9.120
  198    HG2  GLU  26           HG2      GLU  26  84.076 -11.930  10.668
  199    HG3  GLU  26           HG1      GLU  26  83.218 -10.892   9.532
  200    H    ARG  27           HN       ARG  27  85.994  -9.839   7.985
  201    HA   ARG  27           HA       ARG  27  83.807  -8.604   6.417
  202    HB2  ARG  27           HB2      ARG  27  85.629  -7.577   8.554
  203    HB3  ARG  27           HB1      ARG  27  84.756  -6.497   7.470
  204    HG2  ARG  27           HG2      ARG  27  82.686  -7.064   8.324
  205    HG3  ARG  27           HG1      ARG  27  83.199  -8.690   8.772
  206    HD2  ARG  27           HD2      ARG  27  84.143  -7.995  10.762
  207    HD3  ARG  27           HD1      ARG  27  84.469  -6.372  10.160
  208    HE   ARG  27           HE       ARG  27  82.259  -5.756  10.699
  209   HH11  ARG  27          HH21      ARG  27  82.870  -9.129  11.206
  210   HH12  ARG  27          HH22      ARG  27  81.436  -9.385  12.142
  211   HH21  ARG  27          HH11      ARG  27  80.383  -6.090  11.923
  212   HH22  ARG  27          HH12      ARG  27  80.028  -7.666  12.547
  213    H    ARG  28           HN       ARG  28  84.254  -7.579   4.554
  214    HA   ARG  28           HA       ARG  28  87.078  -6.994   3.849
  215    HB2  ARG  28           HB2      ARG  28  86.467  -8.944   2.563
  216    HB3  ARG  28           HB1      ARG  28  84.936  -8.211   2.084
  217    HG2  ARG  28           HG2      ARG  28  86.091  -6.490   0.810
  218    HG3  ARG  28           HG1      ARG  28  87.655  -7.043   1.405
  219    HD2  ARG  28           HD2      ARG  28  87.257  -9.236   0.286
  220    HD3  ARG  28           HD1      ARG  28  85.753  -8.601  -0.366
  221    HE   ARG  28           HE       ARG  28  88.461  -7.878  -1.213
  222   HH11  ARG  28          HH21      ARG  28  85.055  -7.252  -1.270
  223   HH12  ARG  28          HH22      ARG  28  85.108  -6.346  -2.745
  224   HH21  ARG  28          HH11      ARG  28  88.533  -6.693  -3.145
  225   HH22  ARG  28          HH12      ARG  28  87.076  -6.029  -3.806
  226    H    TRP  29           HN       TRP  29  87.401  -5.218   2.529
  227    HA   TRP  29           HA       TRP  29  85.137  -3.482   1.898
  228    HB2  TRP  29           HB2      TRP  29  87.465  -2.642   3.627
  229    HB3  TRP  29           HB1      TRP  29  86.175  -1.584   3.055
  230    HD1  TRP  29           HD1      TRP  29  83.609  -2.504   3.836
  231    HE1  TRP  29           HE1      TRP  29  82.928  -3.329   6.193
  232    HE3  TRP  29           HE3      TRP  29  88.190  -3.718   5.669
  233    HZ2  TRP  29           HZ2      TRP  29  84.198  -4.372   8.547
  234    HZ3  TRP  29           HZ3      TRP  29  88.449  -4.620   7.956
  235    HH2  TRP  29           HH2      TRP  29  86.456  -4.958   9.401
  236    H    GLU  30           HN       GLU  30  85.720  -1.767   0.457
  237    HA   GLU  30           HA       GLU  30  88.082  -2.413  -1.153
  238    HB2  GLU  30           HB2      GLU  30  85.894  -0.494  -1.937
  239    HB3  GLU  30           HB1      GLU  30  86.999  -1.392  -2.978
  240    HG2  GLU  30           HG2      GLU  30  85.894  -3.507  -1.909
  241    HG3  GLU  30           HG1      GLU  30  84.601  -2.397  -1.460
  242    H    VAL  31           HN       VAL  31  89.718  -0.843  -1.481
  243    HA   VAL  31           HA       VAL  31  89.306   1.889  -0.489
  244    HB   VAL  31           HB       VAL  31  91.444   1.699   0.843
  245   HG11  VAL  31          HG11      VAL  31  89.133   1.715   1.824
  246   HG12  VAL  31          HG12      VAL  31  90.310   0.836   2.799
  247   HG13  VAL  31          HG13      VAL  31  89.160  -0.048   1.798
  248   HG21  VAL  31          HG21      VAL  31  90.840  -1.267   0.660
  249   HG22  VAL  31          HG22      VAL  31  92.180  -0.506   1.516
  250   HG23  VAL  31          HG23      VAL  31  92.127  -0.473  -0.245
  251    H    LEU  32           HN       LEU  32  90.992   3.331  -1.074
  252    HA   LEU  32           HA       LEU  32  92.367   2.511  -3.548
  253    HB2  LEU  32           HB2      LEU  32  92.682   4.975  -3.884
  254    HB3  LEU  32           HB1      LEU  32  90.989   4.501  -3.812
  255    HG   LEU  32           HG       LEU  32  92.525   5.534  -1.410
  256   HD11  LEU  32          HD11      LEU  32  90.681   7.065  -3.266
  257   HD12  LEU  32          HD12      LEU  32  92.437   7.228  -3.231
  258   HD13  LEU  32          HD13      LEU  32  91.478   7.700  -1.827
  259   HD21  LEU  32          HD21      LEU  32  89.807   6.117  -1.158
  260   HD22  LEU  32          HD22      LEU  32  90.656   4.799  -0.355
  261   HD23  LEU  32          HD23      LEU  32  89.815   4.507  -1.876
  262    H    LEU  33           HN       LEU  33  94.543   2.290  -3.556
  263    HA   LEU  33           HA       LEU  33  95.945   2.887  -1.046
  264    HB2  LEU  33           HB2      LEU  33  96.307   0.651  -1.826
  265    HB3  LEU  33           HB1      LEU  33  96.677   1.204  -3.456
  266    HG   LEU  33           HG       LEU  33  98.395   2.383  -1.340
  267   HD11  LEU  33          HD11      LEU  33  99.745   0.362  -1.048
  268   HD12  LEU  33          HD12      LEU  33  98.623  -0.559  -2.049
  269   HD13  LEU  33          HD13      LEU  33  98.102   0.066  -0.485
  270   HD21  LEU  33          HD21      LEU  33  99.199   0.864  -3.827
  271   HD22  LEU  33          HD22      LEU  33 100.064   2.166  -3.010
  272   HD23  LEU  33          HD23      LEU  33  98.595   2.518  -3.918
  273    H    HIS  34           HN       HIS  34  97.183   4.567  -0.833
  274    HA   HIS  34           HA       HIS  34  97.722   6.230  -3.169
  275    HB2  HIS  34           HB2      HIS  34  98.007   6.654  -0.191
  276    HB3  HIS  34           HB1      HIS  34  98.462   7.877  -1.387
  277    HD2  HIS  34           HD2      HIS  34  95.130   5.739  -0.841
  278    HE1  HIS  34           HE1      HIS  34  94.091   9.723  -1.748
  279    HE2  HIS  34           HE2      HIS  34  93.171   7.425  -1.200
  280    H    ASP  35           HN       ASP  35  99.514   4.113  -1.030
  281    HA   ASP  35           HA       ASP  35 101.640   4.120  -2.843
  282    HB2  ASP  35           HB2      ASP  35 103.432   5.243  -1.574
  283    HB3  ASP  35           HB1      ASP  35 102.096   6.365  -1.851
  284    H    VAL  36           HN       VAL  36 103.511   2.828  -2.147
  285    HA   VAL  36           HA       VAL  36 103.038   1.110   0.179
  286    HB   VAL  36           HB       VAL  36 101.887   0.140  -1.891
  287   HG11  VAL  36          HG11      VAL  36 103.869   0.902  -3.362
  288   HG12  VAL  36          HG12      VAL  36 103.214  -0.708  -3.664
  289   HG13  VAL  36          HG13      VAL  36 104.707  -0.520  -2.746
  290   HG21  VAL  36          HG21      VAL  36 102.518  -2.086  -1.340
  291   HG22  VAL  36          HG22      VAL  36 102.764  -1.170   0.142
  292   HG23  VAL  36          HG23      VAL  36 104.144  -1.596  -0.869
  293    H    SER  37           HN       SER  37 104.839  -0.466   0.445
  294    HA   SER  37           HA       SER  37 107.408   0.414  -0.645
  295    HB2  SER  37           HB2      SER  37 106.895   1.555   1.622
  296    HB3  SER  37           HB1      SER  37 107.075  -0.050   2.321
  297    HG   SER  37           HG       SER  37 108.996   1.151   0.615
  298    H    LEU  38           HN       LEU  38 109.123  -1.273   0.079
  299    HA   LEU  38           HA       LEU  38 108.107  -3.822  -0.634
  300    HB2  LEU  38           HB2      LEU  38 110.401  -3.153  -1.179
  301    HB3  LEU  38           HB1      LEU  38 110.801  -3.071   0.535
  302    HG   LEU  38           HG       LEU  38 109.608  -5.646  -0.294
  303   HD11  LEU  38          HD11      LEU  38 110.875  -5.285  -2.317
  304   HD12  LEU  38          HD12      LEU  38 111.777  -6.422  -1.315
  305   HD13  LEU  38          HD13      LEU  38 112.276  -4.732  -1.400
  306   HD21  LEU  38          HD21      LEU  38 110.786  -4.933   1.922
  307   HD22  LEU  38          HD22      LEU  38 112.282  -5.173   1.023
  308   HD23  LEU  38          HD23      LEU  38 111.166  -6.519   1.250
  309    H    HIS  39           HN       HIS  39 107.798  -2.219   2.225
  310    HA   HIS  39           HA       HIS  39 107.111  -4.664   3.634
  311    HB2  HIS  39           HB2      HIS  39 109.564  -4.351   4.046
  312    HB3  HIS  39           HB1      HIS  39 109.186  -2.811   4.815
  313    HD2  HIS  39           HD2      HIS  39 108.161  -3.012   7.420
  314    HE1  HIS  39           HE1      HIS  39 108.077  -7.229   7.605
  315    HE2  HIS  39           HE2      HIS  39 107.787  -5.095   8.950
  316    H    GLY  40           HN       GLY  40 105.630  -2.338   2.712
  317    HA2  GLY  40           HA2      GLY  40 104.095  -1.819   5.036
  318    HA3  GLY  40           HA1      GLY  40 105.124  -0.435   4.693
  319    H    ILE  41           HN       ILE  41 102.267  -0.372   4.614
  320    HA   ILE  41           HA       ILE  41 101.870   0.517   1.845
  321    HB   ILE  41           HB       ILE  41 100.790  -1.376   1.276
  322   HG12  ILE  41          HG12      ILE  41  98.761  -0.550   3.384
  323   HG13  ILE  41          HG11      ILE  41  98.861   0.149   1.767
  324   HG21  ILE  41          HG21      ILE  41 101.832  -2.599   3.117
  325   HG22  ILE  41          HG22      ILE  41 100.158  -3.112   2.928
  326   HG23  ILE  41          HG23      ILE  41 100.599  -2.012   4.233
  327   HD11  ILE  41          HD11      ILE  41  97.222  -1.534   1.556
  328   HD12  ILE  41          HD12      ILE  41  98.132  -2.669   2.552
  329   HD13  ILE  41          HD13      ILE  41  98.683  -2.289   0.920
  330    H    LEU  42           HN       LEU  42 100.241   2.004   1.551
  331    HA   LEU  42           HA       LEU  42  98.986   3.081   4.011
  332    HB2  LEU  42           HB2      LEU  42 100.872   4.451   2.715
  333    HB3  LEU  42           HB1      LEU  42  99.522   4.866   1.669
  334    HG   LEU  42           HG       LEU  42  99.391   5.168   4.674
  335   HD11  LEU  42          HD11      LEU  42  99.851   7.590   4.251
  336   HD12  LEU  42          HD12      LEU  42 100.244   7.185   2.579
  337   HD13  LEU  42          HD13      LEU  42 101.234   6.555   3.895
  338   HD21  LEU  42          HD21      LEU  42  97.734   7.035   3.659
  339   HD22  LEU  42          HD22      LEU  42  97.205   5.385   3.968
  340   HD23  LEU  42          HD23      LEU  42  97.664   5.871   2.337
  341    H    VAL  43           HN       VAL  43  96.807   3.616   3.833
  342    HA   VAL  43           HA       VAL  43  95.552   3.441   1.187
  343    HB   VAL  43           HB       VAL  43  93.885   1.835   1.932
  344   HG11  VAL  43          HG11      VAL  43  95.283  -0.119   1.913
  345   HG12  VAL  43          HG12      VAL  43  96.645   0.775   2.588
  346   HG13  VAL  43          HG13      VAL  43  96.103   1.102   0.942
  347   HG21  VAL  43          HG21      VAL  43  95.485   1.897   4.506
  348   HG22  VAL  43          HG22      VAL  43  94.294   0.653   4.128
  349   HG23  VAL  43          HG23      VAL  43  93.789   2.333   4.297
  350    H    GLY  44           HN       GLY  44  93.108   3.779   1.450
  351    HA2  GLY  44           HA2      GLY  44  92.722   6.195   3.121
  352    HA3  GLY  44           HA1      GLY  44  91.759   5.756   1.711
  353    H    GLN  45           HN       GLN  45  90.945   6.339   4.616
  354    HA   GLN  45           HA       GLN  45  90.047   3.782   5.584
  355    HB2  GLN  45           HB2      GLN  45  90.800   5.543   7.113
  356    HB3  GLN  45           HB1      GLN  45  89.478   6.577   6.575
  357    HG2  GLN  45           HG2      GLN  45  87.831   5.177   7.521
  358    HG3  GLN  45           HG1      GLN  45  88.936   3.810   7.648
  359   HE21  GLN  45          HE21      GLN  45  87.831   4.155  10.000
  360   HE22  GLN  45          HE22      GLN  45  88.776   5.066  11.077
  361    HA   PRO  46           HA       PRO  46  86.171   4.670   3.398
  362    HB2  PRO  46           HB2      PRO  46  85.181   2.149   3.214
  363    HB3  PRO  46           HB1      PRO  46  86.553   2.676   2.214
  364    HG2  PRO  46           HG2      PRO  46  86.550   1.034   4.703
  365    HG3  PRO  46           HG1      PRO  46  87.543   0.868   3.246
  366    HD2  PRO  46           HD2      PRO  46  88.380   2.119   5.612
  367    HD3  PRO  46           HD1      PRO  46  89.126   2.350   4.022
  368    H    GLN  47           HN       GLN  47  83.852   4.496   3.943
  369    HA   GLN  47           HA       GLN  47  83.354   4.985   6.678
  370    HB2  GLN  47           HB2      GLN  47  81.046   5.221   6.044
  371    HB3  GLN  47           HB1      GLN  47  82.040   5.914   4.766
  372    HG2  GLN  47           HG2      GLN  47  80.758   3.165   4.757
  373    HG3  GLN  47           HG1      GLN  47  80.286   4.543   3.768
  374   HE21  GLN  47          HE21      GLN  47  82.180   5.428   2.326
  375   HE22  GLN  47          HE22      GLN  47  83.189   4.259   1.623
  376    H    ASP  48           HN       ASP  48  83.205   2.035   4.808
  377    HA   ASP  48           HA       ASP  48  81.595   0.653   6.799
  378    HB2  ASP  48           HB2      ASP  48  82.228  -1.347   5.247
  379    HB3  ASP  48           HB1      ASP  48  81.106  -0.119   4.666
  380    H    TRP  49           HN       TRP  49  84.636   1.638   7.003
  381    HA   TRP  49           HA       TRP  49  86.205  -0.637   7.515
  382    HB2  TRP  49           HB2      TRP  49  87.024   1.729   7.314
  383    HB3  TRP  49           HB1      TRP  49  86.418   2.011   8.943
  384    HD1  TRP  49           HD1      TRP  49  87.699   0.962  10.928
  385    HE1  TRP  49           HE1      TRP  49  90.060  -0.142  11.149
  386    HE3  TRP  49           HE3      TRP  49  88.623   0.075   6.043
  387    HZ2  TRP  49           HZ2      TRP  49  92.091  -1.280   9.327
  388    HZ3  TRP  49           HZ3      TRP  49  90.712  -1.012   5.293
  389    HH2  TRP  49           HH2      TRP  49  92.418  -1.695   6.942
  390    H    ASN  50           HN       ASN  50  84.315  -1.858   8.635
  391    HA   ASN  50           HA       ASN  50  84.152  -1.169  11.482
  392    HB2  ASN  50           HB2      ASN  50  82.063  -1.806  10.240
  393    HB3  ASN  50           HB1      ASN  50  82.739  -3.417  10.019
  394   HD21  ASN  50          HD21      ASN  50  83.696  -4.254  12.352
  395   HD22  ASN  50          HD22      ASN  50  82.579  -4.104  13.619
  396    H    GLY  51           HN       GLY  51  86.411  -1.634  11.832
  397    HA2  GLY  51           HA2      GLY  51  86.839  -4.478  12.448
  398    HA3  GLY  51           HA1      GLY  51  88.025  -3.663  11.433
  399    H    ASP  52           HN       ASP  52  88.636  -4.821  13.928
  400    HA   ASP  52           HA       ASP  52  88.891  -2.590  15.811
  401    HB2  ASP  52           HB2      ASP  52  88.211  -5.004  16.438
  402    HB3  ASP  52           HB1      ASP  52  89.925  -5.374  16.268
  403    HA   PRO  53           HA       PRO  53  92.924  -1.713  13.917
  404    HB2  PRO  53           HB2      PRO  53  93.163  -0.193  16.482
  405    HB3  PRO  53           HB1      PRO  53  93.520   0.332  14.825
  406    HG2  PRO  53           HG2      PRO  53  91.306   1.113  16.087
  407    HG3  PRO  53           HG1      PRO  53  91.317   0.775  14.347
  408    HD2  PRO  53           HD2      PRO  53  90.146  -0.837  16.565
  409    HD3  PRO  53           HD1      PRO  53  89.648  -0.722  14.862
  410    H    GLN  54           HN       GLN  54  92.232  -3.047  17.037
  411    HA   GLN  54           HA       GLN  54  94.962  -3.613  17.709
  412    HB2  GLN  54           HB2      GLN  54  92.328  -4.552  18.845
  413    HB3  GLN  54           HB1      GLN  54  93.886  -5.084  19.477
  414    HG2  GLN  54           HG2      GLN  54  94.501  -2.873  20.112
  415    HG3  GLN  54           HG1      GLN  54  93.197  -2.159  19.166
  416   HE21  GLN  54          HE21      GLN  54  93.907  -2.329  22.246
  417   HE22  GLN  54          HE22      GLN  54  92.409  -2.719  22.940
  418    H    ARG  55           HN       ARG  55  92.502  -5.196  15.847
  419    HA   ARG  55           HA       ARG  55  93.973  -7.737  15.891
  420    HB2  ARG  55           HB2      ARG  55  91.228  -6.894  15.062
  421    HB3  ARG  55           HB1      ARG  55  91.929  -8.304  14.272
  422    HG2  ARG  55           HG2      ARG  55  91.984  -9.555  16.224
  423    HG3  ARG  55           HG1      ARG  55  92.142  -8.137  17.256
  424    HD2  ARG  55           HD2      ARG  55  89.954  -8.692  17.720
  425    HD3  ARG  55           HD1      ARG  55  89.680  -7.644  16.336
  426    HE   ARG  55           HE       ARG  55  90.065 -10.369  15.537
  427   HH11  ARG  55          HH21      ARG  55  87.831  -8.100  16.893
  428   HH12  ARG  55          HH22      ARG  55  86.423  -8.949  16.351
  429   HH21  ARG  55          HH11      ARG  55  88.221 -11.492  14.825
  430   HH22  ARG  55          HH12      ARG  55  86.644 -10.871  15.180
  431    HA   PRO  56           HA       PRO  56  96.101  -6.994  12.160
  432    HB2  PRO  56           HB2      PRO  56  96.107  -9.503  11.007
  433    HB3  PRO  56           HB1      PRO  56  97.147  -9.028  12.362
  434    HG2  PRO  56           HG2      PRO  56  94.590 -10.557  12.387
  435    HG3  PRO  56           HG1      PRO  56  96.062 -10.799  13.346
  436    HD2  PRO  56           HD2      PRO  56  93.849  -9.584  14.368
  437    HD3  PRO  56           HD1      PRO  56  95.495  -9.158  14.887
  438    H    PHE  57           HN       PHE  57  96.006  -6.962   9.846
  439    HA   PHE  57           HA       PHE  57  93.297  -7.265   8.691
  440    HB2  PHE  57           HB2      PHE  57  95.221  -4.959   8.270
  441    HB3  PHE  57           HB1      PHE  57  93.691  -5.182   7.424
  442    HD1  PHE  57           HD2      PHE  57  95.182  -4.723  10.819
  443    HD2  PHE  57           HD1      PHE  57  91.649  -4.460   8.394
  444    HE1  PHE  57           HE2      PHE  57  93.991  -3.579  12.671
  445    HE2  PHE  57           HE1      PHE  57  90.460  -3.319  10.241
  446    HZ   PHE  57           HZ       PHE  57  91.629  -2.878  12.381
  447    H    GLU  58           HN       GLU  58  93.364  -7.688   6.340
  448    HA   GLU  58           HA       GLU  58  96.034  -8.548   5.405
  449    HB2  GLU  58           HB2      GLU  58  93.436  -9.758   4.430
  450    HB3  GLU  58           HB1      GLU  58  95.067 -10.406   4.268
  451    HG2  GLU  58           HG2      GLU  58  95.203 -10.805   6.660
  452    HG3  GLU  58           HG1      GLU  58  93.646 -10.025   6.918
  453    H    ALA  59           HN       ALA  59  96.676  -7.719   3.357
  454    HA   ALA  59           HA       ALA  59  94.668  -6.005   1.986
  455    HB1  ALA  59           HB1      ALA  59  97.122  -5.056   1.243
  456    HB2  ALA  59           HB2      ALA  59  97.418  -5.555   2.906
  457    HB3  ALA  59           HB3      ALA  59  96.137  -4.397   2.546
  458    H    ARG  60           HN       ARG  60  94.436  -6.162  -0.143
  459    HA   ARG  60           HA       ARG  60  96.266  -7.942  -1.647
  460    HB2  ARG  60           HB2      ARG  60  93.337  -7.573  -2.289
  461    HB3  ARG  60           HB1      ARG  60  94.442  -8.797  -2.913
  462    HG2  ARG  60           HG2      ARG  60  93.744  -8.582   0.023
  463    HG3  ARG  60           HG1      ARG  60  92.814  -9.571  -1.100
  464    HD2  ARG  60           HD2      ARG  60  94.296 -11.220  -0.683
  465    HD3  ARG  60           HD1      ARG  60  95.466 -10.291  -1.612
  466    HE   ARG  60           HE       ARG  60  96.049  -9.202   0.598
  467   HH11  ARG  60          HH21      ARG  60  94.650 -12.376   0.403
  468   HH12  ARG  60          HH22      ARG  60  95.319 -12.903   1.910
  469   HH21  ARG  60          HH11      ARG  60  96.924  -9.906   2.564
  470   HH22  ARG  60          HH12      ARG  60  96.600 -11.511   3.129
  471    H    LEU  61           HN       LEU  61  97.232  -6.886  -3.336
  472    HA   LEU  61           HA       LEU  61  96.118  -4.261  -4.106
  473    HB2  LEU  61           HB2      LEU  61  98.872  -5.429  -4.025
  474    HB3  LEU  61           HB1      LEU  61  98.528  -4.184  -5.222
  475    HG   LEU  61           HG       LEU  61  97.812  -2.644  -3.478
  476   HD11  LEU  61          HD11      LEU  61  96.756  -4.037  -1.872
  477   HD12  LEU  61          HD12      LEU  61  98.196  -3.434  -1.052
  478   HD13  LEU  61          HD13      LEU  61  98.178  -5.068  -1.713
  479   HD21  LEU  61          HD21      LEU  61 100.415  -4.044  -2.782
  480   HD22  LEU  61          HD22      LEU  61  99.962  -2.429  -2.243
  481   HD23  LEU  61          HD23      LEU  61 100.221  -2.745  -3.959
  482    H    TYR  62           HN       TYR  62  95.924  -3.700  -6.296
  483    HA   TYR  62           HA       TYR  62  96.151  -5.913  -8.231
  484    HB2  TYR  62           HB2      TYR  62  93.791  -4.019  -8.121
  485    HB3  TYR  62           HB1      TYR  62  93.989  -5.420  -9.173
  486    HD1  TYR  62           HD1      TYR  62  93.729  -4.409  -5.586
  487    HD2  TYR  62           HD2      TYR  62  93.317  -7.569  -8.465
  488    HE1  TYR  62           HE1      TYR  62  92.714  -5.869  -3.845
  489    HE2  TYR  62           HE2      TYR  62  92.304  -9.022  -6.729
  490    HH   TYR  62           HH       TYR  62  91.112  -7.899  -3.859
  491    H    LEU  63           HN       LEU  63  97.667  -5.256  -9.569
  492    HA   LEU  63           HA       LEU  63  97.731  -2.432 -10.446
  493    HB2  LEU  63           HB2      LEU  63  99.786  -3.674  -9.419
  494    HB3  LEU  63           HB1      LEU  63  99.908  -4.439 -10.999
  495    HG   LEU  63           HG       LEU  63  99.890  -1.451 -10.470
  496   HD11  LEU  63          HD11      LEU  63 102.208  -1.481 -10.985
  497   HD12  LEU  63          HD12      LEU  63 102.128  -3.122 -11.624
  498   HD13  LEU  63          HD13      LEU  63 101.978  -2.843  -9.890
  499   HD21  LEU  63          HD21      LEU  63 100.607  -1.498 -12.972
  500   HD22  LEU  63          HD22      LEU  63  98.900  -1.713 -12.599
  501   HD23  LEU  63          HD23      LEU  63  99.900  -3.112 -12.991
  502    H    GLY  64           HN       GLY  64  99.023  -5.268 -12.106
  503    HA2  GLY  64           HA2      GLY  64  97.805  -4.479 -14.597
  504    HA3  GLY  64           HA1      GLY  64  98.786  -5.920 -14.319
  505    H    LEU  65           HN       LEU  65  96.705  -6.477 -15.855
  506    HA   LEU  65           HA       LEU  65  94.316  -6.985 -14.379
  507    HB2  LEU  65           HB2      LEU  65  95.047  -8.357 -16.966
  508    HB3  LEU  65           HB1      LEU  65  93.444  -7.915 -16.375
  509    HG   LEU  65           HG       LEU  65  95.625  -5.985 -17.224
  510   HD11  LEU  65          HD11      LEU  65  92.960  -6.744 -18.455
  511   HD12  LEU  65          HD12      LEU  65  94.557  -7.066 -19.130
  512   HD13  LEU  65          HD13      LEU  65  93.969  -5.408 -19.007
  513   HD21  LEU  65          HD21      LEU  65  94.412  -4.928 -15.468
  514   HD22  LEU  65          HD22      LEU  65  92.877  -5.601 -16.021
  515   HD23  LEU  65          HD23      LEU  65  93.671  -4.333 -16.953
  516    H    ASP  66           HN       ASP  66  97.202  -8.855 -15.200
  517    HA   ASP  66           HA       ASP  66  96.137 -11.303 -13.959
  518    HB2  ASP  66           HB2      ASP  66  98.550 -10.652 -15.640
  519    HB3  ASP  66           HB1      ASP  66  98.288 -12.214 -14.864
  520    H    VAL  67           HN       VAL  67  97.425  -8.560 -12.809
  521    HA   VAL  67           HA       VAL  67  99.433  -9.888 -11.097
  522    HB   VAL  67           HB       VAL  67  99.049  -7.038 -11.967
  523   HG11  VAL  67          HG11      VAL  67  99.373  -6.582  -9.696
  524   HG12  VAL  67          HG12      VAL  67 101.037  -6.672 -10.266
  525   HG13  VAL  67          HG13      VAL  67 100.317  -8.048  -9.433
  526   HG21  VAL  67          HG21      VAL  67 101.597  -8.639 -11.700
  527   HG22  VAL  67          HG22      VAL  67 101.268  -7.261 -12.753
  528   HG23  VAL  67          HG23      VAL  67 100.546  -8.831 -13.106
  529    H    LEU  68           HN       LEU  68  98.224 -10.826  -9.564
  530    HA   LEU  68           HA       LEU  68  96.609  -9.052  -7.827
  531    HB2  LEU  68           HB2      LEU  68  95.114 -10.726  -8.481
  532    HB3  LEU  68           HB1      LEU  68  96.375 -11.952  -8.587
  533    HG   LEU  68           HG       LEU  68  96.570 -11.972  -6.126
  534   HD11  LEU  68          HD11      LEU  68  95.976  -9.766  -5.472
  535   HD12  LEU  68          HD12      LEU  68  94.646 -10.764  -4.890
  536   HD13  LEU  68          HD13      LEU  68  94.460  -9.822  -6.367
  537   HD21  LEU  68          HD21      LEU  68  93.677 -12.245  -6.991
  538   HD22  LEU  68          HD22      LEU  68  94.473 -13.094  -5.667
  539   HD23  LEU  68          HD23      LEU  68  94.923 -13.444  -7.335
  540    H    ILE  69           HN       ILE  69  97.709  -8.493  -6.036
  541    HA   ILE  69           HA       ILE  69  99.768 -10.363  -5.026
  542    HB   ILE  69           HB       ILE  69  99.555  -7.356  -4.908
  543   HG12  ILE  69          HG12      ILE  69 102.085  -8.524  -5.754
  544   HG13  ILE  69          HG11      ILE  69 100.758  -9.145  -6.730
  545   HG21  ILE  69          HG21      ILE  69 101.973  -7.930  -3.781
  546   HG22  ILE  69          HG22      ILE  69 100.997  -9.254  -3.153
  547   HG23  ILE  69          HG23      ILE  69 100.516  -7.587  -2.849
  548   HD11  ILE  69          HD11      ILE  69 101.440  -6.231  -6.254
  549   HD12  ILE  69          HD12      ILE  69 100.000  -6.788  -7.106
  550   HD13  ILE  69          HD13      ILE  69 101.598  -7.120  -7.770
  551    H    ARG  70           HN       ARG  70  99.883 -10.850  -2.869
  552    HA   ARG  70           HA       ARG  70  97.694  -9.867  -1.147
  553    HB2  ARG  70           HB2      ARG  70  98.619 -12.665  -0.732
  554    HB3  ARG  70           HB1      ARG  70  97.004 -11.979  -0.574
  555    HG2  ARG  70           HG2      ARG  70  96.917 -11.798  -3.087
  556    HG3  ARG  70           HG1      ARG  70  98.432 -12.702  -3.143
  557    HD2  ARG  70           HD2      ARG  70  97.271 -14.493  -1.755
  558    HD3  ARG  70           HD1      ARG  70  95.765 -13.632  -2.062
  559    HE   ARG  70           HE       ARG  70  95.785 -14.506  -4.207
  560   HH11  ARG  70          HH21      ARG  70  98.951 -14.644  -2.808
  561   HH12  ARG  70          HH22      ARG  70  99.636 -15.552  -4.113
  562   HH21  ARG  70          HH11      ARG  70  96.680 -15.697  -5.921
  563   HH22  ARG  70          HH12      ARG  70  98.352 -16.148  -5.874
  564    H    MET  71           HN       MET  71  98.266  -9.181   0.786
  565    HA   MET  71           HA       MET  71 100.825 -10.025   1.965
  566    HB2  MET  71           HB2      MET  71 100.504  -7.201   2.409
  567    HB3  MET  71           HB1      MET  71 101.850  -8.047   1.658
  568    HG2  MET  71           HG2      MET  71 101.036  -7.707  -0.497
  569    HG3  MET  71           HG1      MET  71  99.364  -7.567   0.044
  570    HE1  MET  71           HE1      MET  71 102.651  -4.391   0.657
  571    HE2  MET  71           HE2      MET  71 102.876  -6.068   0.161
  572    HE3  MET  71           HE3      MET  71 102.412  -5.703   1.821
  573    H    GLU  72           HN       GLU  72 100.900  -9.804   4.209
  574    HA   GLU  72           HA       GLU  72  98.278  -9.435   5.496
  575    HB2  GLU  72           HB2      GLU  72  99.603 -11.577   5.863
  576    HB3  GLU  72           HB1      GLU  72 100.795 -10.600   6.717
  577    HG2  GLU  72           HG2      GLU  72  99.431 -11.303   8.473
  578    HG3  GLU  72           HG1      GLU  72  98.720  -9.740   8.079
  579    H    ILE  73           HN       ILE  73  98.009  -7.636   6.933
  580    HA   ILE  73           HA       ILE  73 100.479  -6.232   7.692
  581    HB   ILE  73           HB       ILE  73  99.777  -4.175   6.793
  582   HG12  ILE  73          HG12      ILE  73  97.106  -5.558   6.380
  583   HG13  ILE  73          HG11      ILE  73  97.434  -4.187   7.430
  584   HG21  ILE  73          HG21      ILE  73  99.568  -4.669   4.426
  585   HG22  ILE  73          HG22      ILE  73  98.940  -6.277   4.776
  586   HG23  ILE  73          HG23      ILE  73 100.618  -5.883   5.151
  587   HD11  ILE  73          HD11      ILE  73  96.783  -2.884   5.709
  588   HD12  ILE  73          HD12      ILE  73  96.837  -4.229   4.585
  589   HD13  ILE  73          HD13      ILE  73  98.302  -3.317   4.926
  590    H    SER  74           HN       SER  74 100.244  -4.691   9.357
  591    HA   SER  74           HA       SER  74  97.791  -4.943  11.018
  592    HB2  SER  74           HB2      SER  74 100.696  -4.874  11.845
  593    HB3  SER  74           HB1      SER  74  99.385  -4.524  12.968
  594    HG   SER  74           HG       SER  74  99.135  -6.593  13.134
  595    H    LEU  75           HN       LEU  75  97.178  -3.080  12.221
  596    HA   LEU  75           HA       LEU  75  97.466  -0.623  10.832
  597    HB2  LEU  75           HB2      LEU  75  95.622  -1.528  12.511
  598    HB3  LEU  75           HB1      LEU  75  96.622  -0.712  13.705
  599    HG   LEU  75           HG       LEU  75  94.977   0.879  13.006
  600   HD11  LEU  75          HD11      LEU  75  96.308   2.671  12.229
  601   HD12  LEU  75          HD12      LEU  75  97.367   1.601  11.316
  602   HD13  LEU  75          HD13      LEU  75  97.433   1.614  13.079
  603   HD21  LEU  75          HD21      LEU  75  95.780   0.588  10.113
  604   HD22  LEU  75          HD22      LEU  75  94.312   1.287  10.790
  605   HD23  LEU  75          HD23      LEU  75  94.544  -0.459  10.811
  606    H    ALA  76           HN       ALA  76  99.090   0.742  10.840
  607    HA   ALA  76           HA       ALA  76 100.989   0.676  13.074
  608    HB1  ALA  76           HB1      ALA  76 102.499   1.970  11.540
  609    HB2  ALA  76           HB2      ALA  76 101.276   1.795  10.277
  610    HB3  ALA  76           HB3      ALA  76 102.074   0.370  10.937
  611    H    TRP  77           HN       TRP  77  98.848   2.801  11.266
  612    HA   TRP  77           HA       TRP  77  98.431   4.524  13.520
  613    HB2  TRP  77           HB2      TRP  77  99.415   6.583  12.576
  614    HB3  TRP  77           HB1      TRP  77 100.667   5.361  12.836
  615    HD1  TRP  77           HD1      TRP  77 101.755   4.247  10.756
  616    HE1  TRP  77           HE1      TRP  77 101.616   4.663   8.212
  617    HE3  TRP  77           HE3      TRP  77  97.905   7.590  10.618
  618    HZ2  TRP  77           HZ2      TRP  77 100.239   6.354   6.412
  619    HZ3  TRP  77           HZ3      TRP  77  97.185   8.585   8.463
  620    HH2  TRP  77           HH2      TRP  77  98.328   7.959   6.350
  621    H    ALA  78           HN       ALA  78  97.103   6.499  12.847
  622    HA   ALA  78           HA       ALA  78  95.726   6.273  10.268
  623    HB1  ALA  78           HB1      ALA  78  93.498   6.280  11.429
  624    HB2  ALA  78           HB2      ALA  78  94.346   5.901  12.928
  625    HB3  ALA  78           HB3      ALA  78  94.395   4.769  11.576
  626    H    ARG  79           HN       ARG  79  95.513   8.355   9.530
  627    HA   ARG  79           HA       ARG  79  94.648  10.426  11.369
  628    HB2  ARG  79           HB2      ARG  79  97.060  10.508  11.704
  629    HB3  ARG  79           HB1      ARG  79  97.331  10.578   9.966
  630    HG2  ARG  79           HG2      ARG  79  96.352  12.767   9.815
  631    HG3  ARG  79           HG1      ARG  79  95.749  12.675  11.472
  632    HD2  ARG  79           HD2      ARG  79  98.685  12.337  11.064
  633    HD3  ARG  79           HD1      ARG  79  98.017  13.957  10.881
  634    HE   ARG  79           HE       ARG  79  98.378  12.558  13.340
  635   HH11  ARG  79          HH21      ARG  79  96.262  14.681  11.613
  636   HH12  ARG  79          HH22      ARG  79  95.609  15.416  13.039
  637   HH21  ARG  79          HH11      ARG  79  97.527  13.515  15.217
  638   HH22  ARG  79          HH12      ARG  79  96.325  14.755  15.081
  639    H    ASP  80           HN       ASP  80  93.339  11.870  10.445
  640    HA   ASP  80           HA       ASP  80  92.110  12.952   8.837
  641    HB2  ASP  80           HB2      ASP  80  94.469  13.866   8.550
  642    HB3  ASP  80           HB1      ASP  80  94.589  12.815   7.140
  643    H    GLY  81           HN       GLY  81  91.499  10.232   8.688
  644    HA2  GLY  81           HA2      GLY  81  90.428   8.799   7.251
  645    HA3  GLY  81           HA1      GLY  81  90.518  10.065   6.033
  646    H    LEU  82           HN       LEU  82  93.540   9.275   7.337
  647    HA   LEU  82           HA       LEU  82  94.150   7.528   5.022
  648    HB2  LEU  82           HB2      LEU  82  96.074   9.347   6.500
  649    HB3  LEU  82           HB1      LEU  82  96.415   8.399   5.054
  650    HG   LEU  82           HG       LEU  82  94.514  10.749   5.289
  651   HD11  LEU  82          HD11      LEU  82  96.958  11.234   5.058
  652   HD12  LEU  82          HD12      LEU  82  96.013  11.789   3.675
  653   HD13  LEU  82          HD13      LEU  82  96.962  10.308   3.556
  654   HD21  LEU  82          HD21      LEU  82  94.883   8.666   3.137
  655   HD22  LEU  82          HD22      LEU  82  94.376  10.302   2.715
  656   HD23  LEU  82          HD23      LEU  82  93.383   9.323   3.792
  657    H    LEU  83           HN       LEU  83  95.203   5.608   5.451
  658    HA   LEU  83           HA       LEU  83  95.757   5.032   8.327
  659    HB2  LEU  83           HB2      LEU  83  94.645   3.092   6.315
  660    HB3  LEU  83           HB1      LEU  83  94.834   2.861   8.049
  661    HG   LEU  83           HG       LEU  83  93.062   4.997   6.834
  662   HD11  LEU  83          HD11      LEU  83  92.486   2.158   7.700
  663   HD12  LEU  83          HD12      LEU  83  92.101   2.921   6.158
  664   HD13  LEU  83          HD13      LEU  83  91.224   3.385   7.616
  665   HD21  LEU  83          HD21      LEU  83  93.503   3.889   9.617
  666   HD22  LEU  83          HD22      LEU  83  92.044   4.781   9.190
  667   HD23  LEU  83          HD23      LEU  83  93.619   5.566   9.083
  668    H    GLY  84           HN       GLY  84  97.714   4.108   8.725
  669    HA2  GLY  84           HA2      GLY  84  99.318   3.281   6.404
  670    HA3  GLY  84           HA1      GLY  84  99.937   3.729   7.985
  671    H    PHE  85           HN       PHE  85 100.508   1.332   6.565
  672    HA   PHE  85           HA       PHE  85  99.667  -0.575   8.621
  673    HB2  PHE  85           HB2      PHE  85  99.145  -0.823   5.666
  674    HB3  PHE  85           HB1      PHE  85  99.283  -2.239   6.698
  675    HD1  PHE  85           HD2      PHE  85  97.783  -2.418   8.739
  676    HD2  PHE  85           HD1      PHE  85  97.140   0.452   5.620
  677    HE1  PHE  85           HE2      PHE  85  95.445  -2.128   9.499
  678    HE2  PHE  85           HE1      PHE  85  94.793   0.742   6.381
  679    HZ   PHE  85           HZ       PHE  85  93.952  -0.542   8.317
  680    H    GLU  86           HN       GLU  86 101.259  -1.989   9.156
  681    HA   GLU  86           HA       GLU  86 103.762  -1.806   7.610
  682    HB2  GLU  86           HB2      GLU  86 104.863  -2.597   9.630
  683    HB3  GLU  86           HB1      GLU  86 103.836  -1.223  10.039
  684    HG2  GLU  86           HG2      GLU  86 102.039  -3.174  10.432
  685    HG3  GLU  86           HG1      GLU  86 103.502  -4.112  10.729
  686    H    CYS  87           HN       CYS  87 104.381  -3.553   6.450
  687    HA   CYS  87           HA       CYS  87 102.678  -5.858   6.339
  688    HB2  CYS  87           HB2      CYS  87 104.051  -4.726   4.449
  689    HB3  CYS  87           HB1      CYS  87 105.390  -5.699   5.058
  690    HG   CYS  87           HG       CYS  87 102.888  -7.379   4.592
  691    H    GLN  88           HN       GLN  88 102.809  -7.684   7.448
  692    HA   GLN  88           HA       GLN  88 105.236  -8.215   9.037
  693    HB2  GLN  88           HB2      GLN  88 103.627  -9.973  10.096
  694    HB3  GLN  88           HB1      GLN  88 103.434  -8.273  10.514
  695    HG2  GLN  88           HG2      GLN  88 101.931  -9.070   8.103
  696    HG3  GLN  88           HG1      GLN  88 101.420  -9.909   9.565
  697   HE21  GLN  88          HE21      GLN  88 102.767  -6.616   9.589
  698   HE22  GLN  88          HE22      GLN  88 101.328  -5.857  10.072
  699    H    HIS  89           HN       HIS  89 103.225  -9.481   6.466
  700    HA   HIS  89           HA       HIS  89 105.284 -11.367   5.745
  701    HB2  HIS  89           HB2      HIS  89 104.430 -12.973   7.143
  702    HB3  HIS  89           HB1      HIS  89 102.826 -12.244   7.170
  703    HD2  HIS  89           HD2      HIS  89 101.210 -14.200   6.083
  704    HE1  HIS  89           HE1      HIS  89 103.617 -15.180   2.754
  705    HE2  HIS  89           HE2      HIS  89 101.393 -15.621   3.898
  706    H    ILE  90           HN       ILE  90 105.174 -11.918   3.625
  707    HA   ILE  90           HA       ILE  90 102.752 -11.405   2.040
  708    HB   ILE  90           HB       ILE  90 103.837  -9.245   1.959
  709   HG12  ILE  90          HG12      ILE  90 104.663 -10.734  -0.543
  710   HG13  ILE  90          HG11      ILE  90 102.987 -10.325  -0.183
  711   HG21  ILE  90          HG21      ILE  90 106.308 -10.915   1.556
  712   HG22  ILE  90          HG22      ILE  90 106.037  -9.587   2.684
  713   HG23  ILE  90          HG23      ILE  90 106.252  -9.254   0.966
  714   HD11  ILE  90          HD11      ILE  90 103.290  -8.171  -0.788
  715   HD12  ILE  90          HD12      ILE  90 104.836  -8.678  -1.468
  716   HD13  ILE  90          HD13      ILE  90 104.762  -8.034   0.172
  717    H    ASP  91           HN       ASP  91 102.537 -12.596   0.289
  718    HA   ASP  91           HA       ASP  91 103.806 -15.069   0.177
  719    HB2  ASP  91           HB2      ASP  91 102.619 -13.814  -2.281
  720    HB3  ASP  91           HB1      ASP  91 102.570 -15.495  -1.760
  721    H    LEU  92           HN       LEU  92 105.382 -15.964  -0.983
  722    HA   LEU  92           HA       LEU  92 107.684 -14.517  -1.594
  723    HB2  LEU  92           HB2      LEU  92 107.735 -16.944  -1.254
  724    HB3  LEU  92           HB1      LEU  92 106.815 -17.186  -2.738
  725    HG   LEU  92           HG       LEU  92 108.644 -16.190  -4.053
  726   HD11  LEU  92          HD11      LEU  92 109.685 -14.612  -2.666
  727   HD12  LEU  92          HD12      LEU  92 110.865 -15.920  -2.691
  728   HD13  LEU  92          HD13      LEU  92 109.789 -15.730  -1.307
  729   HD21  LEU  92          HD21      LEU  92 109.371 -18.419  -2.139
  730   HD22  LEU  92          HD22      LEU  92 110.416 -17.947  -3.480
  731   HD23  LEU  92          HD23      LEU  92 108.794 -18.563  -3.799
  732    H    ASP  93           HN       ASP  93 105.067 -15.567  -3.720
  733    HA   ASP  93           HA       ASP  93 106.196 -14.573  -6.133
  734    HB2  ASP  93           HB2      ASP  93 103.986 -14.898  -7.074
  735    HB3  ASP  93           HB1      ASP  93 104.351 -16.259  -6.013
  736    H    SER  94           HN       SER  94 104.066 -13.244  -3.659
  737    HA   SER  94           HA       SER  94 103.468 -10.806  -5.005
  738    HB2  SER  94           HB2      SER  94 101.997 -11.340  -3.251
  739    HB3  SER  94           HB1      SER  94 103.313 -11.728  -2.147
  740    HG   SER  94           HG       SER  94 103.232  -9.157  -3.209
  741    H    ILE  95           HN       ILE  95 106.019 -11.883  -2.846
  742    HA   ILE  95           HA       ILE  95 107.178  -9.406  -2.212
  743    HB   ILE  95           HB       ILE  95 108.307 -12.194  -2.476
  744   HG12  ILE  95          HG12      ILE  95 108.000 -10.379  -0.071
  745   HG13  ILE  95          HG11      ILE  95 106.771 -11.536  -0.575
  746   HG21  ILE  95          HG21      ILE  95 110.319 -11.135  -1.241
  747   HG22  ILE  95          HG22      ILE  95 109.730  -9.601  -1.879
  748   HG23  ILE  95          HG23      ILE  95 110.210 -10.890  -2.983
  749   HD11  ILE  95          HD11      ILE  95 108.946 -12.065   1.100
  750   HD12  ILE  95          HD12      ILE  95 109.404 -12.782  -0.444
  751   HD13  ILE  95          HD13      ILE  95 107.899 -13.262   0.342
  752    H    SER  96           HN       SER  96 107.526 -11.525  -5.001
  753    HA   SER  96           HA       SER  96 109.637  -9.985  -6.145
  754    HB2  SER  96           HB2      SER  96 108.529 -12.490  -6.678
  755    HB3  SER  96           HB1      SER  96 108.043 -11.529  -8.076
  756    HG   SER  96           HG       SER  96 110.683 -11.817  -7.042
  757    H    HIS  97           HN       HIS  97 106.124 -10.045  -6.639
  758    HA   HIS  97           HA       HIS  97 106.149  -8.235  -8.803
  759    HB2  HIS  97           HB2      HIS  97 104.074  -8.992  -6.760
  760    HB3  HIS  97           HB1      HIS  97 103.775  -7.694  -7.901
  761    HD2  HIS  97           HD2      HIS  97 103.761 -11.548  -7.824
  762    HE1  HIS  97           HE1      HIS  97 103.287 -10.385 -11.853
  763    HE2  HIS  97           HE2      HIS  97 103.201 -12.350 -10.246
  764    H    LEU  98           HN       LEU  98 106.185  -7.754  -5.315
  765    HA   LEU  98           HA       LEU  98 105.933  -4.877  -5.425
  766    HB2  LEU  98           HB2      LEU  98 106.373  -6.934  -3.371
  767    HB3  LEU  98           HB1      LEU  98 107.339  -5.485  -3.098
  768    HG   LEU  98           HG       LEU  98 105.252  -4.112  -3.368
  769   HD11  LEU  98          HD11      LEU  98 104.089  -6.022  -4.671
  770   HD12  LEU  98          HD12      LEU  98 103.117  -5.133  -3.500
  771   HD13  LEU  98          HD13      LEU  98 103.760  -6.722  -3.087
  772   HD21  LEU  98          HD21      LEU  98 104.390  -4.615  -1.155
  773   HD22  LEU  98          HD22      LEU  98 106.133  -4.881  -1.137
  774   HD23  LEU  98          HD23      LEU  98 105.032  -6.253  -1.234
  775    H    ARG  99           HN       ARG  99 108.615  -7.138  -5.655
  776    HA   ARG  99           HA       ARG  99 110.647  -5.137  -5.461
  777    HB2  ARG  99           HB2      ARG  99 110.551  -7.927  -6.599
  778    HB3  ARG  99           HB1      ARG  99 111.978  -6.912  -6.809
  779    HG2  ARG  99           HG2      ARG  99 112.282  -6.701  -4.437
  780    HG3  ARG  99           HG1      ARG  99 110.713  -7.436  -4.109
  781    HD2  ARG  99           HD2      ARG  99 111.554  -9.533  -4.276
  782    HD3  ARG  99           HD1      ARG  99 112.427  -9.150  -5.757
  783    HE   ARG  99           HE       ARG  99 114.320  -8.673  -4.474
  784   HH11  ARG  99          HH21      ARG  99 111.493  -9.048  -2.514
  785   HH12  ARG  99          HH22      ARG  99 112.365  -9.074  -1.018
  786   HH21  ARG  99          HH11      ARG  99 115.470  -8.700  -2.517
  787   HH22  ARG  99          HH12      ARG  99 114.617  -8.876  -1.020
  788    H    ARG 100           HN       ARG 100 108.694  -6.485  -8.038
  789    HA   ARG 100           HA       ARG 100 109.931  -5.315 -10.301
  790    HB2  ARG 100           HB2      ARG 100 107.180  -6.338  -9.697
  791    HB3  ARG 100           HB1      ARG 100 107.510  -5.513 -11.215
  792    HG2  ARG 100           HG2      ARG 100 109.372  -7.109 -11.645
  793    HG3  ARG 100           HG1      ARG 100 108.946  -7.968 -10.164
  794    HD2  ARG 100           HD2      ARG 100 107.950  -9.010 -12.201
  795    HD3  ARG 100           HD1      ARG 100 106.736  -8.481 -11.040
  796    HE   ARG 100           HE       ARG 100 107.391  -6.554 -13.126
  797   HH11  ARG 100          HH21      ARG 100 105.379  -9.145 -12.026
  798   HH12  ARG 100          HH22      ARG 100 104.055  -8.743 -13.069
  799   HH21  ARG 100          HH11      ARG 100 105.662  -6.021 -14.495
  800   HH22  ARG 100          HH12      ARG 100 104.215  -6.974 -14.467
  801    H    LEU 101           HN       LEU 101 107.297  -4.160  -8.192
  802    HA   LEU 101           HA       LEU 101 106.754  -1.823  -9.670
  803    HB2  LEU 101           HB2      LEU 101 106.046  -2.876  -7.012
  804    HB3  LEU 101           HB1      LEU 101 106.133  -1.118  -7.057
  805    HG   LEU 101           HG       LEU 101 104.528  -2.808  -9.000
  806   HD11  LEU 101          HD11      LEU 101 103.528  -1.091  -6.716
  807   HD12  LEU 101          HD12      LEU 101 103.722  -2.841  -6.607
  808   HD13  LEU 101          HD13      LEU 101 102.574  -2.150  -7.755
  809   HD21  LEU 101          HD21      LEU 101 104.791  -0.839 -10.173
  810   HD22  LEU 101          HD22      LEU 101 105.120   0.107  -8.723
  811   HD23  LEU 101          HD23      LEU 101 103.464  -0.330  -9.135
  812    H    VAL 102           HN       VAL 102 109.012  -2.495  -7.054
  813    HA   VAL 102           HA       VAL 102 109.902   0.185  -6.699
  814    HB   VAL 102           HB       VAL 102 111.165  -2.481  -6.037
  815   HG11  VAL 102          HG11      VAL 102 112.988  -0.941  -6.215
  816   HG12  VAL 102          HG12      VAL 102 112.599  -1.026  -4.497
  817   HG13  VAL 102          HG13      VAL 102 112.059   0.353  -5.457
  818   HG21  VAL 102          HG21      VAL 102 110.394  -2.036  -3.806
  819   HG22  VAL 102          HG22      VAL 102 109.025  -1.733  -4.875
  820   HG23  VAL 102          HG23      VAL 102 109.950  -0.381  -4.224
  821    H    GLU 103           HN       GLU 103 111.095  -2.550  -8.616
  822    HA   GLU 103           HA       GLU 103 113.460  -1.381  -9.567
  823    HB2  GLU 103           HB2      GLU 103 112.786  -3.792  -9.801
  824    HB3  GLU 103           HB1      GLU 103 111.683  -3.299 -11.085
  825    HG2  GLU 103           HG2      GLU 103 114.041  -2.076 -11.851
  826    HG3  GLU 103           HG1      GLU 103 114.618  -3.581 -11.139
  827    H    LEU 104           HN       LEU 104 110.202  -1.419 -11.029
  828    HA   LEU 104           HA       LEU 104 110.949   0.136 -13.284
  829    HB2  LEU 104           HB2      LEU 104 108.289  -0.494 -12.002
  830    HB3  LEU 104           HB1      LEU 104 108.416   0.529 -13.432
  831    HG   LEU 104           HG       LEU 104 109.861  -2.090 -13.486
  832   HD11  LEU 104          HD11      LEU 104 107.666  -3.095 -14.393
  833   HD12  LEU 104          HD12      LEU 104 106.859  -1.762 -13.568
  834   HD13  LEU 104          HD13      LEU 104 107.810  -2.925 -12.644
  835   HD21  LEU 104          HD21      LEU 104 108.124  -0.802 -15.598
  836   HD22  LEU 104          HD22      LEU 104 109.461  -1.930 -15.820
  837   HD23  LEU 104          HD23      LEU 104 109.782  -0.270 -15.320
  838    H    ASN 105           HN       ASN 105 109.521   0.959 -10.144
  839    HA   ASN 105           HA       ASN 105 109.241   3.744 -10.745
  840    HB2  ASN 105           HB2      ASN 105 109.106   2.095  -8.234
  841    HB3  ASN 105           HB1      ASN 105 109.088   3.855  -8.151
  842   HD21  ASN 105          HD21      ASN 105 107.512   1.420 -10.318
  843   HD22  ASN 105          HD22      ASN 105 105.961   2.094 -10.171
  844    H    LEU 106           HN       LEU 106 111.791   1.721  -9.474
  845    HA   LEU 106           HA       LEU 106 113.385   3.744  -8.300
  846    HB2  LEU 106           HB2      LEU 106 113.842   1.413  -7.824
  847    HB3  LEU 106           HB1      LEU 106 114.137   1.081  -9.531
  848    HG   LEU 106           HG       LEU 106 116.098   2.547  -9.511
  849   HD11  LEU 106          HD11      LEU 106 115.161   3.103  -6.694
  850   HD12  LEU 106          HD12      LEU 106 115.567   4.259  -7.964
  851   HD13  LEU 106          HD13      LEU 106 116.843   3.348  -7.160
  852   HD21  LEU 106          HD21      LEU 106 116.046   0.594  -7.189
  853   HD22  LEU 106          HD22      LEU 106 117.508   1.239  -7.934
  854   HD23  LEU 106          HD23      LEU 106 116.427   0.204  -8.866
  855    H    GLY 107           HN       GLY 107 112.709   2.884 -11.561
  856    HA2  GLY 107           HA2      GLY 107 114.042   5.165 -12.609
  857    HA3  GLY 107           HA1      GLY 107 114.974   3.707 -12.940
  858    H    ASP 108           HN       ASP 108 113.262   5.648 -14.604
  859    HA   ASP 108           HA       ASP 108 111.718   3.560 -16.030
  860    HB2  ASP 108           HB2      ASP 108 110.973   6.484 -15.811
  861    HB3  ASP 108           HB1      ASP 108 110.038   5.206 -16.585
  862    H    GLU 109           HN       GLU 109 112.888   6.903 -16.534
  863    HA   GLU 109           HA       GLU 109 114.373   6.014 -18.898
  864    HB2  GLU 109           HB2      GLU 109 113.353   8.102 -20.099
  865    HB3  GLU 109           HB1      GLU 109 112.443   6.594 -20.072
  866    HG2  GLU 109           HG2      GLU 109 112.068   8.618 -17.875
  867    HG3  GLU 109           HG1      GLU 109 111.234   8.821 -19.415
  868    H    GLU 110           HN       GLU 110 116.302   6.963 -18.945
  869    HA   GLU 110           HA       GLU 110 117.446   8.508 -17.051
  870    HB2  GLU 110           HB2      GLU 110 118.547   7.541 -19.126
  871    HB3  GLU 110           HB1      GLU 110 118.007   8.987 -19.979
  872    HG2  GLU 110           HG2      GLU 110 119.142  10.184 -17.856
  873    HG3  GLU 110           HG1      GLU 110 120.097   8.703 -17.865
  874    H    LEU 111           HN       LEU 111 116.037  10.051 -16.178
  875    HA   LEU 111           HA       LEU 111 115.158  12.261 -17.889
  876    HB2  LEU 111           HB2      LEU 111 113.971  13.026 -15.842
  877    HB3  LEU 111           HB1      LEU 111 113.521  11.391 -16.319
  878    HG   LEU 111           HG       LEU 111 115.834  11.369 -14.532
  879   HD11  LEU 111          HD11      LEU 111 114.839  13.410 -13.615
  880   HD12  LEU 111          HD12      LEU 111 114.596  12.068 -12.495
  881   HD13  LEU 111          HD13      LEU 111 113.266  12.620 -13.513
  882   HD21  LEU 111          HD21      LEU 111 114.410   9.416 -15.042
  883   HD22  LEU 111          HD22      LEU 111 113.027  10.231 -14.312
  884   HD23  LEU 111          HD23      LEU 111 114.402   9.764 -13.312
  885    H    LEU 112           HN       LEU 112 115.197  14.322 -16.002
  886    HA   LEU 112           HA       LEU 112 118.025  15.034 -16.089
  887    HB2  LEU 112           HB2      LEU 112 116.459  16.707 -16.868
  888    HB3  LEU 112           HB1      LEU 112 115.546  16.612 -15.363
  889    HG   LEU 112           HG       LEU 112 117.433  17.498 -14.104
  890   HD11  LEU 112          HD11      LEU 112 119.417  18.351 -15.577
  891   HD12  LEU 112          HD12      LEU 112 118.850  17.153 -16.741
  892   HD13  LEU 112          HD13      LEU 112 119.366  16.646 -15.131
  893   HD21  LEU 112          HD21      LEU 112 115.975  19.168 -15.088
  894   HD22  LEU 112          HD22      LEU 112 116.818  19.053 -16.634
  895   HD23  LEU 112          HD23      LEU 112 117.636  19.740 -15.230
  896    H    GLU 113           HN       GLU 113 115.637  15.844 -13.602
  897    HA   GLU 113           HA       GLU 113 117.447  15.871 -11.470
  898    HB2  GLU 113           HB2      GLU 113 114.466  15.341 -11.441
  899    HB3  GLU 113           HB1      GLU 113 115.436  15.743 -10.024
  900    HG2  GLU 113           HG2      GLU 113 115.943  17.915 -10.862
  901    HG3  GLU 113           HG1      GLU 113 115.358  17.510 -12.474
  902    H    ARG 114           HN       ARG 114 116.591  14.324  -9.447
  903    HA   ARG 114           HA       ARG 114 116.346  11.554 -10.223
  904    HB2  ARG 114           HB2      ARG 114 118.811  12.083 -10.516
  905    HB3  ARG 114           HB1      ARG 114 118.871  12.353  -8.773
  906    HG2  ARG 114           HG2      ARG 114 117.600   9.952  -8.816
  907    HG3  ARG 114           HG1      ARG 114 118.562   9.806 -10.286
  908    HD2  ARG 114           HD2      ARG 114 119.789   8.942  -8.326
  909    HD3  ARG 114           HD1      ARG 114 120.601  10.341  -9.022
  910    HE   ARG 114           HE       ARG 114 120.100  11.547  -7.085
  911   HH11  ARG 114          HH21      ARG 114 118.376   8.546  -7.210
  912   HH12  ARG 114          HH22      ARG 114 117.828   8.634  -5.569
  913   HH21  ARG 114          HH11      ARG 114 119.386  11.665  -4.931
  914   HH22  ARG 114          HH12      ARG 114 118.400  10.399  -4.280
  915    H    GLU 115           HN       GLU 115 114.670  13.104  -8.699
  916    HA   GLU 115           HA       GLU 115 113.573  13.150  -6.678
  917    HB2  GLU 115           HB2      GLU 115 115.106  10.554  -6.390
  918    HB3  GLU 115           HB1      GLU 115 113.854  11.083  -5.271
  919    HG2  GLU 115           HG2      GLU 115 112.372  10.060  -6.653
  920    HG3  GLU 115           HG1      GLU 115 112.651  11.390  -7.772
  921    H    LEU 116           HN       LEU 116 116.418  14.233  -6.981
  922    HA   LEU 116           HA       LEU 116 117.707  13.928  -4.472
  923    HB2  LEU 116           HB2      LEU 116 117.976  15.870  -6.745
  924    HB3  LEU 116           HB1      LEU 116 118.854  16.139  -5.241
  925    HG   LEU 116           HG       LEU 116 118.953  13.476  -6.667
  926   HD11  LEU 116          HD11      LEU 116 120.567  15.978  -7.169
  927   HD12  LEU 116          HD12      LEU 116 119.766  14.937  -8.345
  928   HD13  LEU 116          HD13      LEU 116 121.218  14.376  -7.517
  929   HD21  LEU 116          HD21      LEU 116 121.223  13.487  -5.462
  930   HD22  LEU 116          HD22      LEU 116 119.802  13.355  -4.432
  931   HD23  LEU 116          HD23      LEU 116 120.635  14.900  -4.587
  932    H    ALA 117           HN       ALA 117 115.406  16.347  -5.698
  933    HA   ALA 117           HA       ALA 117 115.673  18.122  -3.608
  934    HB1  ALA 117           HB1      ALA 117 113.386  18.960  -4.208
  935    HB2  ALA 117           HB2      ALA 117 113.176  17.542  -5.235
  936    HB3  ALA 117           HB3      ALA 117 114.419  18.733  -5.618
  937    H    LEU 118           HN       LEU 118 114.306  15.075  -3.726
  938    HA   LEU 118           HA       LEU 118 112.384  15.131  -1.619
  939    HB2  LEU 118           HB2      LEU 118 114.140  12.793  -2.412
  940    HB3  LEU 118           HB1      LEU 118 112.633  12.717  -1.505
  941    HG   LEU 118           HG       LEU 118 113.035  13.384  -4.423
  942   HD11  LEU 118          HD11      LEU 118 111.708  11.521  -4.812
  943   HD12  LEU 118          HD12      LEU 118 110.848  11.686  -3.284
  944   HD13  LEU 118          HD13      LEU 118 112.483  11.033  -3.306
  945   HD21  LEU 118          HD21      LEU 118 110.539  13.930  -4.402
  946   HD22  LEU 118          HD22      LEU 118 111.591  15.163  -3.711
  947   HD23  LEU 118          HD23      LEU 118 110.678  14.085  -2.651
  948    H    LEU 119           HN       LEU 119 115.828  14.970  -1.752
  949    HA   LEU 119           HA       LEU 119 116.435  14.124   0.863
  950    HB2  LEU 119           HB2      LEU 119 117.870  15.971  -1.037
  951    HB3  LEU 119           HB1      LEU 119 118.489  15.706   0.590
  952    HG   LEU 119           HG       LEU 119 117.753  13.325  -1.091
  953   HD11  LEU 119          HD11      LEU 119 120.049  13.281  -1.998
  954   HD12  LEU 119          HD12      LEU 119 120.373  14.849  -1.258
  955   HD13  LEU 119          HD13      LEU 119 119.179  14.713  -2.549
  956   HD21  LEU 119          HD21      LEU 119 118.370  13.060   1.297
  957   HD22  LEU 119          HD22      LEU 119 119.908  13.863   0.983
  958   HD23  LEU 119          HD23      LEU 119 119.560  12.301   0.242
  959    H    VAL 120           HN       VAL 120 115.798  17.391  -0.401
  960    HA   VAL 120           HA       VAL 120 116.002  18.866   2.002
  961    HB   VAL 120           HB       VAL 120 114.103  19.289  -0.315
  962   HG11  VAL 120          HG11      VAL 120 114.439  21.711   0.437
  963   HG12  VAL 120          HG12      VAL 120 115.139  21.050   1.914
  964   HG13  VAL 120          HG13      VAL 120 113.461  20.699   1.499
  965   HG21  VAL 120          HG21      VAL 120 116.874  20.440   0.117
  966   HG22  VAL 120          HG22      VAL 120 115.853  20.622  -1.310
  967   HG23  VAL 120          HG23      VAL 120 116.551  19.050  -0.919
  968    H    SER 121           HN       SER 121 113.866  16.355   1.240
  969    HA   SER 121           HA       SER 121 111.914  17.299   3.256
  970    HB2  SER 121           HB2      SER 121 111.039  14.925   1.886
  971    HB3  SER 121           HB1      SER 121 110.303  16.524   1.883
  972    HG   SER 121           HG       SER 121 112.005  15.317   0.060
  973    H    ALA 122           HN       ALA 122 113.951  14.671   2.157
  974    HA   ALA 122           HA       ALA 122 113.468  12.609   3.885
  975    HB1  ALA 122           HB1      ALA 122 115.159  12.666   2.051
  976    HB2  ALA 122           HB2      ALA 122 115.739  11.919   3.537
  977    HB3  ALA 122           HB3      ALA 122 116.229  13.563   3.128
  978    H    HIS 123           HN       HIS 123 116.194  12.560   5.168
  979    HA   HIS 123           HA       HIS 123 115.850  12.747   7.745
  980    HB2  HIS 123           HB2      HIS 123 118.106  13.097   8.051
  981    HB3  HIS 123           HB1      HIS 123 118.072  12.636   6.352
  982    HD2  HIS 123           HD2      HIS 123 117.612  15.318   4.760
  983    HE1  HIS 123           HE1      HIS 123 120.418  17.171   7.309
  984    HE2  HIS 123           HE2      HIS 123 119.192  17.368   5.095
  985    H    ASP 124           HN       ASP 124 116.198  15.645   5.740
  986    HA   ASP 124           HA       ASP 124 115.646  17.833   6.081
  987    HB2  ASP 124           HB2      ASP 124 113.443  16.750   6.725
  988    HB3  ASP 124           HB1      ASP 124 113.969  16.863   8.402
  989    H    ASP 125           HN       ASP 125 115.610  16.517   9.388
  990    HA   ASP 125           HA       ASP 125 116.530  18.396  10.958
  991    HB2  ASP 125           HB2      ASP 125 116.396  16.075  11.705
  992    HB3  ASP 125           HB1      ASP 125 117.862  15.685  10.807
  993   H5'1  C2E 501          H5'1      C2E 501 105.415   0.758  11.789
  994   H5'2  C2E 501          H5'2      C2E 501 107.058   1.405  11.960
  995    H4'  C2E 501           H4'      C2E 501 107.155  -0.016  10.073
  996    H3'  C2E 501           H3'      C2E 501 106.821   2.861   9.189
  997    H2'  C2E 501           H2'      C2E 501 106.895   2.152   6.943
  998   HO2'  C2E 501          HO2'      C2E 501 108.638   0.462   7.707
  999    H1'  C2E 501           H1'      C2E 501 105.348  -0.107   7.255
 1000    H8   C2E 501           H8       C2E 501 103.610   2.371   9.401
 1001    HN1  C2E 501           HN1      C2E 501 102.907   3.699   3.179
 1002   HN21  C2E 501          HN21      C2E 501 104.320   2.479   1.980
 1003   HN22  C2E 501          HN22      C2E 501 105.430   1.344   2.712
 1004   H511  C2E 501          H511      C2E 501 107.738   4.833  10.047
 1005   H512  C2E 501          H512      C2E 501 109.370   4.884  10.746
 1006    H4A  C2E 501           H4A      C2E 501 108.228   5.164  13.018
 1007    H3A  C2E 501           H3A      C2E 501 105.787   5.537  11.255
 1008    H2A  C2E 501           H2A      C2E 501 105.063   7.255  12.673
 1009   HO2A  C2E 501          HO2A      C2E 501 106.278   5.913  14.544
 1010    H1A  C2E 501           H1A      C2E 501 107.419   8.573  12.792
 1011    H81  C2E 501           H81      C2E 501 107.671   6.954   9.450
 1012   HN11  C2E 501          HN11      C2E 501 103.714  11.985   9.271
 1013   HN24  C2E 501          HN24      C2E 501 103.811  11.833  12.754
 1014   HN23  C2E 501          HN23      C2E 501 103.181  12.624  11.323
 1015   H5'1  C2E 502          H5'1      C2E 502 102.731  11.960   5.225
 1016   H5'2  C2E 502          H5'2      C2E 502 101.726  10.781   4.364
 1017    H4'  C2E 502           H4'      C2E 502  99.883  12.226   5.805
 1018    H3'  C2E 502           H3'      C2E 502 102.375  12.500   7.327
 1019    H2'  C2E 502           H2'      C2E 502 101.923  11.035   9.036
 1020   HO2'  C2E 502          HO2'      C2E 502  99.185  11.778   8.696
 1021    H1'  C2E 502           H1'      C2E 502  99.884   9.424   8.089
 1022    H8   C2E 502           H8       C2E 502 102.467   8.899   5.542
 1023    HN1  C2E 502           HN1      C2E 502 103.850   6.078  11.105
 1024   HN21  C2E 502          HN21      C2E 502 102.511   6.806  12.694
 1025   HN22  C2E 502          HN22      C2E 502 101.273   8.008  12.402
 1026   H511  C2E 502          H511      C2E 502 104.048  15.727   7.504
 1027   H512  C2E 502          H512      C2E 502 102.970  16.933   6.774
 1028    H4A  C2E 502           H4A      C2E 502 103.907  16.686   4.722
 1029    H3A  C2E 502           H3A      C2E 502 103.783  13.739   5.294
 1030    H2A  C2E 502           H2A      C2E 502 105.450  13.323   3.656
 1031   HO2A  C2E 502          HO2A      C2E 502 104.927  15.999   2.795
 1032    H1A  C2E 502           H1A      C2E 502 107.074  15.442   4.245
 1033    H81  C2E 502           H81      C2E 502 106.112  14.320   7.630
 1034   HN11  C2E 502          HN11      C2E 502 109.856  10.068   4.662
 1035   HN24  C2E 502          HN24      C2E 502 109.972  10.535   2.495
 1036   HN23  C2E 502          HN23      C2E 502 109.139  11.899   1.785
  Start of MODEL   11
    1    H    MET   1           H        MET   1 109.389  28.104  15.142
    2    HA   MET   1           HA       MET   1 108.628  26.771  13.463
    3    HB2  MET   1           HB2      MET   1 111.236  25.454  14.286
    4    HB3  MET   1           HB1      MET   1 110.539  25.456  12.667
    5    HG2  MET   1           HG2      MET   1 111.315  27.544  12.223
    6    HG3  MET   1           HG1      MET   1 110.791  28.160  13.790
    7    HE1  MET   1           HE1      MET   1 114.661  26.091  12.619
    8    HE2  MET   1           HE2      MET   1 113.061  25.981  11.890
    9    HE3  MET   1           HE3      MET   1 113.437  25.024  13.319
   10    H    SER   2           HN       SER   2 108.924  24.225  12.704
   11    HA   SER   2           HA       SER   2 108.550  22.176  14.558
   12    HB2  SER   2           HB2      SER   2 105.987  21.935  14.181
   13    HB3  SER   2           HB1      SER   2 106.558  23.070  15.400
   14    HG   SER   2           HG       SER   2 105.407  23.523  12.904
   15    H    ASP   3           HN       ASP   3 109.907  22.220  12.278
   16    HA   ASP   3           HA       ASP   3 108.584  21.481   9.917
   17    HB2  ASP   3           HB2      ASP   3 111.353  20.842  10.940
   18    HB3  ASP   3           HB1      ASP   3 110.796  20.332   9.348
   19    H    GLN   4           HN       GLN   4 106.976  20.210  11.328
   20    HA   GLN   4           HA       GLN   4 107.670  17.547  12.092
   21    HB2  GLN   4           HB2      GLN   4 105.036  18.955  11.671
   22    HB3  GLN   4           HB1      GLN   4 105.115  17.242  12.089
   23    HG2  GLN   4           HG2      GLN   4 106.498  19.406  13.693
   24    HG3  GLN   4           HG1      GLN   4 104.884  18.806  14.069
   25   HE21  GLN   4          HE21      GLN   4 108.320  17.939  14.027
   26   HE22  GLN   4          HE22      GLN   4 108.146  16.510  14.927
   27    H    HIS   5           HN       HIS   5 107.465  18.901   9.091
   28    HA   HIS   5           HA       HIS   5 106.227  16.667   7.707
   29    HB2  HIS   5           HB2      HIS   5 107.810  19.032   6.673
   30    HB3  HIS   5           HB1      HIS   5 106.988  17.848   5.660
   31    HD2  HIS   5           HD2      HIS   5 104.849  18.650   8.722
   32    HE1  HIS   5           HE1      HIS   5 103.435  21.152   5.629
   33    HE2  HIS   5           HE2      HIS   5 102.948  20.269   7.960
   34    H    ASP   6           HN       ASP   6 109.242  17.492   9.013
   35    HA   ASP   6           HA       ASP   6 111.307  16.529   7.612
   36    HB2  ASP   6           HB2      ASP   6 110.537  15.825  10.442
   37    HB3  ASP   6           HB1      ASP   6 112.089  15.380   9.733
   38    H    GLU   7           HN       GLU   7 112.211  14.583   6.989
   39    HA   GLU   7           HA       GLU   7 110.303  12.477   6.455
   40    HB2  GLU   7           HB2      GLU   7 111.837  13.043   4.699
   41    HB3  GLU   7           HB1      GLU   7 113.226  12.801   5.758
   42    HG2  GLU   7           HG2      GLU   7 113.280  10.600   5.238
   43    HG3  GLU   7           HG1      GLU   7 111.623  10.404   5.799
   44    H    ARG   8           HN       ARG   8 110.111  10.602   7.468
   45    HA   ARG   8           HA       ARG   8 112.006   9.929   9.643
   46    HB2  ARG   8           HB2      ARG   8 109.003   9.894   9.585
   47    HB3  ARG   8           HB1      ARG   8 109.882   8.788  10.628
   48    HG2  ARG   8           HG2      ARG   8 109.569  10.622  12.037
   49    HG3  ARG   8           HG1      ARG   8 111.179  10.931  11.398
   50    HD2  ARG   8           HD2      ARG   8 109.676  12.937  11.365
   51    HD3  ARG   8           HD1      ARG   8 110.305  12.504   9.786
   52    HE   ARG   8           HE       ARG   8 108.010  11.259   9.621
   53   HH11  ARG   8          HH21      ARG   8 108.674  14.283  11.182
   54   HH12  ARG   8          HH22      ARG   8 107.098  14.934  10.885
   55   HH21  ARG   8          HH11      ARG   8 105.956  12.122   9.219
   56   HH22  ARG   8          HH12      ARG   8 105.561  13.712   9.775
   57    H    ARG   9           HN       ARG   9 110.571   8.998   6.730
   58    HA   ARG   9           HA       ARG   9 110.816   6.110   7.246
   59    HB2  ARG   9           HB2      ARG   9 109.871   7.375   4.673
   60    HB3  ARG   9           HB1      ARG   9 109.561   5.746   5.268
   61    HG2  ARG   9           HG2      ARG   9 108.050   6.500   6.919
   62    HG3  ARG   9           HG1      ARG   9 108.611   8.159   6.794
   63    HD2  ARG   9           HD2      ARG   9 107.727   7.570   4.215
   64    HD3  ARG   9           HD1      ARG   9 106.547   6.791   5.260
   65    HE   ARG   9           HE       ARG   9 106.940   9.365   6.275
   66   HH11  ARG   9          HH21      ARG   9 105.794   7.794   3.411
   67   HH12  ARG   9          HH22      ARG   9 104.731   9.086   2.964
   68   HH21  ARG   9          HH11      ARG   9 105.561  11.063   5.688
   69   HH22  ARG   9          HH12      ARG   9 104.600  10.938   4.253
   70    H    ARG  10           HN       ARG  10 113.163   6.440   7.439
   71    HA   ARG  10           HA       ARG  10 115.304   6.860   6.505
   72    HB2  ARG  10           HB2      ARG  10 115.401   4.756   4.706
   73    HB3  ARG  10           HB1      ARG  10 115.688   4.636   6.438
   74    HG2  ARG  10           HG2      ARG  10 112.873   4.482   5.381
   75    HG3  ARG  10           HG1      ARG  10 113.915   3.067   5.316
   76    HD2  ARG  10           HD2      ARG  10 114.101   2.928   7.645
   77    HD3  ARG  10           HD1      ARG  10 113.648   4.611   7.882
   78    HE   ARG  10           HE       ARG  10 111.390   3.995   7.717
   79   HH11  ARG  10          HH21      ARG  10 113.535   1.397   6.924
   80   HH12  ARG  10          HH22      ARG  10 112.297   0.186   6.935
   81   HH21  ARG  10          HH11      ARG  10 109.757   2.411   7.732
   82   HH22  ARG  10          HH12      ARG  10 110.158   0.760   7.393
   83    H    PHE  11           HN       PHE  11 113.654   5.584   3.637
   84    HA   PHE  11           HA       PHE  11 114.330   8.069   2.182
   85    HB2  PHE  11           HB2      PHE  11 115.037   5.241   1.549
   86    HB3  PHE  11           HB1      PHE  11 114.561   6.274   0.202
   87    HD1  PHE  11           HD2      PHE  11 115.852   8.310  -0.347
   88    HD2  PHE  11           HD1      PHE  11 117.091   5.636   2.778
   89    HE1  PHE  11           HE2      PHE  11 118.097   9.364  -0.335
   90    HE2  PHE  11           HE1      PHE  11 119.337   6.691   2.790
   91    HZ   PHE  11           HZ       PHE  11 119.838   8.555   1.234
   92    H    HIS  12           HN       HIS  12 112.894   8.573   0.440
   93    HA   HIS  12           HA       HIS  12 110.206   8.277   0.914
   94    HB2  HIS  12           HB2      HIS  12 110.059   8.602  -1.716
   95    HB3  HIS  12           HB1      HIS  12 110.626   9.902  -0.669
   96    HD2  HIS  12           HD2      HIS  12 113.563  10.095  -0.569
   97    HE1  HIS  12           HE1      HIS  12 114.067   8.039  -4.222
   98    HE2  HIS  12           HE2      HIS  12 115.228   9.486  -2.488
   99    H    ARG  13           HN       ARG  13 108.526   7.057  -0.162
  100    HA   ARG  13           HA       ARG  13 109.378   4.290  -0.739
  101    HB2  ARG  13           HB2      ARG  13 106.492   4.813  -0.369
  102    HB3  ARG  13           HB1      ARG  13 107.517   3.573   0.355
  103    HG2  ARG  13           HG2      ARG  13 108.516   5.379   1.820
  104    HG3  ARG  13           HG1      ARG  13 107.281   6.474   1.202
  105    HD2  ARG  13           HD2      ARG  13 106.165   3.927   2.134
  106    HD3  ARG  13           HD1      ARG  13 107.001   4.813   3.404
  107    HE   ARG  13           HE       ARG  13 105.121   6.356   1.789
  108   HH11  ARG  13          HH21      ARG  13 105.758   4.516   4.655
  109   HH12  ARG  13          HH22      ARG  13 104.470   5.231   5.562
  110   HH21  ARG  13          HH11      ARG  13 103.435   7.293   2.978
  111   HH22  ARG  13          HH12      ARG  13 103.155   6.800   4.613
  112    H    ILE  14           HN       ILE  14 107.107   3.388  -2.016
  113    HA   ILE  14           HA       ILE  14 107.350   4.718  -4.639
  114    HB   ILE  14           HB       ILE  14 106.285   1.973  -3.953
  115   HG12  ILE  14          HG12      ILE  14 108.657   2.083  -3.435
  116   HG13  ILE  14          HG11      ILE  14 108.447   1.189  -4.938
  117   HG21  ILE  14          HG21      ILE  14 105.344   2.667  -6.022
  118   HG22  ILE  14          HG22      ILE  14 106.725   1.660  -6.457
  119   HG23  ILE  14          HG23      ILE  14 106.851   3.418  -6.544
  120   HD11  ILE  14          HD11      ILE  14 110.189   2.649  -5.487
  121   HD12  ILE  14          HD12      ILE  14 109.522   3.966  -4.524
  122   HD13  ILE  14          HD13      ILE  14 108.783   3.539  -6.067
  123    H    ALA  15           HN       ALA  15 105.812   6.346  -4.519
  124    HA   ALA  15           HA       ALA  15 103.085   5.628  -3.702
  125    HB1  ALA  15           HB1      ALA  15 102.626   8.024  -3.899
  126    HB2  ALA  15           HB2      ALA  15 104.248   8.292  -4.539
  127    HB3  ALA  15           HB3      ALA  15 104.035   7.743  -2.875
  128    H    PHE  16           HN       PHE  16 101.695   4.937  -5.110
  129    HA   PHE  16           HA       PHE  16 101.469   6.165  -7.726
  130    HB2  PHE  16           HB2      PHE  16 101.579   4.127  -8.993
  131    HB3  PHE  16           HB1      PHE  16 103.057   4.237  -8.042
  132    HD1  PHE  16           HD2      PHE  16 102.814   3.165  -5.574
  133    HD2  PHE  16           HD1      PHE  16 100.490   2.075  -9.018
  134    HE1  PHE  16           HE2      PHE  16 102.340   0.956  -4.559
  135    HE2  PHE  16           HE1      PHE  16 100.024  -0.137  -8.004
  136    HZ   PHE  16           HZ       PHE  16 100.955  -0.697  -5.775
  137    H    ASP  17           HN       ASP  17  99.350   5.622  -8.723
  138    HA   ASP  17           HA       ASP  17  97.407   5.117  -6.596
  139    HB2  ASP  17           HB2      ASP  17  95.774   6.080  -8.103
  140    HB3  ASP  17           HB1      ASP  17  97.190   7.128  -8.050
  141    H    ALA  18           HN       ALA  18  95.817   3.535  -6.725
  142    HA   ALA  18           HA       ALA  18  95.282   1.893  -8.917
  143    HB1  ALA  18           HB1      ALA  18  96.378  -0.237  -7.884
  144    HB2  ALA  18           HB2      ALA  18  97.450   0.907  -7.076
  145    HB3  ALA  18           HB3      ALA  18  97.386   0.852  -8.837
  146    H    ASP  19           HN       ASP  19  94.261  -0.291  -8.060
  147    HA   ASP  19           HA       ASP  19  92.438   0.550  -5.903
  148    HB2  ASP  19           HB2      ASP  19  91.589  -0.290  -8.151
  149    HB3  ASP  19           HB1      ASP  19  92.166  -1.885  -7.672
  150    H    SER  20           HN       SER  20  92.374  -0.402  -3.949
  151    HA   SER  20           HA       SER  20  93.818  -2.945  -3.584
  152    HB2  SER  20           HB2      SER  20  94.474  -1.922  -1.276
  153    HB3  SER  20           HB1      SER  20  95.415  -1.486  -2.699
  154    HG   SER  20           HG       SER  20  94.561   0.253  -1.228
  155    H    GLU  21           HN       GLU  21  93.071  -4.234  -1.919
  156    HA   GLU  21           HA       GLU  21  90.462  -3.477  -0.716
  157    HB2  GLU  21           HB2      GLU  21  91.185  -6.220  -1.800
  158    HB3  GLU  21           HB1      GLU  21  89.641  -5.733  -1.105
  159    HG2  GLU  21           HG2      GLU  21  90.732  -4.243  -3.481
  160    HG3  GLU  21           HG1      GLU  21  89.935  -5.794  -3.722
  161    H    ILE  22           HN       ILE  22  90.289  -3.941   1.415
  162    HA   ILE  22           HA       ILE  22  92.519  -5.495   2.604
  163    HB   ILE  22           HB       ILE  22  91.010  -3.108   3.686
  164   HG12  ILE  22          HG12      ILE  22  93.341  -3.288   2.114
  165   HG13  ILE  22          HG11      ILE  22  92.781  -1.877   3.001
  166   HG21  ILE  22          HG21      ILE  22  92.509  -3.389   5.693
  167   HG22  ILE  22          HG22      ILE  22  92.992  -4.957   5.043
  168   HG23  ILE  22          HG23      ILE  22  91.314  -4.669   5.504
  169   HD11  ILE  22          HD11      ILE  22  94.087  -2.525   4.952
  170   HD12  ILE  22          HD12      ILE  22  95.138  -2.487   3.539
  171   HD13  ILE  22          HD13      ILE  22  94.565  -4.032   4.171
  172    H    LEU  23           HN       LEU  23  92.091  -7.101   3.928
  173    HA   LEU  23           HA       LEU  23  89.256  -7.627   4.644
  174    HB2  LEU  23           HB2      LEU  23  91.169  -9.874   4.199
  175    HB3  LEU  23           HB1      LEU  23  89.424  -9.806   3.947
  176    HG   LEU  23           HG       LEU  23  90.109  -8.018   2.104
  177   HD11  LEU  23          HD11      LEU  23  92.457  -9.829   1.748
  178   HD12  LEU  23          HD12      LEU  23  92.603  -8.533   2.932
  179   HD13  LEU  23          HD13      LEU  23  92.242  -8.151   1.252
  180   HD21  LEU  23          HD21      LEU  23  88.920 -10.188   1.738
  181   HD22  LEU  23          HD22      LEU  23  90.484 -11.000   1.676
  182   HD23  LEU  23          HD23      LEU  23  90.056  -9.813   0.442
  183    H    GLN  24           HN       GLN  24  88.936  -7.734   6.707
  184    HA   GLN  24           HA       GLN  24  91.086  -8.776   8.472
  185    HB2  GLN  24           HB2      GLN  24  91.087  -6.401   8.857
  186    HB3  GLN  24           HB1      GLN  24  89.326  -6.363   8.977
  187    HG2  GLN  24           HG2      GLN  24  89.312  -7.455  11.057
  188    HG3  GLN  24           HG1      GLN  24  90.924  -8.128  10.825
  189   HE21  GLN  24          HE21      GLN  24  89.149  -5.380  12.037
  190   HE22  GLN  24          HE22      GLN  24  90.501  -4.483  12.541
  191    H    GLY  25           HN       GLY  25  90.237 -10.763   8.906
  192    HA2  GLY  25           HA2      GLY  25  88.887 -12.240  10.078
  193    HA3  GLY  25           HA1      GLY  25  87.844 -10.888  10.524
  194    H    GLU  26           HN       GLU  26  85.834 -11.281   9.795
  195    HA   GLU  26           HA       GLU  26  85.486 -12.619   7.195
  196    HB2  GLU  26           HB2      GLU  26  83.145 -12.910   7.917
  197    HB3  GLU  26           HB1      GLU  26  84.278 -13.599   9.076
  198    HG2  GLU  26           HG2      GLU  26  82.901 -12.420  10.520
  199    HG3  GLU  26           HG1      GLU  26  84.115 -11.192  10.181
  200    H    ARG  27           HN       ARG  27  86.045  -9.606   8.030
  201    HA   ARG  27           HA       ARG  27  83.852  -8.419   6.438
  202    HB2  ARG  27           HB2      ARG  27  85.753  -7.051   8.331
  203    HB3  ARG  27           HB1      ARG  27  84.399  -6.320   7.474
  204    HG2  ARG  27           HG2      ARG  27  83.153  -6.833   9.294
  205    HG3  ARG  27           HG1      ARG  27  83.222  -8.501   8.721
  206    HD2  ARG  27           HD2      ARG  27  85.313  -8.825  10.010
  207    HD3  ARG  27           HD1      ARG  27  85.168  -7.181  10.626
  208    HE   ARG  27           HE       ARG  27  83.617  -9.486  11.468
  209   HH11  ARG  27          HH21      ARG  27  83.836  -6.040  11.235
  210   HH12  ARG  27          HH22      ARG  27  82.739  -5.742  12.544
  211   HH21  ARG  27          HH11      ARG  27  82.176  -9.102  13.187
  212   HH22  ARG  27          HH12      ARG  27  81.798  -7.475  13.645
  213    H    ARG  28           HN       ARG  28  84.290  -7.510   4.537
  214    HA   ARG  28           HA       ARG  28  87.100  -6.876   3.839
  215    HB2  ARG  28           HB2      ARG  28  86.241  -8.985   2.727
  216    HB3  ARG  28           HB1      ARG  28  85.014  -7.996   1.940
  217    HG2  ARG  28           HG2      ARG  28  87.202  -6.548   1.290
  218    HG3  ARG  28           HG1      ARG  28  87.948  -8.135   1.432
  219    HD2  ARG  28           HD2      ARG  28  85.978  -8.954  -0.046
  220    HD3  ARG  28           HD1      ARG  28  85.756  -7.251  -0.433
  221    HE   ARG  28           HE       ARG  28  88.317  -7.459  -1.018
  222   HH11  ARG  28          HH21      ARG  28  85.780  -9.765  -1.547
  223   HH12  ARG  28          HH22      ARG  28  86.534 -10.474  -2.935
  224   HH21  ARG  28          HH11      ARG  28  89.299  -8.388  -2.835
  225   HH22  ARG  28          HH12      ARG  28  88.523  -9.696  -3.663
  226    H    TRP  29           HN       TRP  29  87.431  -5.089   2.590
  227    HA   TRP  29           HA       TRP  29  85.132  -3.445   1.839
  228    HB2  TRP  29           HB2      TRP  29  87.431  -2.503   3.555
  229    HB3  TRP  29           HB1      TRP  29  86.097  -1.505   2.978
  230    HD1  TRP  29           HD1      TRP  29  83.583  -2.479   3.809
  231    HE1  TRP  29           HE1      TRP  29  82.950  -3.282   6.193
  232    HE3  TRP  29           HE3      TRP  29  88.216  -3.560   5.606
  233    HZ2  TRP  29           HZ2      TRP  29  84.278  -4.256   8.551
  234    HZ3  TRP  29           HZ3      TRP  29  88.523  -4.417   7.908
  235    HH2  TRP  29           HH2      TRP  29  86.561  -4.774   9.384
  236    H    GLU  30           HN       GLU  30  85.660  -1.796   0.342
  237    HA   GLU  30           HA       GLU  30  88.051  -2.413  -1.247
  238    HB2  GLU  30           HB2      GLU  30  86.000  -0.501  -2.252
  239    HB3  GLU  30           HB1      GLU  30  86.864  -1.780  -3.105
  240    HG2  GLU  30           HG2      GLU  30  85.484  -3.463  -1.853
  241    HG3  GLU  30           HG1      GLU  30  84.554  -2.128  -1.172
  242    H    VAL  31           HN       VAL  31  89.736  -0.982  -1.301
  243    HA   VAL  31           HA       VAL  31  89.227   1.835  -0.602
  244    HB   VAL  31           HB       VAL  31  91.202   1.849   0.889
  245   HG11  VAL  31          HG11      VAL  31  90.147   0.602   2.760
  246   HG12  VAL  31          HG12      VAL  31  89.053  -0.165   1.611
  247   HG13  VAL  31          HG13      VAL  31  88.978   1.578   1.871
  248   HG21  VAL  31          HG21      VAL  31  92.282  -0.185   1.554
  249   HG22  VAL  31          HG22      VAL  31  92.238  -0.212  -0.207
  250   HG23  VAL  31          HG23      VAL  31  91.085  -1.173   0.719
  251    H    LEU  32           HN       LEU  32  90.878   3.290  -1.283
  252    HA   LEU  32           HA       LEU  32  92.330   2.329  -3.650
  253    HB2  LEU  32           HB2      LEU  32  92.749   4.813  -3.993
  254    HB3  LEU  32           HB1      LEU  32  91.067   4.303  -4.117
  255    HG   LEU  32           HG       LEU  32  92.040   5.139  -1.415
  256   HD11  LEU  32          HD11      LEU  32  92.962   6.859  -2.977
  257   HD12  LEU  32          HD12      LEU  32  91.712   7.503  -1.912
  258   HD13  LEU  32          HD13      LEU  32  91.331   7.127  -3.592
  259   HD21  LEU  32          HD21      LEU  32  89.670   4.326  -2.132
  260   HD22  LEU  32          HD22      LEU  32  89.503   5.932  -2.840
  261   HD23  LEU  32          HD23      LEU  32  89.786   5.757  -1.108
  262    H    LEU  33           HN       LEU  33  94.511   2.125  -3.653
  263    HA   LEU  33           HA       LEU  33  95.879   2.640  -1.118
  264    HB2  LEU  33           HB2      LEU  33  96.358   0.482  -1.983
  265    HB3  LEU  33           HB1      LEU  33  96.617   1.098  -3.613
  266    HG   LEU  33           HG       LEU  33  98.407   2.287  -1.564
  267   HD11  LEU  33          HD11      LEU  33  98.169  -0.137  -0.835
  268   HD12  LEU  33          HD12      LEU  33  99.802   0.363  -1.263
  269   HD13  LEU  33          HD13      LEU  33  98.848  -0.590  -2.398
  270   HD21  LEU  33          HD21      LEU  33  99.977   2.188  -3.331
  271   HD22  LEU  33          HD22      LEU  33  98.444   2.470  -4.155
  272   HD23  LEU  33          HD23      LEU  33  99.140   0.851  -4.118
  273    H    HIS  34           HN       HIS  34  97.124   4.309  -0.780
  274    HA   HIS  34           HA       HIS  34  97.651   6.148  -2.994
  275    HB2  HIS  34           HB2      HIS  34  97.787   6.359   0.016
  276    HB3  HIS  34           HB1      HIS  34  98.391   7.646  -1.035
  277    HD2  HIS  34           HD2      HIS  34  94.948   5.970  -0.071
  278    HE1  HIS  34           HE1      HIS  34  94.138   9.526  -2.191
  279    HE2  HIS  34           HE2      HIS  34  93.099   7.629  -0.863
  280    H    ASP  35           HN       ASP  35  99.450   3.953  -0.932
  281    HA   ASP  35           HA       ASP  35 101.608   4.050  -2.703
  282    HB2  ASP  35           HB2      ASP  35 103.336   5.246  -1.481
  283    HB3  ASP  35           HB1      ASP  35 101.937   6.314  -1.634
  284    H    VAL  36           HN       VAL  36 103.515   2.829  -1.976
  285    HA   VAL  36           HA       VAL  36 103.082   1.098   0.346
  286    HB   VAL  36           HB       VAL  36 102.016   0.112  -1.789
  287   HG11  VAL  36          HG11      VAL  36 104.874  -0.582  -2.458
  288   HG12  VAL  36          HG12      VAL  36 104.102   0.849  -3.138
  289   HG13  VAL  36          HG13      VAL  36 103.436  -0.752  -3.465
  290   HG21  VAL  36          HG21      VAL  36 102.716  -1.161   0.308
  291   HG22  VAL  36          HG22      VAL  36 104.204  -1.567  -0.543
  292   HG23  VAL  36          HG23      VAL  36 102.653  -2.110  -1.173
  293    H    SER  37           HN       SER  37 104.945  -0.410   0.645
  294    HA   SER  37           HA       SER  37 107.490   0.552  -0.421
  295    HB2  SER  37           HB2      SER  37 107.042   1.766   1.755
  296    HB3  SER  37           HB1      SER  37 107.007   0.194   2.551
  297    HG   SER  37           HG       SER  37 109.154   1.231   1.001
  298    H    LEU  38           HN       LEU  38 109.251  -1.094   0.343
  299    HA   LEU  38           HA       LEU  38 108.297  -3.665  -0.363
  300    HB2  LEU  38           HB2      LEU  38 110.637  -4.413   0.383
  301    HB3  LEU  38           HB1      LEU  38 110.563  -3.229  -0.921
  302    HG   LEU  38           HG       LEU  38 110.618  -2.078   1.814
  303   HD11  LEU  38          HD11      LEU  38 112.937  -3.646   0.666
  304   HD12  LEU  38          HD12      LEU  38 112.199  -3.815   2.259
  305   HD13  LEU  38          HD13      LEU  38 113.150  -2.380   1.874
  306   HD21  LEU  38          HD21      LEU  38 111.892  -0.392   0.754
  307   HD22  LEU  38          HD22      LEU  38 110.768  -0.908  -0.500
  308   HD23  LEU  38          HD23      LEU  38 112.435  -1.480  -0.522
  309    H    HIS  39           HN       HIS  39 107.833  -2.067   2.464
  310    HA   HIS  39           HA       HIS  39 107.143  -4.517   3.842
  311    HB2  HIS  39           HB2      HIS  39 109.606  -4.123   4.314
  312    HB3  HIS  39           HB1      HIS  39 109.117  -2.667   5.181
  313    HD2  HIS  39           HD2      HIS  39 108.117  -3.131   7.749
  314    HE1  HIS  39           HE1      HIS  39 108.004  -7.346   7.526
  315    HE2  HIS  39           HE2      HIS  39 107.704  -5.348   9.065
  316    H    GLY  40           HN       GLY  40 105.612  -2.270   2.907
  317    HA2  GLY  40           HA2      GLY  40 104.047  -1.748   5.204
  318    HA3  GLY  40           HA1      GLY  40 105.057  -0.351   4.871
  319    H    ILE  41           HN       ILE  41 102.194  -0.358   4.759
  320    HA   ILE  41           HA       ILE  41 101.804   0.515   1.978
  321    HB   ILE  41           HB       ILE  41 100.740  -1.379   1.409
  322   HG12  ILE  41          HG12      ILE  41  98.733  -0.684   3.583
  323   HG13  ILE  41          HG11      ILE  41  98.783   0.100   2.001
  324   HG21  ILE  41          HG21      ILE  41 101.841  -2.654   3.123
  325   HG22  ILE  41          HG22      ILE  41 100.142  -3.122   3.131
  326   HG23  ILE  41          HG23      ILE  41 100.761  -2.024   4.366
  327   HD11  ILE  41          HD11      ILE  41  98.491  -2.101   0.913
  328   HD12  ILE  41          HD12      ILE  41  97.144  -1.719   1.987
  329   HD13  ILE  41          HD13      ILE  41  98.386  -2.861   2.501
  330    H    LEU  42           HN       LEU  42 100.190   1.965   1.653
  331    HA   LEU  42           HA       LEU  42  98.858   3.074   4.061
  332    HB2  LEU  42           HB2      LEU  42 100.769   4.357   2.516
  333    HB3  LEU  42           HB1      LEU  42  99.263   4.928   1.808
  334    HG   LEU  42           HG       LEU  42  99.768   4.982   4.789
  335   HD11  LEU  42          HD11      LEU  42 101.449   6.335   3.438
  336   HD12  LEU  42          HD12      LEU  42 100.484   7.262   4.584
  337   HD13  LEU  42          HD13      LEU  42 100.087   7.294   2.866
  338   HD21  LEU  42          HD21      LEU  42  97.412   5.134   3.883
  339   HD22  LEU  42          HD22      LEU  42  97.895   6.620   3.068
  340   HD23  LEU  42          HD23      LEU  42  97.929   6.527   4.830
  341    H    VAL  43           HN       VAL  43  96.668   3.470   3.841
  342    HA   VAL  43           HA       VAL  43  95.483   3.293   1.155
  343    HB   VAL  43           HB       VAL  43  93.808   1.669   1.902
  344   HG11  VAL  43          HG11      VAL  43  96.550   0.605   2.605
  345   HG12  VAL  43          HG12      VAL  43  96.088   0.987   0.946
  346   HG13  VAL  43          HG13      VAL  43  95.214  -0.257   1.842
  347   HG21  VAL  43          HG21      VAL  43  94.253   0.504   4.110
  348   HG22  VAL  43          HG22      VAL  43  93.694   2.170   4.259
  349   HG23  VAL  43          HG23      VAL  43  95.403   1.790   4.474
  350    H    GLY  44           HN       GLY  44  93.028   3.614   1.354
  351    HA2  GLY  44           HA2      GLY  44  92.583   6.044   2.989
  352    HA3  GLY  44           HA1      GLY  44  91.607   5.533   1.611
  353    H    GLN  45           HN       GLN  45  90.830   6.160   4.553
  354    HA   GLN  45           HA       GLN  45  90.037   3.586   5.567
  355    HB2  GLN  45           HB2      GLN  45  90.779   5.394   7.048
  356    HB3  GLN  45           HB1      GLN  45  89.408   6.372   6.539
  357    HG2  GLN  45           HG2      GLN  45  88.877   3.607   7.575
  358    HG3  GLN  45           HG1      GLN  45  89.267   4.875   8.732
  359   HE21  GLN  45          HE21      GLN  45  86.700   3.756   8.811
  360   HE22  GLN  45          HE22      GLN  45  85.568   4.886   8.242
  361    HA   PRO  46           HA       PRO  46  86.054   4.323   3.551
  362    HB2  PRO  46           HB2      PRO  46  85.137   1.763   3.427
  363    HB3  PRO  46           HB1      PRO  46  86.453   2.323   2.371
  364    HG2  PRO  46           HG2      PRO  46  86.592   0.692   4.860
  365    HG3  PRO  46           HG1      PRO  46  87.557   0.573   3.380
  366    HD2  PRO  46           HD2      PRO  46  88.366   1.873   5.748
  367    HD3  PRO  46           HD1      PRO  46  89.110   2.083   4.151
  368    H    GLN  47           HN       GLN  47  83.742   4.052   4.204
  369    HA   GLN  47           HA       GLN  47  83.350   4.575   6.952
  370    HB2  GLN  47           HB2      GLN  47  81.386   3.888   4.764
  371    HB3  GLN  47           HB1      GLN  47  80.926   4.449   6.371
  372    HG2  GLN  47           HG2      GLN  47  81.425   6.602   5.868
  373    HG3  GLN  47           HG1      GLN  47  82.981   6.154   5.172
  374   HE21  GLN  47          HE21      GLN  47  79.476   5.849   4.320
  375   HE22  GLN  47          HE22      GLN  47  79.707   6.204   2.677
  376    H    ASP  48           HN       ASP  48  82.765   1.648   5.033
  377    HA   ASP  48           HA       ASP  48  81.475   0.223   7.148
  378    HB2  ASP  48           HB2      ASP  48  82.637  -0.565   4.493
  379    HB3  ASP  48           HB1      ASP  48  82.000  -1.772   5.609
  380    H    TRP  49           HN       TRP  49  84.490   1.284   7.224
  381    HA   TRP  49           HA       TRP  49  86.169  -0.917   7.665
  382    HB2  TRP  49           HB2      TRP  49  86.887   1.458   7.448
  383    HB3  TRP  49           HB1      TRP  49  86.260   1.756   9.066
  384    HD1  TRP  49           HD1      TRP  49  87.598   0.853  11.081
  385    HE1  TRP  49           HE1      TRP  49  90.031  -0.084  11.332
  386    HE3  TRP  49           HE3      TRP  49  88.578  -0.130   6.227
  387    HZ2  TRP  49           HZ2      TRP  49  92.137  -1.137   9.539
  388    HZ3  TRP  49           HZ3      TRP  49  90.737  -1.094   5.504
  389    HH2  TRP  49           HH2      TRP  49  92.488  -1.606   7.167
  390    H    ASN  50           HN       ASN  50  84.376  -2.250   8.817
  391    HA   ASN  50           HA       ASN  50  84.236  -1.604  11.677
  392    HB2  ASN  50           HB2      ASN  50  82.220  -2.430  10.253
  393    HB3  ASN  50           HB1      ASN  50  82.964  -4.020  10.400
  394   HD21  ASN  50          HD21      ASN  50  83.970  -3.872  13.053
  395   HD22  ASN  50          HD22      ASN  50  82.662  -3.735  14.125
  396    H    GLY  51           HN       GLY  51  86.532  -1.953  11.957
  397    HA2  GLY  51           HA2      GLY  51  87.127  -4.789  12.480
  398    HA3  GLY  51           HA1      GLY  51  88.251  -3.856  11.501
  399    H    ASP  52           HN       ASP  52  88.924  -5.095  13.904
  400    HA   ASP  52           HA       ASP  52  89.085  -2.979  15.918
  401    HB2  ASP  52           HB2      ASP  52  89.623  -5.928  15.894
  402    HB3  ASP  52           HB1      ASP  52  90.286  -4.918  17.180
  403    HA   PRO  53           HA       PRO  53  93.105  -1.862  14.260
  404    HB2  PRO  53           HB2      PRO  53  93.864  -0.289  16.430
  405    HB3  PRO  53           HB1      PRO  53  92.918   0.279  15.043
  406    HG2  PRO  53           HG2      PRO  53  92.016  -0.498  17.759
  407    HG3  PRO  53           HG1      PRO  53  91.381   0.743  16.664
  408    HD2  PRO  53           HD2      PRO  53  90.141  -1.653  17.055
  409    HD3  PRO  53           HD1      PRO  53  90.038  -0.761  15.520
  410    H    GLN  54           HN       GLN  54  92.459  -3.357  17.306
  411    HA   GLN  54           HA       GLN  54  95.212  -3.887  17.938
  412    HB2  GLN  54           HB2      GLN  54  92.705  -5.172  19.051
  413    HB3  GLN  54           HB1      GLN  54  94.321  -5.271  19.748
  414    HG2  GLN  54           HG2      GLN  54  93.403  -2.507  19.237
  415    HG3  GLN  54           HG1      GLN  54  92.440  -3.376  20.431
  416   HE21  GLN  54          HE21      GLN  54  93.216  -3.007  22.501
  417   HE22  GLN  54          HE22      GLN  54  94.854  -2.827  22.912
  418    H    ARG  55           HN       ARG  55  92.780  -5.352  15.981
  419    HA   ARG  55           HA       ARG  55  94.260  -7.889  15.857
  420    HB2  ARG  55           HB2      ARG  55  91.516  -7.020  14.949
  421    HB3  ARG  55           HB1      ARG  55  92.247  -8.493  14.316
  422    HG2  ARG  55           HG2      ARG  55  92.619  -9.198  16.742
  423    HG3  ARG  55           HG1      ARG  55  91.574  -7.851  17.194
  424    HD2  ARG  55           HD2      ARG  55  89.759  -8.765  15.831
  425    HD3  ARG  55           HD1      ARG  55  90.799 -10.078  15.290
  426    HE   ARG  55           HE       ARG  55  89.377  -9.960  17.768
  427   HH11  ARG  55          HH21      ARG  55  92.317 -11.000  16.269
  428   HH12  ARG  55          HH22      ARG  55  92.581 -12.305  17.376
  429   HH21  ARG  55          HH11      ARG  55  89.716 -11.671  19.222
  430   HH22  ARG  55          HH12      ARG  55  91.110 -12.685  19.047
  431    HA   PRO  56           HA       PRO  56  96.307  -6.855  12.134
  432    HB2  PRO  56           HB2      PRO  56  96.416  -9.311  10.892
  433    HB3  PRO  56           HB1      PRO  56  97.446  -8.845  12.259
  434    HG2  PRO  56           HG2      PRO  56  94.950 -10.475  12.241
  435    HG3  PRO  56           HG1      PRO  56  96.447 -10.711  13.161
  436    HD2  PRO  56           HD2      PRO  56  94.221  -9.632  14.285
  437    HD3  PRO  56           HD1      PRO  56  95.858  -9.153  14.783
  438    H    PHE  57           HN       PHE  57  96.162  -6.743   9.829
  439    HA   PHE  57           HA       PHE  57  93.453  -7.151   8.701
  440    HB2  PHE  57           HB2      PHE  57  95.272  -4.763   8.257
  441    HB3  PHE  57           HB1      PHE  57  93.715  -5.033   7.481
  442    HD1  PHE  57           HD2      PHE  57  95.290  -4.714  10.869
  443    HD2  PHE  57           HD1      PHE  57  91.753  -4.224   8.486
  444    HE1  PHE  57           HE2      PHE  57  94.148  -3.616  12.781
  445    HE2  PHE  57           HE1      PHE  57  90.613  -3.132  10.392
  446    HZ   PHE  57           HZ       PHE  57  91.807  -2.830  12.542
  447    H    GLU  58           HN       GLU  58  93.540  -7.477   6.306
  448    HA   GLU  58           HA       GLU  58  96.253  -8.179   5.380
  449    HB2  GLU  58           HB2      GLU  58  93.664  -9.618   4.714
  450    HB3  GLU  58           HB1      GLU  58  95.237  -9.992   4.008
  451    HG2  GLU  58           HG2      GLU  58  96.106 -10.776   6.050
  452    HG3  GLU  58           HG1      GLU  58  94.857  -9.970   6.999
  453    H    ALA  59           HN       ALA  59  96.820  -7.437   3.289
  454    HA   ALA  59           HA       ALA  59  94.755  -5.791   1.929
  455    HB1  ALA  59           HB1      ALA  59  96.901  -4.584   1.106
  456    HB2  ALA  59           HB2      ALA  59  97.662  -5.351   2.500
  457    HB3  ALA  59           HB3      ALA  59  96.300  -4.258   2.728
  458    H    ARG  60           HN       ARG  60  94.465  -6.067  -0.179
  459    HA   ARG  60           HA       ARG  60  96.332  -7.831  -1.659
  460    HB2  ARG  60           HB2      ARG  60  93.312  -7.667  -1.846
  461    HB3  ARG  60           HB1      ARG  60  94.331  -8.517  -3.008
  462    HG2  ARG  60           HG2      ARG  60  95.272  -9.559  -0.657
  463    HG3  ARG  60           HG1      ARG  60  93.584  -9.281  -0.240
  464    HD2  ARG  60           HD2      ARG  60  94.582 -10.841  -2.638
  465    HD3  ARG  60           HD1      ARG  60  93.883 -11.532  -1.177
  466    HE   ARG  60           HE       ARG  60  92.445 -10.147  -3.310
  467   HH11  ARG  60          HH21      ARG  60  92.474 -11.467  -0.111
  468   HH12  ARG  60          HH22      ARG  60  90.751 -11.580   0.007
  469   HH21  ARG  60          HH11      ARG  60  90.184 -10.293  -3.162
  470   HH22  ARG  60          HH12      ARG  60  89.453 -10.913  -1.718
  471    H    LEU  61           HN       LEU  61  97.216  -6.813  -3.406
  472    HA   LEU  61           HA       LEU  61  95.965  -4.271  -4.247
  473    HB2  LEU  61           HB2      LEU  61  98.663  -4.775  -5.262
  474    HB3  LEU  61           HB1      LEU  61  98.027  -3.373  -4.410
  475    HG   LEU  61           HG       LEU  61  98.717  -5.970  -3.011
  476   HD11  LEU  61          HD11      LEU  61 100.653  -4.688  -4.219
  477   HD12  LEU  61          HD12      LEU  61 100.863  -5.165  -2.537
  478   HD13  LEU  61          HD13      LEU  61 100.436  -3.501  -2.933
  479   HD21  LEU  61          HD21      LEU  61  97.111  -4.227  -1.997
  480   HD22  LEU  61          HD22      LEU  61  98.519  -3.170  -1.884
  481   HD23  LEU  61          HD23      LEU  61  98.494  -4.701  -1.009
  482    H    TYR  62           HN       TYR  62  95.791  -3.746  -6.433
  483    HA   TYR  62           HA       TYR  62  96.113  -5.971  -8.339
  484    HB2  TYR  62           HB2      TYR  62  93.695  -4.151  -8.278
  485    HB3  TYR  62           HB1      TYR  62  93.941  -5.571  -9.294
  486    HD1  TYR  62           HD1      TYR  62  93.319  -4.399  -5.834
  487    HD2  TYR  62           HD2      TYR  62  93.612  -7.800  -8.440
  488    HE1  TYR  62           HE1      TYR  62  92.298  -5.835  -4.077
  489    HE2  TYR  62           HE2      TYR  62  92.595  -9.231  -6.688
  490    HH   TYR  62           HH       TYR  62  91.088  -8.906  -4.698
  491    H    LEU  63           HN       LEU  63  97.608  -5.252  -9.699
  492    HA   LEU  63           HA       LEU  63  97.562  -2.420 -10.550
  493    HB2  LEU  63           HB2      LEU  63  99.667  -3.717  -9.562
  494    HB3  LEU  63           HB1      LEU  63  99.832  -4.252 -11.231
  495    HG   LEU  63           HG       LEU  63  99.634  -1.367 -10.317
  496   HD11  LEU  63          HD11      LEU  63 101.790  -2.631  -9.833
  497   HD12  LEU  63          HD12      LEU  63 101.962  -1.195 -10.843
  498   HD13  LEU  63          HD13      LEU  63 101.981  -2.798 -11.579
  499   HD21  LEU  63          HD21      LEU  63  99.896  -2.667 -13.038
  500   HD22  LEU  63          HD22      LEU  63 100.313  -0.977 -12.752
  501   HD23  LEU  63          HD23      LEU  63  98.659  -1.533 -12.496
  502    H    GLY  64           HN       GLY  64  98.907  -5.232 -12.226
  503    HA2  GLY  64           HA2      GLY  64  97.665  -4.432 -14.711
  504    HA3  GLY  64           HA1      GLY  64  98.696  -5.841 -14.460
  505    H    LEU  65           HN       LEU  65  96.656  -6.482 -15.990
  506    HA   LEU  65           HA       LEU  65  94.276  -7.090 -14.524
  507    HB2  LEU  65           HB2      LEU  65  95.202  -8.178 -17.203
  508    HB3  LEU  65           HB1      LEU  65  93.575  -8.322 -16.544
  509    HG   LEU  65           HG       LEU  65  93.590  -6.483 -18.115
  510   HD11  LEU  65          HD11      LEU  65  93.738  -5.061 -15.473
  511   HD12  LEU  65          HD12      LEU  65  92.490  -6.278 -15.740
  512   HD13  LEU  65          HD13      LEU  65  92.577  -4.863 -16.785
  513   HD21  LEU  65          HD21      LEU  65  96.195  -6.159 -17.627
  514   HD22  LEU  65          HD22      LEU  65  95.590  -4.921 -16.524
  515   HD23  LEU  65          HD23      LEU  65  95.206  -4.837 -18.242
  516    H    ASP  66           HN       ASP  66  97.263  -8.811 -15.293
  517    HA   ASP  66           HA       ASP  66  96.287 -11.318 -14.083
  518    HB2  ASP  66           HB2      ASP  66  98.454 -12.145 -15.006
  519    HB3  ASP  66           HB1      ASP  66  97.302 -11.585 -16.218
  520    H    VAL  67           HN       VAL  67  97.493  -8.531 -12.913
  521    HA   VAL  67           HA       VAL  67  99.559  -9.811 -11.230
  522    HB   VAL  67           HB       VAL  67  99.077  -6.970 -12.075
  523   HG11  VAL  67          HG11      VAL  67  99.401  -6.531  -9.799
  524   HG12  VAL  67          HG12      VAL  67 101.061  -6.542 -10.392
  525   HG13  VAL  67          HG13      VAL  67 100.411  -7.957  -9.567
  526   HG21  VAL  67          HG21      VAL  67 100.607  -8.666 -13.269
  527   HG22  VAL  67          HG22      VAL  67 101.654  -8.540 -11.854
  528   HG23  VAL  67          HG23      VAL  67 101.328  -7.115 -12.840
  529    H    LEU  68           HN       LEU  68  98.414 -10.784  -9.653
  530    HA   LEU  68           HA       LEU  68  96.746  -9.059  -7.923
  531    HB2  LEU  68           HB2      LEU  68  95.237 -10.702  -8.491
  532    HB3  LEU  68           HB1      LEU  68  96.492 -11.888  -8.826
  533    HG   LEU  68           HG       LEU  68  96.860 -12.176  -6.389
  534   HD11  LEU  68          HD11      LEU  68  95.568 -11.063  -4.756
  535   HD12  LEU  68          HD12      LEU  68  94.371 -10.532  -5.934
  536   HD13  LEU  68          HD13      LEU  68  95.963  -9.781  -5.897
  537   HD21  LEU  68          HD21      LEU  68  93.964 -12.454  -7.244
  538   HD22  LEU  68          HD22      LEU  68  94.734 -13.330  -5.921
  539   HD23  LEU  68          HD23      LEU  68  95.247 -13.614  -7.584
  540    H    ILE  69           HN       ILE  69  97.761  -8.499  -6.105
  541    HA   ILE  69           HA       ILE  69  99.867 -10.298  -5.051
  542    HB   ILE  69           HB       ILE  69  99.567  -7.295  -4.928
  543   HG12  ILE  69          HG12      ILE  69 102.145  -8.288  -5.759
  544   HG13  ILE  69          HG11      ILE  69 100.901  -9.099  -6.707
  545   HG21  ILE  69          HG21      ILE  69 101.078  -9.195  -3.214
  546   HG22  ILE  69          HG22      ILE  69 100.488  -7.578  -2.846
  547   HG23  ILE  69          HG23      ILE  69 101.974  -7.784  -3.774
  548   HD11  ILE  69          HD11      ILE  69 101.554  -7.040  -7.833
  549   HD12  ILE  69          HD12      ILE  69 101.237  -6.106  -6.371
  550   HD13  ILE  69          HD13      ILE  69  99.903  -6.875  -7.232
  551    H    ARG  70           HN       ARG  70  99.953 -10.764  -2.884
  552    HA   ARG  70           HA       ARG  70  97.703  -9.832  -1.205
  553    HB2  ARG  70           HB2      ARG  70  97.854 -12.206  -0.170
  554    HB3  ARG  70           HB1      ARG  70  97.014 -12.017  -1.708
  555    HG2  ARG  70           HG2      ARG  70  98.941 -12.786  -2.940
  556    HG3  ARG  70           HG1      ARG  70  99.938 -12.770  -1.486
  557    HD2  ARG  70           HD2      ARG  70  97.443 -14.457  -1.663
  558    HD3  ARG  70           HD1      ARG  70  98.994 -15.048  -2.252
  559    HE   ARG  70           HE       ARG  70  99.649 -14.270   0.231
  560   HH11  ARG  70          HH21      ARG  70  96.950 -16.053  -1.007
  561   HH12  ARG  70          HH22      ARG  70  96.723 -16.980   0.438
  562   HH21  ARG  70          HH11      ARG  70  99.355 -15.486   2.132
  563   HH22  ARG  70          HH12      ARG  70  98.084 -16.660   2.214
  564    H    MET  71           HN       MET  71  98.243  -9.096   0.720
  565    HA   MET  71           HA       MET  71 100.803  -9.890   1.932
  566    HB2  MET  71           HB2      MET  71 100.144  -7.028   2.262
  567    HB3  MET  71           HB1      MET  71 101.702  -7.795   1.981
  568    HG2  MET  71           HG2      MET  71 101.397  -7.816  -0.360
  569    HG3  MET  71           HG1      MET  71  99.656  -7.593  -0.227
  570    HE1  MET  71           HE1      MET  71 102.737  -4.382   0.989
  571    HE2  MET  71           HE2      MET  71 102.989  -6.125   0.940
  572    HE3  MET  71           HE3      MET  71 101.966  -5.429   2.191
  573    H    GLU  72           HN       GLU  72 100.823  -9.763   4.183
  574    HA   GLU  72           HA       GLU  72  98.191  -9.259   5.421
  575    HB2  GLU  72           HB2      GLU  72  98.896 -11.628   5.618
  576    HB3  GLU  72           HB1      GLU  72 100.397 -11.113   6.386
  577    HG2  GLU  72           HG2      GLU  72  97.782 -10.197   7.545
  578    HG3  GLU  72           HG1      GLU  72  98.328 -11.842   7.865
  579    H    ILE  73           HN       ILE  73  98.162  -7.432   6.574
  580    HA   ILE  73           HA       ILE  73 100.715  -6.512   7.767
  581    HB   ILE  73           HB       ILE  73 100.230  -4.300   7.071
  582   HG12  ILE  73          HG12      ILE  73  97.513  -5.461   6.405
  583   HG13  ILE  73          HG11      ILE  73  97.880  -4.097   7.454
  584   HG21  ILE  73          HG21      ILE  73  99.314  -5.729   4.614
  585   HG22  ILE  73          HG22      ILE  73 100.823  -6.286   5.328
  586   HG23  ILE  73          HG23      ILE  73 100.656  -4.605   4.826
  587   HD11  ILE  73          HD11      ILE  73  97.655  -4.206   4.499
  588   HD12  ILE  73          HD12      ILE  73  98.939  -3.184   5.130
  589   HD13  ILE  73          HD13      ILE  73  97.267  -2.892   5.604
  590    H    SER  74           HN       SER  74 100.432  -4.808   9.402
  591    HA   SER  74           HA       SER  74  97.991  -5.164  11.052
  592    HB2  SER  74           HB2      SER  74 100.878  -4.905  11.911
  593    HB3  SER  74           HB1      SER  74  99.519  -4.722  13.015
  594    HG   SER  74           HG       SER  74  99.678  -6.971  11.338
  595    H    LEU  75           HN       LEU  75  97.265  -3.324  12.189
  596    HA   LEU  75           HA       LEU  75  97.609  -0.856  10.792
  597    HB2  LEU  75           HB2      LEU  75  95.535  -1.589  12.093
  598    HB3  LEU  75           HB1      LEU  75  96.420  -1.151  13.554
  599    HG   LEU  75           HG       LEU  75  96.813   1.128  12.426
  600   HD11  LEU  75          HD11      LEU  75  96.210   0.641  10.155
  601   HD12  LEU  75          HD12      LEU  75  94.955   1.702  10.791
  602   HD13  LEU  75          HD13      LEU  75  94.654  -0.028  10.651
  603   HD21  LEU  75          HD21      LEU  75  94.788   1.999  13.321
  604   HD22  LEU  75          HD22      LEU  75  95.123   0.554  14.273
  605   HD23  LEU  75          HD23      LEU  75  93.912   0.506  12.990
  606    H    ALA  76           HN       ALA  76  99.074   0.628  10.962
  607    HA   ALA  76           HA       ALA  76 100.937   0.535  13.228
  608    HB1  ALA  76           HB1      ALA  76 102.447   1.873  11.802
  609    HB2  ALA  76           HB2      ALA  76 101.230   1.850  10.522
  610    HB3  ALA  76           HB3      ALA  76 101.994   0.350  11.042
  611    H    TRP  77           HN       TRP  77  98.981   2.780  11.349
  612    HA   TRP  77           HA       TRP  77  98.380   4.428  13.647
  613    HB2  TRP  77           HB2      TRP  77  99.511   6.479  12.855
  614    HB3  TRP  77           HB1      TRP  77 100.702   5.200  13.126
  615    HD1  TRP  77           HD1      TRP  77 101.964   4.233  11.061
  616    HE1  TRP  77           HE1      TRP  77 101.864   4.662   8.533
  617    HE3  TRP  77           HE3      TRP  77  98.075   7.542  10.857
  618    HZ2  TRP  77           HZ2      TRP  77 100.548   6.385   6.712
  619    HZ3  TRP  77           HZ3      TRP  77  97.438   8.589   8.701
  620    HH2  TRP  77           HH2      TRP  77  98.657   8.004   6.618
  621    H    ALA  78           HN       ALA  78  97.073   6.390  12.963
  622    HA   ALA  78           HA       ALA  78  95.892   6.218  10.266
  623    HB1  ALA  78           HB1      ALA  78  93.626   6.181  11.160
  624    HB2  ALA  78           HB2      ALA  78  94.253   6.107  12.806
  625    HB3  ALA  78           HB3      ALA  78  94.516   4.758  11.701
  626    H    ARG  79           HN       ARG  79  95.814   8.318   9.501
  627    HA   ARG  79           HA       ARG  79  94.943  10.422  11.305
  628    HB2  ARG  79           HB2      ARG  79  97.493  10.158  11.519
  629    HB3  ARG  79           HB1      ARG  79  97.579  10.806   9.883
  630    HG2  ARG  79           HG2      ARG  79  96.537  12.869  10.562
  631    HG3  ARG  79           HG1      ARG  79  96.148  12.214  12.154
  632    HD2  ARG  79           HD2      ARG  79  98.597  11.950  12.585
  633    HD3  ARG  79           HD1      ARG  79  98.915  12.747  11.046
  634    HE   ARG  79           HE       ARG  79  97.254  14.198  12.980
  635   HH11  ARG  79          HH21      ARG  79 100.331  13.682  11.468
  636   HH12  ARG  79          HH22      ARG  79 100.962  15.232  11.915
  637   HH21  ARG  79          HH11      ARG  79  98.080  16.229  13.567
  638   HH22  ARG  79          HH12      ARG  79  99.689  16.673  13.104
  639    H    ASP  80           HN       ASP  80  93.790  11.967  10.343
  640    HA   ASP  80           HA       ASP  80  92.710  13.153   8.722
  641    HB2  ASP  80           HB2      ASP  80  95.419  12.820   7.450
  642    HB3  ASP  80           HB1      ASP  80  94.154  13.845   6.776
  643    H    GLY  81           HN       GLY  81  91.879  10.497   8.576
  644    HA2  GLY  81           HA2      GLY  81  90.516   9.372   7.092
  645    HA3  GLY  81           HA1      GLY  81  91.083  10.429   5.810
  646    H    LEU  82           HN       LEU  82  93.969   9.716   6.456
  647    HA   LEU  82           HA       LEU  82  93.985   7.305   4.825
  648    HB2  LEU  82           HB2      LEU  82  96.456   8.697   5.808
  649    HB3  LEU  82           HB1      LEU  82  96.182   7.847   4.287
  650    HG   LEU  82           HG       LEU  82  95.005  10.523   5.086
  651   HD11  LEU  82          HD11      LEU  82  96.372  11.398   3.277
  652   HD12  LEU  82          HD12      LEU  82  96.903   9.772   2.844
  653   HD13  LEU  82          HD13      LEU  82  97.411  10.487   4.374
  654   HD21  LEU  82          HD21      LEU  82  94.542   8.707   2.708
  655   HD22  LEU  82          HD22      LEU  82  94.194  10.435   2.652
  656   HD23  LEU  82          HD23      LEU  82  93.337   9.400   3.793
  657    H    LEU  83           HN       LEU  83  95.186   5.451   5.360
  658    HA   LEU  83           HA       LEU  83  95.602   4.997   8.283
  659    HB2  LEU  83           HB2      LEU  83  94.565   3.076   6.213
  660    HB3  LEU  83           HB1      LEU  83  94.780   2.759   7.934
  661    HG   LEU  83           HG       LEU  83  92.937   4.857   6.754
  662   HD11  LEU  83          HD11      LEU  83  91.175   3.274   7.728
  663   HD12  LEU  83          HD12      LEU  83  92.465   2.081   7.865
  664   HD13  LEU  83          HD13      LEU  83  92.007   2.705   6.281
  665   HD21  LEU  83          HD21      LEU  83  93.684   4.041   9.556
  666   HD22  LEU  83          HD22      LEU  83  92.066   4.663   9.234
  667   HD23  LEU  83          HD23      LEU  83  93.477   5.660   8.889
  668    H    GLY  84           HN       GLY  84  97.594   4.104   8.788
  669    HA2  GLY  84           HA2      GLY  84  99.279   3.217   6.536
  670    HA3  GLY  84           HA1      GLY  84  99.861   3.779   8.096
  671    H    PHE  85           HN       PHE  85 100.378   1.258   6.678
  672    HA   PHE  85           HA       PHE  85  99.670  -0.540   8.897
  673    HB2  PHE  85           HB2      PHE  85  99.160  -1.047   5.963
  674    HB3  PHE  85           HB1      PHE  85  99.242  -2.333   7.163
  675    HD1  PHE  85           HD2      PHE  85  97.595  -2.465   8.990
  676    HD2  PHE  85           HD1      PHE  85  97.278   0.470   5.879
  677    HE1  PHE  85           HE2      PHE  85  95.249  -2.035   9.646
  678    HE2  PHE  85           HE1      PHE  85  94.923   0.894   6.533
  679    HZ   PHE  85           HZ       PHE  85  93.919  -0.342   8.422
  680    H    GLU  86           HN       GLU  86 101.232  -2.065   9.359
  681    HA   GLU  86           HA       GLU  86 103.736  -1.801   7.824
  682    HB2  GLU  86           HB2      GLU  86 104.146  -1.329  10.115
  683    HB3  GLU  86           HB1      GLU  86 103.127  -2.665  10.657
  684    HG2  GLU  86           HG2      GLU  86 104.713  -4.290  10.036
  685    HG3  GLU  86           HG1      GLU  86 105.563  -3.184   8.958
  686    H    CYS  87           HN       CYS  87 104.406  -3.470   6.610
  687    HA   CYS  87           HA       CYS  87 102.760  -5.745   6.227
  688    HB2  CYS  87           HB2      CYS  87 104.029  -4.952   4.374
  689    HB3  CYS  87           HB1      CYS  87 105.536  -5.062   5.281
  690    HG   CYS  87           HG       CYS  87 105.641  -7.525   4.861
  691    H    GLN  88           HN       GLN  88 102.619  -7.516   7.386
  692    HA   GLN  88           HA       GLN  88 104.764  -8.227   9.258
  693    HB2  GLN  88           HB2      GLN  88 102.156  -8.115   9.732
  694    HB3  GLN  88           HB1      GLN  88 102.191  -9.745   9.063
  695    HG2  GLN  88           HG2      GLN  88 102.533 -10.088  11.370
  696    HG3  GLN  88           HG1      GLN  88 104.161 -10.157  10.695
  697   HE21  GLN  88          HE21      GLN  88 103.388  -6.974  10.395
  698   HE22  GLN  88          HE22      GLN  88 103.960  -6.390  11.883
  699    H    HIS  89           HN       HIS  89 102.996  -9.478   6.468
  700    HA   HIS  89           HA       HIS  89 105.169 -11.244   5.790
  701    HB2  HIS  89           HB2      HIS  89 104.415 -13.044   6.931
  702    HB3  HIS  89           HB1      HIS  89 102.881 -12.258   7.299
  703    HD2  HIS  89           HD2      HIS  89 100.923 -13.881   6.236
  704    HE1  HIS  89           HE1      HIS  89 102.832 -14.841   2.593
  705    HE2  HIS  89           HE2      HIS  89 100.713 -15.143   3.960
  706    H    ILE  90           HN       ILE  90 105.140 -11.783   3.654
  707    HA   ILE  90           HA       ILE  90 102.742 -11.320   2.004
  708    HB   ILE  90           HB       ILE  90 103.784  -9.143   1.954
  709   HG12  ILE  90          HG12      ILE  90 104.712 -10.678  -0.495
  710   HG13  ILE  90          HG11      ILE  90 103.048 -10.166  -0.224
  711   HG21  ILE  90          HG21      ILE  90 106.310 -10.761   1.659
  712   HG22  ILE  90          HG22      ILE  90 105.950  -9.473   2.808
  713   HG23  ILE  90          HG23      ILE  90 106.249  -9.086   1.115
  714   HD11  ILE  90          HD11      ILE  90 105.326  -8.191  -0.114
  715   HD12  ILE  90          HD12      ILE  90 103.610  -7.878  -0.351
  716   HD13  ILE  90          HD13      ILE  90 104.555  -8.615  -1.641
  717    H    ASP  91           HN       ASP  91 102.594 -12.522   0.264
  718    HA   ASP  91           HA       ASP  91 103.948 -14.948   0.164
  719    HB2  ASP  91           HB2      ASP  91 101.739 -14.176  -0.987
  720    HB3  ASP  91           HB1      ASP  91 102.792 -13.760  -2.335
  721    H    LEU  92           HN       LEU  92 105.564 -15.793  -0.990
  722    HA   LEU  92           HA       LEU  92 107.829 -14.263  -1.546
  723    HB2  LEU  92           HB2      LEU  92 108.081 -16.621  -1.204
  724    HB3  LEU  92           HB1      LEU  92 107.017 -16.996  -2.558
  725    HG   LEU  92           HG       LEU  92 109.353 -15.296  -3.237
  726   HD11  LEU  92          HD11      LEU  92 110.537 -16.725  -1.731
  727   HD12  LEU  92          HD12      LEU  92 110.816 -17.385  -3.343
  728   HD13  LEU  92          HD13      LEU  92 109.643 -18.148  -2.268
  729   HD21  LEU  92          HD21      LEU  92 107.583 -16.412  -4.781
  730   HD22  LEU  92          HD22      LEU  92 108.483 -17.900  -4.497
  731   HD23  LEU  92          HD23      LEU  92 109.276 -16.521  -5.258
  732    H    ASP  93           HN       ASP  93 105.293 -15.399  -3.748
  733    HA   ASP  93           HA       ASP  93 106.456 -14.326  -6.116
  734    HB2  ASP  93           HB2      ASP  93 104.779 -16.067  -6.287
  735    HB3  ASP  93           HB1      ASP  93 103.597 -15.064  -5.445
  736    H    SER  94           HN       SER  94 104.166 -13.131  -3.716
  737    HA   SER  94           HA       SER  94 103.460 -10.726  -5.041
  738    HB2  SER  94           HB2      SER  94 103.389 -11.637  -2.174
  739    HB3  SER  94           HB1      SER  94 102.983  -9.983  -2.599
  740    HG   SER  94           HG       SER  94 101.438 -10.869  -4.078
  741    H    ILE  95           HN       ILE  95 106.073 -11.658  -2.888
  742    HA   ILE  95           HA       ILE  95 107.118  -9.118  -2.308
  743    HB   ILE  95           HB       ILE  95 108.326 -11.875  -2.465
  744   HG12  ILE  95          HG12      ILE  95 107.979  -9.904  -0.190
  745   HG13  ILE  95          HG11      ILE  95 106.850 -11.204  -0.560
  746   HG21  ILE  95          HG21      ILE  95 110.156 -10.465  -3.137
  747   HG22  ILE  95          HG22      ILE  95 110.388 -10.819  -1.427
  748   HG23  ILE  95          HG23      ILE  95 109.742  -9.254  -1.924
  749   HD11  ILE  95          HD11      ILE  95 109.582 -11.347   0.624
  750   HD12  ILE  95          HD12      ILE  95 109.100 -12.662  -0.445
  751   HD13  ILE  95          HD13      ILE  95 108.148 -12.302   0.993
  752    H    SER  96           HN       SER  96 107.578 -11.272  -5.065
  753    HA   SER  96           HA       SER  96 109.630  -9.660  -6.202
  754    HB2  SER  96           HB2      SER  96 108.623 -12.209  -6.730
  755    HB3  SER  96           HB1      SER  96 108.135 -11.277  -8.146
  756    HG   SER  96           HG       SER  96 110.452 -10.503  -8.020
  757    H    HIS  97           HN       HIS  97 106.131  -9.852  -6.761
  758    HA   HIS  97           HA       HIS  97 106.139  -8.069  -8.947
  759    HB2  HIS  97           HB2      HIS  97 104.048  -8.845  -6.921
  760    HB3  HIS  97           HB1      HIS  97 103.736  -7.582  -8.095
  761    HD2  HIS  97           HD2      HIS  97 103.861 -11.432  -7.929
  762    HE1  HIS  97           HE1      HIS  97 103.293 -10.362 -11.972
  763    HE2  HIS  97           HE2      HIS  97 103.310 -12.302 -10.331
  764    H    LEU  98           HN       LEU  98 106.054  -7.544  -5.463
  765    HA   LEU  98           HA       LEU  98 105.709  -4.693  -5.645
  766    HB2  LEU  98           HB2      LEU  98 105.675  -6.544  -3.568
  767    HB3  LEU  98           HB1      LEU  98 107.195  -5.694  -3.306
  768    HG   LEU  98           HG       LEU  98 105.303  -3.671  -3.912
  769   HD11  LEU  98          HD11      LEU  98 103.532  -5.358  -3.460
  770   HD12  LEU  98          HD12      LEU  98 103.528  -4.052  -2.275
  771   HD13  LEU  98          HD13      LEU  98 104.219  -5.620  -1.858
  772   HD21  LEU  98          HD21      LEU  98 106.361  -4.602  -1.229
  773   HD22  LEU  98          HD22      LEU  98 105.721  -2.999  -1.593
  774   HD23  LEU  98          HD23      LEU  98 107.218  -3.544  -2.350
  775    H    ARG  99           HN       ARG  99 108.480  -6.850  -5.730
  776    HA   ARG  99           HA       ARG  99 110.440  -4.787  -5.500
  777    HB2  ARG  99           HB2      ARG  99 110.469  -7.588  -6.615
  778    HB3  ARG  99           HB1      ARG  99 111.866  -6.530  -6.806
  779    HG2  ARG  99           HG2      ARG  99 112.144  -6.305  -4.444
  780    HG3  ARG  99           HG1      ARG  99 110.567  -7.024  -4.119
  781    HD2  ARG  99           HD2      ARG  99 111.300  -9.186  -4.683
  782    HD3  ARG  99           HD1      ARG  99 112.693  -8.583  -5.578
  783    HE   ARG  99           HE       ARG  99 112.505  -8.958  -2.696
  784   HH11  ARG  99          HH21      ARG  99 114.130  -7.490  -5.375
  785   HH12  ARG  99          HH22      ARG  99 115.620  -7.258  -4.520
  786   HH21  ARG  99          HH11      ARG  99 114.451  -8.654  -1.569
  787   HH22  ARG  99          HH12      ARG  99 115.802  -7.917  -2.365
  788    H    ARG 100           HN       ARG 100 108.628  -6.228  -8.129
  789    HA   ARG 100           HA       ARG 100 109.855  -4.986 -10.375
  790    HB2  ARG 100           HB2      ARG 100 107.097  -6.064  -9.847
  791    HB3  ARG 100           HB1      ARG 100 107.548  -5.344 -11.387
  792    HG2  ARG 100           HG2      ARG 100 109.652  -7.104 -10.859
  793    HG3  ARG 100           HG1      ARG 100 108.233  -7.980 -10.294
  794    HD2  ARG 100           HD2      ARG 100 108.761  -8.374 -12.714
  795    HD3  ARG 100           HD1      ARG 100 107.144  -7.736 -12.437
  796    HE   ARG 100           HE       ARG 100 108.549  -5.481 -12.878
  797   HH11  ARG 100          HH21      ARG 100 108.458  -8.539 -14.497
  798   HH12  ARG 100          HH22      ARG 100 108.802  -7.876 -16.060
  799   HH21  ARG 100          HH11      ARG 100 109.000  -4.607 -14.924
  800   HH22  ARG 100          HH12      ARG 100 109.108  -5.651 -16.302
  801    H    LEU 101           HN       LEU 101 107.081  -4.010  -8.351
  802    HA   LEU 101           HA       LEU 101 106.441  -1.695  -9.798
  803    HB2  LEU 101           HB2      LEU 101 105.658  -2.901  -7.296
  804    HB3  LEU 101           HB1      LEU 101 105.918  -1.178  -7.036
  805    HG   LEU 101           HG       LEU 101 104.257  -2.220  -9.340
  806   HD11  LEU 101          HD11      LEU 101 103.088  -3.052  -7.455
  807   HD12  LEU 101          HD12      LEU 101 102.314  -1.506  -7.801
  808   HD13  LEU 101          HD13      LEU 101 103.479  -1.634  -6.482
  809   HD21  LEU 101          HD21      LEU 101 104.200   0.437  -7.883
  810   HD22  LEU 101          HD22      LEU 101 103.422   0.038  -9.414
  811   HD23  LEU 101          HD23      LEU 101 105.180   0.151  -9.322
  812    H    VAL 102           HN       VAL 102 108.754  -2.285  -7.226
  813    HA   VAL 102           HA       VAL 102 109.499   0.424  -6.789
  814    HB   VAL 102           HB       VAL 102 110.928  -2.186  -6.258
  815   HG11  VAL 102          HG11      VAL 102 112.240  -0.706  -4.623
  816   HG12  VAL 102          HG12      VAL 102 111.619   0.668  -5.538
  817   HG13  VAL 102          HG13      VAL 102 112.639  -0.531  -6.332
  818   HG21  VAL 102          HG21      VAL 102 109.911  -2.177  -4.187
  819   HG22  VAL 102          HG22      VAL 102 108.665  -1.313  -5.086
  820   HG23  VAL 102          HG23      VAL 102 109.832  -0.418  -4.114
  821    H    GLU 103           HN       GLU 103 110.968  -2.189  -8.716
  822    HA   GLU 103           HA       GLU 103 113.148  -0.654  -9.660
  823    HB2  GLU 103           HB2      GLU 103 112.690  -3.246  -9.688
  824    HB3  GLU 103           HB1      GLU 103 112.020  -2.902 -11.282
  825    HG2  GLU 103           HG2      GLU 103 114.307  -3.377 -11.692
  826    HG3  GLU 103           HG1      GLU 103 114.207  -1.616 -11.729
  827    H    LEU 104           HN       LEU 104 109.943  -1.304 -11.055
  828    HA   LEU 104           HA       LEU 104 110.483   0.092 -13.501
  829    HB2  LEU 104           HB2      LEU 104 108.021  -1.016 -12.191
  830    HB3  LEU 104           HB1      LEU 104 107.878   0.020 -13.607
  831    HG   LEU 104           HG       LEU 104 108.002  -2.526 -14.011
  832   HD11  LEU 104          HD11      LEU 104 110.172  -1.021 -15.465
  833   HD12  LEU 104          HD12      LEU 104 108.477  -0.579 -15.672
  834   HD13  LEU 104          HD13      LEU 104 109.024  -2.200 -16.100
  835   HD21  LEU 104          HD21      LEU 104 110.972  -2.071 -13.662
  836   HD22  LEU 104          HD22      LEU 104 110.127  -3.594 -13.926
  837   HD23  LEU 104          HD23      LEU 104 109.975  -2.761 -12.385
  838    H    ASN 105           HN       ASN 105 108.883   0.964 -10.447
  839    HA   ASN 105           HA       ASN 105 108.005   3.524 -11.339
  840    HB2  ASN 105           HB2      ASN 105 108.469   2.389  -8.576
  841    HB3  ASN 105           HB1      ASN 105 107.798   3.992  -8.868
  842   HD21  ASN 105          HD21      ASN 105 106.870   1.873 -11.363
  843   HD22  ASN 105          HD22      ASN 105 105.330   1.472 -10.773
  844    H    LEU 106           HN       LEU 106 110.809   2.460  -9.426
  845    HA   LEU 106           HA       LEU 106 111.954   4.957  -8.947
  846    HB2  LEU 106           HB2      LEU 106 112.659   2.699  -8.006
  847    HB3  LEU 106           HB1      LEU 106 113.522   2.441  -9.521
  848    HG   LEU 106           HG       LEU 106 114.544   4.820  -9.008
  849   HD11  LEU 106          HD11      LEU 106 114.849   5.085  -6.516
  850   HD12  LEU 106          HD12      LEU 106 113.616   3.847  -6.289
  851   HD13  LEU 106          HD13      LEU 106 113.200   5.372  -7.071
  852   HD21  LEU 106          HD21      LEU 106 115.923   2.847  -9.138
  853   HD22  LEU 106          HD22      LEU 106 115.293   2.237  -7.608
  854   HD23  LEU 106          HD23      LEU 106 116.332   3.662  -7.629
  855    H    GLY 107           HN       GLY 107 111.954   2.963 -11.823
  856    HA2  GLY 107           HA2      GLY 107 112.175   4.338 -13.918
  857    HA3  GLY 107           HA1      GLY 107 113.653   4.965 -13.198
  858    H    ASP 108           HN       ASP 108 112.855   3.150 -15.610
  859    HA   ASP 108           HA       ASP 108 114.200   0.666 -15.147
  860    HB2  ASP 108           HB2      ASP 108 113.143   2.106 -17.560
  861    HB3  ASP 108           HB1      ASP 108 114.190   0.705 -17.772
  862    H    GLU 109           HN       GLU 109 115.272   3.838 -15.657
  863    HA   GLU 109           HA       GLU 109 117.818   3.034 -16.870
  864    HB2  GLU 109           HB2      GLU 109 116.929   5.801 -16.037
  865    HB3  GLU 109           HB1      GLU 109 118.254   5.380 -17.123
  866    HG2  GLU 109           HG2      GLU 109 116.487   5.979 -18.577
  867    HG3  GLU 109           HG1      GLU 109 116.459   4.216 -18.567
  868    H    GLU 110           HN       GLU 110 116.698   2.720 -13.911
  869    HA   GLU 110           HA       GLU 110 119.310   3.290 -12.680
  870    HB2  GLU 110           HB2      GLU 110 116.646   4.097 -11.486
  871    HB3  GLU 110           HB1      GLU 110 118.204   4.199 -10.666
  872    HG2  GLU 110           HG2      GLU 110 117.487   5.636 -13.239
  873    HG3  GLU 110           HG1      GLU 110 117.542   6.378 -11.641
  874    H    LEU 111           HN       LEU 111 119.184   0.873 -13.232
  875    HA   LEU 111           HA       LEU 111 117.573  -0.728 -11.415
  876    HB2  LEU 111           HB2      LEU 111 119.794  -1.709 -13.213
  877    HB3  LEU 111           HB1      LEU 111 118.435  -2.624 -12.567
  878    HG   LEU 111           HG       LEU 111 117.868  -2.170 -14.834
  879   HD11  LEU 111          HD11      LEU 111 116.136  -1.635 -13.024
  880   HD12  LEU 111          HD12      LEU 111 115.842  -0.943 -14.618
  881   HD13  LEU 111          HD13      LEU 111 116.499   0.063 -13.327
  882   HD21  LEU 111          HD21      LEU 111 119.609  -0.077 -14.706
  883   HD22  LEU 111          HD22      LEU 111 118.075   0.792 -14.655
  884   HD23  LEU 111          HD23      LEU 111 118.433  -0.284 -16.002
  885    H    LEU 112           HN       LEU 112 120.560   0.857 -11.345
  886    HA   LEU 112           HA       LEU 112 122.243  -0.830  -9.924
  887    HB2  LEU 112           HB2      LEU 112 121.921   2.139  -9.438
  888    HB3  LEU 112           HB1      LEU 112 123.352   1.161  -9.118
  889    HG   LEU 112           HG       LEU 112 122.376   0.955 -11.897
  890   HD11  LEU 112          HD11      LEU 112 123.417   3.592 -10.823
  891   HD12  LEU 112          HD12      LEU 112 121.836   3.306 -11.549
  892   HD13  LEU 112          HD13      LEU 112 123.294   3.186 -12.535
  893   HD21  LEU 112          HD21      LEU 112 124.718   1.043 -12.387
  894   HD22  LEU 112          HD22      LEU 112 124.570   0.106 -10.900
  895   HD23  LEU 112          HD23      LEU 112 125.084   1.792 -10.833
  896    H    GLU 113           HN       GLU 113 121.318  -2.095  -8.360
  897    HA   GLU 113           HA       GLU 113 119.491  -1.129  -6.398
  898    HB2  GLU 113           HB2      GLU 113 119.694  -3.287  -5.387
  899    HB3  GLU 113           HB1      GLU 113 119.765  -3.536  -7.130
  900    HG2  GLU 113           HG2      GLU 113 122.074  -3.525  -5.173
  901    HG3  GLU 113           HG1      GLU 113 121.522  -4.862  -6.178
  902    H    ARG 114           HN       ARG 114 120.042  -1.420  -3.987
  903    HA   ARG 114           HA       ARG 114 121.388  -0.996  -2.142
  904    HB2  ARG 114           HB2      ARG 114 123.280  -1.835  -3.806
  905    HB3  ARG 114           HB1      ARG 114 123.697  -0.128  -3.836
  906    HG2  ARG 114           HG2      ARG 114 124.910  -0.595  -1.966
  907    HG3  ARG 114           HG1      ARG 114 123.357  -0.546  -1.136
  908    HD2  ARG 114           HD2      ARG 114 123.108  -2.934  -1.295
  909    HD3  ARG 114           HD1      ARG 114 124.493  -3.061  -2.376
  910    HE   ARG 114           HE       ARG 114 124.956  -1.977   0.314
  911   HH11  ARG 114          HH21      ARG 114 125.185  -4.584  -1.958
  912   HH12  ARG 114          HH22      ARG 114 126.412  -5.426  -1.073
  913   HH21  ARG 114          HH11      ARG 114 126.565  -3.082   1.475
  914   HH22  ARG 114          HH12      ARG 114 127.192  -4.578   0.866
  915    H    GLU 115           HN       GLU 115 122.965   1.050  -1.499
  916    HA   GLU 115           HA       GLU 115 121.309   3.282  -1.455
  917    HB2  GLU 115           HB2      GLU 115 123.440   4.535  -0.849
  918    HB3  GLU 115           HB1      GLU 115 123.046   3.143   0.160
  919    HG2  GLU 115           HG2      GLU 115 124.602   1.741  -1.097
  920    HG3  GLU 115           HG1      GLU 115 124.945   3.072  -2.203
  921    H    LEU 116           HN       LEU 116 122.965   2.056  -4.087
  922    HA   LEU 116           HA       LEU 116 123.862   4.384  -5.429
  923    HB2  LEU 116           HB2      LEU 116 123.175   1.587  -6.191
  924    HB3  LEU 116           HB1      LEU 116 123.319   2.783  -7.478
  925    HG   LEU 116           HG       LEU 116 125.571   3.339  -6.809
  926   HD11  LEU 116          HD11      LEU 116 125.671   3.291  -4.485
  927   HD12  LEU 116          HD12      LEU 116 126.531   1.804  -4.879
  928   HD13  LEU 116          HD13      LEU 116 124.845   1.739  -4.376
  929   HD21  LEU 116          HD21      LEU 116 124.959   0.386  -6.990
  930   HD22  LEU 116          HD22      LEU 116 126.619   0.969  -6.882
  931   HD23  LEU 116          HD23      LEU 116 125.602   1.454  -8.236
  932    H    ALA 117           HN       ALA 117 120.844   2.502  -5.686
  933    HA   ALA 117           HA       ALA 117 119.508   4.038  -7.608
  934    HB1  ALA 117           HB1      ALA 117 118.196   2.251  -7.378
  935    HB2  ALA 117           HB2      ALA 117 117.602   2.918  -5.857
  936    HB3  ALA 117           HB3      ALA 117 118.984   1.823  -5.860
  937    H    LEU 118           HN       LEU 118 119.186   4.114  -4.061
  938    HA   LEU 118           HA       LEU 118 117.185   6.031  -3.907
  939    HB2  LEU 118           HB2      LEU 118 119.426   5.434  -1.971
  940    HB3  LEU 118           HB1      LEU 118 117.989   6.378  -1.581
  941    HG   LEU 118           HG       LEU 118 117.383   3.793  -2.874
  942   HD11  LEU 118          HD11      LEU 118 117.760   2.659  -0.531
  943   HD12  LEU 118          HD12      LEU 118 118.988   3.910  -0.335
  944   HD13  LEU 118          HD13      LEU 118 119.095   2.769  -1.676
  945   HD21  LEU 118          HD21      LEU 118 115.860   5.523  -1.625
  946   HD22  LEU 118          HD22      LEU 118 116.450   4.723  -0.169
  947   HD23  LEU 118          HD23      LEU 118 115.571   3.799  -1.386
  948    H    LEU 119           HN       LEU 119 120.713   6.566  -3.772
  949    HA   LEU 119           HA       LEU 119 120.376   9.426  -3.602
  950    HB2  LEU 119           HB2      LEU 119 122.743   7.625  -4.036
  951    HB3  LEU 119           HB1      LEU 119 122.898   9.367  -4.246
  952    HG   LEU 119           HG       LEU 119 121.622   8.246  -1.754
  953   HD11  LEU 119          HD11      LEU 119 123.953   8.504  -0.727
  954   HD12  LEU 119          HD12      LEU 119 124.568   8.499  -2.379
  955   HD13  LEU 119          HD13      LEU 119 123.707   7.093  -1.755
  956   HD21  LEU 119          HD21      LEU 119 122.694  10.379  -0.839
  957   HD22  LEU 119          HD22      LEU 119 121.390  10.624  -1.998
  958   HD23  LEU 119          HD23      LEU 119 123.068  10.803  -2.508
  959    H    VAL 120           HN       VAL 120 121.469   7.241  -6.189
  960    HA   VAL 120           HA       VAL 120 121.682   9.229  -8.178
  961    HB   VAL 120           HB       VAL 120 121.199   6.265  -8.526
  962   HG11  VAL 120          HG11      VAL 120 120.807   7.277 -10.628
  963   HG12  VAL 120          HG12      VAL 120 122.505   6.804 -10.693
  964   HG13  VAL 120          HG13      VAL 120 122.068   8.484 -10.377
  965   HG21  VAL 120          HG21      VAL 120 123.820   7.776  -8.600
  966   HG22  VAL 120          HG22      VAL 120 123.578   6.031  -8.528
  967   HG23  VAL 120          HG23      VAL 120 123.208   7.031  -7.123
  968    H    SER 121           HN       SER 121 118.849   7.823  -6.853
  969    HA   SER 121           HA       SER 121 117.206   7.803  -9.151
  970    HB2  SER 121           HB2      SER 121 115.322   8.078  -7.432
  971    HB3  SER 121           HB1      SER 121 116.356   6.662  -7.279
  972    HG   SER 121           HG       SER 121 115.883   8.485  -5.470
  973    H    ALA 122           HN       ALA 122 117.920  10.399  -6.818
  974    HA   ALA 122           HA       ALA 122 117.295  12.385  -8.787
  975    HB1  ALA 122           HB1      ALA 122 115.474  12.393  -6.385
  976    HB2  ALA 122           HB2      ALA 122 115.014  11.618  -7.902
  977    HB3  ALA 122           HB3      ALA 122 115.344  13.350  -7.861
  978    H    HIS 123           HN       HIS 123 117.629  14.566  -8.028
  979    HA   HIS 123           HA       HIS 123 118.633  15.139  -5.425
  980    HB2  HIS 123           HB2      HIS 123 120.994  15.516  -6.041
  981    HB3  HIS 123           HB1      HIS 123 120.545  13.817  -6.191
  982    HD2  HIS 123           HD2      HIS 123 120.005  13.031  -8.989
  983    HE1  HIS 123           HE1      HIS 123 122.207  16.262 -10.581
  984    HE2  HIS 123           HE2      HIS 123 121.101  14.043 -11.134
  985    H    ASP 124           HN       ASP 124 119.725  16.219  -8.647
  986    HA   ASP 124           HA       ASP 124 118.603  18.892  -8.055
  987    HB2  ASP 124           HB2      ASP 124 121.134  18.640  -8.191
  988    HB3  ASP 124           HB1      ASP 124 120.908  18.308  -9.907
  989    H    ASP 125           HN       ASP 125 116.918  17.017  -9.179
  990    HA   ASP 125           HA       ASP 125 115.745  18.232 -11.309
  991    HB2  ASP 125           HB2      ASP 125 117.465  18.086 -12.850
  992    HB3  ASP 125           HB1      ASP 125 118.086  16.584 -12.172
  993   H5'1  C2E 501          H5'1      C2E 501 105.408   3.287  10.548
  994   H5'2  C2E 501          H5'2      C2E 501 104.706   1.894  11.386
  995    H4'  C2E 501           H4'      C2E 501 106.969   0.718  10.622
  996    H3'  C2E 501           H3'      C2E 501 106.769   3.110   8.803
  997    H2'  C2E 501           H2'      C2E 501 106.946   1.857   6.840
  998   HO2'  C2E 501          HO2'      C2E 501 108.461   0.269   8.330
  999    H1'  C2E 501           H1'      C2E 501 105.256  -0.125   7.460
 1000    H8   C2E 501           H8       C2E 501 103.576   2.445   9.447
 1001    HN1  C2E 501           HN1      C2E 501 103.104   3.786   3.212
 1002   HN21  C2E 501          HN21      C2E 501 104.514   2.528   2.053
 1003   HN22  C2E 501          HN22      C2E 501 105.571   1.360   2.813
 1004   H511  C2E 501          H511      C2E 501 108.468   4.579  10.119
 1005   H512  C2E 501          H512      C2E 501 110.079   4.475  10.859
 1006    H4A  C2E 501           H4A      C2E 501 109.164   5.352  12.979
 1007    H3A  C2E 501           H3A      C2E 501 106.490   5.287  11.552
 1008    H2A  C2E 501           H2A      C2E 501 105.895   7.295  12.522
 1009   HO2A  C2E 501          HO2A      C2E 501 107.653   6.467  14.479
 1010    H1A  C2E 501           H1A      C2E 501 108.307   8.592  12.317
 1011    H81  C2E 501           H81      C2E 501 108.228   6.739   9.123
 1012   HN11  C2E 501          HN11      C2E 501 104.031  11.569   9.111
 1013   HN24  C2E 501          HN24      C2E 501 104.569  11.643  12.560
 1014   HN23  C2E 501          HN23      C2E 501 103.728  12.320  11.184
 1015   H5'1  C2E 502          H5'1      C2E 502 101.175  10.209   4.465
 1016   H5'2  C2E 502          H5'2      C2E 502  99.808  11.303   4.169
 1017    H4'  C2E 502           H4'      C2E 502  99.602  11.862   6.389
 1018    H3'  C2E 502           H3'      C2E 502 102.582  11.457   6.598
 1019    H2'  C2E 502           H2'      C2E 502 102.281  11.169   8.962
 1020   HO2'  C2E 502          HO2'      C2E 502 100.619  12.892   9.063
 1021    H1'  C2E 502           H1'      C2E 502 100.172   9.497   8.766
 1022    H8   C2E 502           H8       C2E 502 102.382   8.675   5.779
 1023    HN1  C2E 502           HN1      C2E 502 104.322   6.004  11.254
 1024   HN21  C2E 502          HN21      C2E 502 103.191   6.815  12.960
 1025   HN22  C2E 502          HN22      C2E 502 101.953   8.040  12.773
 1026   H511  C2E 502          H511      C2E 502 102.582  16.333   5.713
 1027   H512  C2E 502          H512      C2E 502 102.001  14.687   5.393
 1028    H4A  C2E 502           H4A      C2E 502 103.597  15.931   3.682
 1029    H3A  C2E 502           H3A      C2E 502 103.727  13.007   4.488
 1030    H2A  C2E 502           H2A      C2E 502 105.600  12.724   3.082
 1031   HO2A  C2E 502          HO2A      C2E 502 105.484  15.352   2.060
 1032    H1A  C2E 502           H1A      C2E 502 106.892  15.047   3.738
 1033    H81  C2E 502           H81      C2E 502 105.752  14.332   7.076
 1034   HN11  C2E 502          HN11      C2E 502 109.446   9.528   5.072
 1035   HN24  C2E 502          HN24      C2E 502 109.677   9.613   2.861
 1036   HN23  C2E 502          HN23      C2E 502 108.947  10.872   1.893
  Start of MODEL   12
    1    H    MET   1           H        MET   1 100.991  21.329   6.147
    2    HA   MET   1           HA       MET   1 102.302  23.554   6.745
    3    HB2  MET   1           HB2      MET   1 100.188  24.234   7.932
    4    HB3  MET   1           HB1      MET   1  99.920  23.471   6.367
    5    HG2  MET   1           HG2      MET   1  99.720  21.259   7.726
    6    HG3  MET   1           HG1      MET   1  99.493  22.317   9.119
    7    HE1  MET   1           HE1      MET   1  96.073  20.739   7.952
    8    HE2  MET   1           HE2      MET   1  97.667  20.303   8.561
    9    HE3  MET   1           HE3      MET   1  97.344  20.234   6.830
   10    H    SER   2           HN       SER   2 103.834  23.986   8.179
   11    HA   SER   2           HA       SER   2 104.316  24.648  10.457
   12    HB2  SER   2           HB2      SER   2 103.158  21.972  11.258
   13    HB3  SER   2           HB1      SER   2 103.748  23.236  12.327
   14    HG   SER   2           HG       SER   2 102.014  24.433  11.904
   15    H    ASP   3           HN       ASP   3 105.569  22.932  12.194
   16    HA   ASP   3           HA       ASP   3 107.777  21.938  10.510
   17    HB2  ASP   3           HB2      ASP   3 109.193  22.108  12.474
   18    HB3  ASP   3           HB1      ASP   3 108.323  23.628  12.275
   19    H    GLN   4           HN       GLN   4 105.539  20.387  10.567
   20    HA   GLN   4           HA       GLN   4 106.412  18.079  12.193
   21    HB2  GLN   4           HB2      GLN   4 104.044  19.144  12.663
   22    HB3  GLN   4           HB1      GLN   4 103.586  18.296  11.194
   23    HG2  GLN   4           HG2      GLN   4 103.106  16.815  13.013
   24    HG3  GLN   4           HG1      GLN   4 104.552  16.193  12.218
   25   HE21  GLN   4          HE21      GLN   4 106.626  16.496  13.321
   26   HE22  GLN   4          HE22      GLN   4 106.681  16.881  14.968
   27    H    HIS   5           HN       HIS   5 106.929  19.159   9.366
   28    HA   HIS   5           HA       HIS   5 106.051  16.861   7.780
   29    HB2  HIS   5           HB2      HIS   5 107.815  19.083   6.785
   30    HB3  HIS   5           HB1      HIS   5 106.680  18.080   5.881
   31    HD2  HIS   5           HD2      HIS   5 104.237  18.677   8.285
   32    HE1  HIS   5           HE1      HIS   5 104.500  22.558   6.642
   33    HE2  HIS   5           HE2      HIS   5 103.078  21.006   8.064
   34    H    ASP   6           HN       ASP   6 108.579  17.550   9.828
   35    HA   ASP   6           HA       ASP   6 110.896  16.787   8.563
   36    HB2  ASP   6           HB2      ASP   6 110.195  15.698  11.288
   37    HB3  ASP   6           HB1      ASP   6 111.767  16.227  10.687
   38    H    GLU   7           HN       GLU   7 111.963  14.721   8.272
   39    HA   GLU   7           HA       GLU   7 110.037  12.621   7.664
   40    HB2  GLU   7           HB2      GLU   7 111.992  11.510   6.554
   41    HB3  GLU   7           HB1      GLU   7 111.568  13.088   5.889
   42    HG2  GLU   7           HG2      GLU   7 113.558  13.056   8.116
   43    HG3  GLU   7           HG1      GLU   7 114.096  12.428   6.561
   44    H    ARG   8           HN       ARG   8 109.793  10.773   8.720
   45    HA   ARG   8           HA       ARG   8 111.702  10.147  10.895
   46    HB2  ARG   8           HB2      ARG   8 108.694  10.067  10.842
   47    HB3  ARG   8           HB1      ARG   8 109.603   9.026  11.932
   48    HG2  ARG   8           HG2      ARG   8 109.183  10.936  13.236
   49    HG3  ARG   8           HG1      ARG   8 110.827  11.190  12.662
   50    HD2  ARG   8           HD2      ARG   8 109.403  13.220  12.447
   51    HD3  ARG   8           HD1      ARG   8 110.034  12.670  10.909
   52    HE   ARG   8           HE       ARG   8 107.751  11.559  10.643
   53   HH11  ARG   8          HH21      ARG   8 108.296  14.404  12.564
   54   HH12  ARG   8          HH22      ARG   8 106.718  15.055  12.285
   55   HH21  ARG   8          HH11      ARG   8 105.694  12.442  10.261
   56   HH22  ARG   8          HH12      ARG   8 105.250  13.949  10.990
   57    H    ARG   9           HN       ARG   9 110.470   9.116   7.968
   58    HA   ARG   9           HA       ARG   9 110.861   6.266   8.667
   59    HB2  ARG   9           HB2      ARG   9 109.940   6.152   6.116
   60    HB3  ARG   9           HB1      ARG   9 108.894   6.111   7.526
   61    HG2  ARG   9           HG2      ARG   9 108.803   8.655   7.365
   62    HG3  ARG   9           HG1      ARG   9 109.553   8.472   5.781
   63    HD2  ARG   9           HD2      ARG   9 107.710   7.196   4.958
   64    HD3  ARG   9           HD1      ARG   9 107.031   7.011   6.570
   65    HE   ARG   9           HE       ARG   9 106.275   9.257   6.482
   66   HH11  ARG   9          HH21      ARG   9 108.031   8.280   3.653
   67   HH12  ARG   9          HH22      ARG   9 107.473   9.604   2.688
   68   HH21  ARG   9          HH11      ARG   9 105.549  10.989   5.215
   69   HH22  ARG   9          HH12      ARG   9 106.071  11.136   3.571
   70    H    ARG  10           HN       ARG  10 112.510   5.159   7.866
   71    HA   ARG  10           HA       ARG  10 114.900   5.949   7.185
   72    HB2  ARG  10           HB2      ARG  10 113.843   3.965   5.206
   73    HB3  ARG  10           HB1      ARG  10 115.345   3.945   6.120
   74    HG2  ARG  10           HG2      ARG  10 114.169   2.314   7.261
   75    HG3  ARG  10           HG1      ARG  10 113.676   3.724   8.190
   76    HD2  ARG  10           HD2      ARG  10 111.689   3.915   6.589
   77    HD3  ARG  10           HD1      ARG  10 112.144   2.330   5.982
   78    HE   ARG  10           HE       ARG  10 111.008   2.927   8.612
   79   HH11  ARG  10          HH21      ARG  10 112.513   0.681   6.448
   80   HH12  ARG  10          HH22      ARG  10 111.982  -0.722   7.313
   81   HH21  ARG  10          HH11      ARG  10 110.310   1.087   9.754
   82   HH22  ARG  10          HH12      ARG  10 110.736  -0.492   9.184
   83    H    PHE  11           HN       PHE  11 112.683   5.419   4.419
   84    HA   PHE  11           HA       PHE  11 113.477   7.969   3.268
   85    HB2  PHE  11           HB2      PHE  11 114.011   6.737   1.058
   86    HB3  PHE  11           HB1      PHE  11 115.244   6.770   2.316
   87    HD1  PHE  11           HD2      PHE  11 115.704   4.777   3.690
   88    HD2  PHE  11           HD1      PHE  11 112.848   4.685   0.485
   89    HE1  PHE  11           HE2      PHE  11 115.733   2.298   3.738
   90    HE2  PHE  11           HE1      PHE  11 112.875   2.205   0.533
   91    HZ   PHE  11           HZ       PHE  11 114.317   1.012   2.160
   92    H    HIS  12           HN       HIS  12 112.201   8.539   1.386
   93    HA   HIS  12           HA       HIS  12 109.496   8.259   1.637
   94    HB2  HIS  12           HB2      HIS  12 109.661   8.494  -1.061
   95    HB3  HIS  12           HB1      HIS  12 109.947   9.840   0.044
   96    HD2  HIS  12           HD2      HIS  12 112.410   6.951  -1.222
   97    HE1  HIS  12           HE1      HIS  12 114.376  10.681  -1.443
   98    HE2  HIS  12           HE2      HIS  12 114.631   8.183  -1.825
   99    H    ARG  13           HN       ARG  13 107.946   7.123   0.108
  100    HA   ARG  13           HA       ARG  13 108.848   4.332  -0.340
  101    HB2  ARG  13           HB2      ARG  13 105.978   5.093   0.165
  102    HB3  ARG  13           HB1      ARG  13 106.753   3.524   0.334
  103    HG2  ARG  13           HG2      ARG  13 107.178   3.947   2.511
  104    HG3  ARG  13           HG1      ARG  13 108.110   5.374   2.070
  105    HD2  ARG  13           HD2      ARG  13 105.124   5.222   2.545
  106    HD3  ARG  13           HD1      ARG  13 106.312   6.074   3.526
  107    HE   ARG  13           HE       ARG  13 106.372   7.010   0.834
  108   HH11  ARG  13          HH21      ARG  13 104.542   7.091   3.771
  109   HH12  ARG  13          HH22      ARG  13 103.850   8.648   3.457
  110   HH21  ARG  13          HH11      ARG  13 105.470   9.049   0.417
  111   HH22  ARG  13          HH12      ARG  13 104.375   9.757   1.558
  112    H    ILE  14           HN       ILE  14 107.529   3.167  -1.986
  113    HA   ILE  14           HA       ILE  14 107.521   4.615  -4.456
  114    HB   ILE  14           HB       ILE  14 106.359   1.892  -3.833
  115   HG12  ILE  14          HG12      ILE  14 108.690   1.943  -3.147
  116   HG13  ILE  14          HG11      ILE  14 108.570   1.059  -4.666
  117   HG21  ILE  14          HG21      ILE  14 107.096   3.344  -6.369
  118   HG22  ILE  14          HG22      ILE  14 105.581   2.531  -5.966
  119   HG23  ILE  14          HG23      ILE  14 107.027   1.582  -6.311
  120   HD11  ILE  14          HD11      ILE  14 109.034   3.406  -5.755
  121   HD12  ILE  14          HD12      ILE  14 110.377   2.482  -5.083
  122   HD13  ILE  14          HD13      ILE  14 109.673   3.808  -4.161
  123    H    ALA  15           HN       ALA  15 105.997   6.262  -4.455
  124    HA   ALA  15           HA       ALA  15 103.241   5.585  -3.719
  125    HB1  ALA  15           HB1      ALA  15 102.895   8.076  -4.165
  126    HB2  ALA  15           HB2      ALA  15 104.651   8.179  -4.307
  127    HB3  ALA  15           HB3      ALA  15 103.918   7.649  -2.793
  128    H    PHE  16           HN       PHE  16 101.876   4.925  -5.146
  129    HA   PHE  16           HA       PHE  16 101.692   6.163  -7.758
  130    HB2  PHE  16           HB2      PHE  16 101.794   4.138  -9.039
  131    HB3  PHE  16           HB1      PHE  16 103.257   4.211  -8.064
  132    HD1  PHE  16           HD2      PHE  16 102.802   3.175  -5.541
  133    HD2  PHE  16           HD1      PHE  16 100.828   2.038  -9.184
  134    HE1  PHE  16           HE2      PHE  16 102.277   0.959  -4.571
  135    HE2  PHE  16           HE1      PHE  16 100.315  -0.182  -8.212
  136    HZ   PHE  16           HZ       PHE  16 101.049  -0.723  -5.907
  137    H    ASP  17           HN       ASP  17  99.565   5.651  -8.767
  138    HA   ASP  17           HA       ASP  17  97.611   5.185  -6.640
  139    HB2  ASP  17           HB2      ASP  17  97.545   7.183  -8.245
  140    HB3  ASP  17           HB1      ASP  17  97.003   6.034  -9.468
  141    H    ALA  18           HN       ALA  18  95.977   3.650  -6.762
  142    HA   ALA  18           HA       ALA  18  95.392   2.010  -8.940
  143    HB1  ALA  18           HB1      ALA  18  97.521   0.952  -7.089
  144    HB2  ALA  18           HB2      ALA  18  97.487   0.932  -8.852
  145    HB3  ALA  18           HB3      ALA  18  96.431  -0.146  -7.937
  146    H    ASP  19           HN       ASP  19  94.300  -0.119  -8.111
  147    HA   ASP  19           HA       ASP  19  92.508   0.731  -5.934
  148    HB2  ASP  19           HB2      ASP  19  91.904  -0.271  -8.366
  149    HB3  ASP  19           HB1      ASP  19  91.986  -1.775  -7.456
  150    H    SER  20           HN       SER  20  92.402  -0.274  -4.007
  151    HA   SER  20           HA       SER  20  93.789  -2.858  -3.679
  152    HB2  SER  20           HB2      SER  20  94.549  -1.926  -1.408
  153    HB3  SER  20           HB1      SER  20  95.412  -1.379  -2.843
  154    HG   SER  20           HG       SER  20  93.800   0.003  -1.098
  155    H    GLU  21           HN       GLU  21  93.052  -4.060  -1.817
  156    HA   GLU  21           HA       GLU  21  90.577  -3.118  -0.537
  157    HB2  GLU  21           HB2      GLU  21  90.735  -5.884  -1.749
  158    HB3  GLU  21           HB1      GLU  21  89.324  -5.059  -1.083
  159    HG2  GLU  21           HG2      GLU  21  89.426  -3.395  -2.888
  160    HG3  GLU  21           HG1      GLU  21  90.838  -4.204  -3.561
  161    H    ILE  22           HN       ILE  22  90.253  -3.988   1.511
  162    HA   ILE  22           HA       ILE  22  92.486  -5.679   2.490
  163    HB   ILE  22           HB       ILE  22  91.127  -3.329   3.812
  164   HG12  ILE  22          HG12      ILE  22  93.954  -3.907   2.876
  165   HG13  ILE  22          HG11      ILE  22  92.845  -2.706   2.217
  166   HG21  ILE  22          HG21      ILE  22  91.548  -5.196   5.432
  167   HG22  ILE  22          HG22      ILE  22  92.540  -3.779   5.757
  168   HG23  ILE  22          HG23      ILE  22  93.246  -5.180   4.958
  169   HD11  ILE  22          HD11      ILE  22  94.414  -1.573   3.663
  170   HD12  ILE  22          HD12      ILE  22  94.100  -2.707   4.974
  171   HD13  ILE  22          HD13      ILE  22  92.843  -1.579   4.463
  172    H    LEU  23           HN       LEU  23  92.033  -7.386   3.702
  173    HA   LEU  23           HA       LEU  23  89.209  -7.882   4.460
  174    HB2  LEU  23           HB2      LEU  23  91.110 -10.139   4.019
  175    HB3  LEU  23           HB1      LEU  23  89.370 -10.059   3.760
  176    HG   LEU  23           HG       LEU  23  90.111  -8.254   1.927
  177   HD11  LEU  23          HD11      LEU  23  92.511 -10.049   2.302
  178   HD12  LEU  23          HD12      LEU  23  92.467  -8.287   2.224
  179   HD13  LEU  23          HD13      LEU  23  92.167  -9.243   0.774
  180   HD21  LEU  23          HD21      LEU  23  88.827 -10.406   1.588
  181   HD22  LEU  23          HD22      LEU  23  90.372 -11.239   1.437
  182   HD23  LEU  23          HD23      LEU  23  89.913 -10.013   0.256
  183    H    GLN  24           HN       GLN  24  88.885  -8.020   6.520
  184    HA   GLN  24           HA       GLN  24  91.046  -9.045   8.284
  185    HB2  GLN  24           HB2      GLN  24  90.838  -6.559   8.453
  186    HB3  GLN  24           HB1      GLN  24  89.169  -6.768   8.973
  187    HG2  GLN  24           HG2      GLN  24  91.059  -8.439  10.492
  188    HG3  GLN  24           HG1      GLN  24  91.382  -6.716  10.652
  189   HE21  GLN  24          HE21      GLN  24  90.521  -6.333  12.745
  190   HE22  GLN  24          HE22      GLN  24  88.899  -6.622  13.153
  191    H    GLY  25           HN       GLY  25  90.192 -11.056   8.690
  192    HA2  GLY  25           HA2      GLY  25  88.866 -12.522   9.906
  193    HA3  GLY  25           HA1      GLY  25  87.801 -11.179  10.322
  194    H    GLU  26           HN       GLU  26  85.817 -11.574   9.586
  195    HA   GLU  26           HA       GLU  26  85.446 -12.991   7.025
  196    HB2  GLU  26           HB2      GLU  26  83.171 -13.354   7.781
  197    HB3  GLU  26           HB1      GLU  26  84.283 -13.824   9.066
  198    HG2  GLU  26           HG2      GLU  26  83.911 -11.197   9.686
  199    HG3  GLU  26           HG1      GLU  26  82.342 -11.582   8.979
  200    H    ARG  27           HN       ARG  27  86.032  -9.974   7.793
  201    HA   ARG  27           HA       ARG  27  83.822  -8.774   6.232
  202    HB2  ARG  27           HB2      ARG  27  85.659  -7.622   8.304
  203    HB3  ARG  27           HB1      ARG  27  84.529  -6.678   7.331
  204    HG2  ARG  27           HG2      ARG  27  82.653  -7.609   8.333
  205    HG3  ARG  27           HG1      ARG  27  83.496  -9.098   8.764
  206    HD2  ARG  27           HD2      ARG  27  84.676  -8.025  10.536
  207    HD3  ARG  27           HD1      ARG  27  84.163  -6.429   9.995
  208    HE   ARG  27           HE       ARG  27  82.640  -8.264  11.619
  209   HH11  ARG  27          HH21      ARG  27  82.522  -5.694   9.305
  210   HH12  ARG  27          HH22      ARG  27  80.952  -5.146   9.790
  211   HH21  ARG  27          HH11      ARG  27  80.579  -7.551  12.256
  212   HH22  ARG  27          HH12      ARG  27  79.852  -6.197  11.459
  213    H    ARG  28           HN       ARG  28  84.265  -7.701   4.380
  214    HA   ARG  28           HA       ARG  28  87.089  -7.068   3.722
  215    HB2  ARG  28           HB2      ARG  28  86.100  -9.097   2.473
  216    HB3  ARG  28           HB1      ARG  28  85.062  -7.928   1.654
  217    HG2  ARG  28           HG2      ARG  28  87.458  -6.682   1.382
  218    HG3  ARG  28           HG1      ARG  28  87.997  -8.355   1.404
  219    HD2  ARG  28           HD2      ARG  28  85.939  -8.593  -0.329
  220    HD3  ARG  28           HD1      ARG  28  86.370  -6.914  -0.630
  221    HE   ARG  28           HE       ARG  28  87.688  -8.950  -1.825
  222   HH11  ARG  28          HH21      ARG  28  88.649  -6.646   0.596
  223   HH12  ARG  28          HH22      ARG  28  90.316  -6.689   0.146
  224   HH21  ARG  28          HH11      ARG  28  89.860  -8.980  -2.403
  225   HH22  ARG  28          HH12      ARG  28  91.001  -7.998  -1.545
  226    H    TRP  29           HN       TRP  29  87.434  -5.247   2.486
  227    HA   TRP  29           HA       TRP  29  85.161  -3.529   1.837
  228    HB2  TRP  29           HB2      TRP  29  87.479  -2.699   3.587
  229    HB3  TRP  29           HB1      TRP  29  86.177  -1.645   3.038
  230    HD1  TRP  29           HD1      TRP  29  83.628  -2.573   3.832
  231    HE1  TRP  29           HE1      TRP  29  82.964  -3.444   6.180
  232    HE3  TRP  29           HE3      TRP  29  88.224  -3.844   5.606
  233    HZ2  TRP  29           HZ2      TRP  29  84.249  -4.539   8.503
  234    HZ3  TRP  29           HZ3      TRP  29  88.494  -4.793   7.877
  235    HH2  TRP  29           HH2      TRP  29  86.512  -5.151   9.328
  236    H    GLU  30           HN       GLU  30  85.721  -1.831   0.396
  237    HA   GLU  30           HA       GLU  30  88.108  -2.435  -1.207
  238    HB2  GLU  30           HB2      GLU  30  85.879  -0.557  -1.986
  239    HB3  GLU  30           HB1      GLU  30  87.006  -1.422  -3.032
  240    HG2  GLU  30           HG2      GLU  30  85.977  -3.578  -2.101
  241    HG3  GLU  30           HG1      GLU  30  84.701  -2.557  -1.439
  242    H    VAL  31           HN       VAL  31  89.757  -0.908  -1.439
  243    HA   VAL  31           HA       VAL  31  89.302   1.842  -0.517
  244    HB   VAL  31           HB       VAL  31  91.405   1.713   0.859
  245   HG11  VAL  31          HG11      VAL  31  89.128   1.644   1.855
  246   HG12  VAL  31          HG12      VAL  31  90.296   0.707   2.788
  247   HG13  VAL  31          HG13      VAL  31  89.150  -0.115   1.731
  248   HG21  VAL  31          HG21      VAL  31  92.085  -0.497  -0.303
  249   HG22  VAL  31          HG22      VAL  31  90.958  -1.274   0.808
  250   HG23  VAL  31          HG23      VAL  31  92.345  -0.384   1.437
  251    H    LEU  32           HN       LEU  32  90.975   3.306  -1.156
  252    HA   LEU  32           HA       LEU  32  92.369   2.414  -3.587
  253    HB2  LEU  32           HB2      LEU  32  92.708   4.827  -4.021
  254    HB3  LEU  32           HB1      LEU  32  91.003   4.432  -3.837
  255    HG   LEU  32           HG       LEU  32  92.716   5.492  -1.569
  256   HD11  LEU  32          HD11      LEU  32  91.646   7.672  -2.014
  257   HD12  LEU  32          HD12      LEU  32  90.868   6.992  -3.443
  258   HD13  LEU  32          HD13      LEU  32  92.624   7.144  -3.384
  259   HD21  LEU  32          HD21      LEU  32  89.930   4.581  -1.856
  260   HD22  LEU  32          HD22      LEU  32  90.061   6.191  -1.153
  261   HD23  LEU  32          HD23      LEU  32  90.886   4.830  -0.396
  262    H    LEU  33           HN       LEU  33  94.537   2.157  -3.615
  263    HA   LEU  33           HA       LEU  33  95.958   2.665  -1.107
  264    HB2  LEU  33           HB2      LEU  33  96.362   0.484  -1.962
  265    HB3  LEU  33           HB1      LEU  33  96.639   1.082  -3.594
  266    HG   LEU  33           HG       LEU  33  98.458   2.248  -1.564
  267   HD11  LEU  33          HD11      LEU  33  99.809   0.281  -1.243
  268   HD12  LEU  33          HD12      LEU  33  98.778  -0.669  -2.310
  269   HD13  LEU  33          HD13      LEU  33  98.167  -0.123  -0.749
  270   HD21  LEU  33          HD21      LEU  33 100.100   1.831  -3.318
  271   HD22  LEU  33          HD22      LEU  33  98.653   2.523  -4.049
  272   HD23  LEU  33          HD23      LEU  33  98.965   0.793  -4.181
  273    H    HIS  34           HN       HIS  34  97.212   4.319  -0.809
  274    HA   HIS  34           HA       HIS  34  97.774   6.115  -3.046
  275    HB2  HIS  34           HB2      HIS  34  97.911   6.352  -0.042
  276    HB3  HIS  34           HB1      HIS  34  98.565   7.609  -1.104
  277    HD2  HIS  34           HD2      HIS  34  95.064   6.067  -0.136
  278    HE1  HIS  34           HE1      HIS  34  94.382   9.558  -2.405
  279    HE2  HIS  34           HE2      HIS  34  93.272   7.743  -1.022
  280    H    ASP  35           HN       ASP  35  99.549   3.907  -0.963
  281    HA   ASP  35           HA       ASP  35 101.697   3.958  -2.750
  282    HB2  ASP  35           HB2      ASP  35 103.456   5.111  -1.514
  283    HB3  ASP  35           HB1      ASP  35 102.081   6.209  -1.668
  284    H    VAL  36           HN       VAL  36 103.565   2.663  -2.055
  285    HA   VAL  36           HA       VAL  36 103.090   0.942   0.265
  286    HB   VAL  36           HB       VAL  36 101.978  -0.023  -1.840
  287   HG11  VAL  36          HG11      VAL  36 103.317  -0.850  -3.583
  288   HG12  VAL  36          HG12      VAL  36 104.788  -0.784  -2.613
  289   HG13  VAL  36          HG13      VAL  36 104.067   0.705  -3.221
  290   HG21  VAL  36          HG21      VAL  36 104.175  -1.780  -0.736
  291   HG22  VAL  36          HG22      VAL  36 102.548  -2.244  -1.228
  292   HG23  VAL  36          HG23      VAL  36 102.789  -1.310   0.245
  293    H    SER  37           HN       SER  37 104.916  -0.638   0.540
  294    HA   SER  37           HA       SER  37 107.486   0.263  -0.522
  295    HB2  SER  37           HB2      SER  37 107.048  -0.155   2.444
  296    HB3  SER  37           HB1      SER  37 108.500   0.438   1.645
  297    HG   SER  37           HG       SER  37 107.526   2.254   2.270
  298    H    LEU  38           HN       LEU  38 109.203  -1.424   0.213
  299    HA   LEU  38           HA       LEU  38 108.205  -3.976  -0.498
  300    HB2  LEU  38           HB2      LEU  38 110.847  -3.458   0.887
  301    HB3  LEU  38           HB1      LEU  38 110.439  -4.792  -0.190
  302    HG   LEU  38           HG       LEU  38 109.871  -2.628  -1.787
  303   HD11  LEU  38          HD11      LEU  38 111.489  -0.927  -1.525
  304   HD12  LEU  38          HD12      LEU  38 112.464  -1.899  -0.422
  305   HD13  LEU  38          HD13      LEU  38 110.927  -1.224   0.119
  306   HD21  LEU  38          HD21      LEU  38 111.141  -4.546  -2.533
  307   HD22  LEU  38          HD22      LEU  38 112.471  -4.151  -1.444
  308   HD23  LEU  38          HD23      LEU  38 112.123  -3.111  -2.824
  309    H    HIS  39           HN       HIS  39 107.769  -2.343   2.315
  310    HA   HIS  39           HA       HIS  39 106.918  -4.717   3.698
  311    HB2  HIS  39           HB2      HIS  39 108.385  -4.617   5.581
  312    HB3  HIS  39           HB1      HIS  39 109.403  -4.622   4.142
  313    HD2  HIS  39           HD2      HIS  39 108.615  -2.319   7.165
  314    HE1  HIS  39           HE1      HIS  39 111.154  -0.153   4.579
  315    HE2  HIS  39           HE2      HIS  39 110.074  -0.172   6.877
  316    H    GLY  40           HN       GLY  40 105.550  -2.402   2.831
  317    HA2  GLY  40           HA2      GLY  40 104.147  -1.690   5.193
  318    HA3  GLY  40           HA1      GLY  40 105.223  -0.375   4.735
  319    H    ILE  41           HN       ILE  41 102.274  -0.390   4.745
  320    HA   ILE  41           HA       ILE  41 101.886   0.520   1.986
  321    HB   ILE  41           HB       ILE  41 100.823  -1.365   1.387
  322   HG12  ILE  41          HG12      ILE  41  98.778  -0.619   3.503
  323   HG13  ILE  41          HG11      ILE  41  98.873   0.125   1.906
  324   HG21  ILE  41          HG21      ILE  41 100.607  -2.077   4.324
  325   HG22  ILE  41          HG22      ILE  41 101.887  -2.593   3.226
  326   HG23  ILE  41          HG23      ILE  41 100.235  -3.150   2.975
  327   HD11  ILE  41          HD11      ILE  41  98.896  -2.749   1.630
  328   HD12  ILE  41          HD12      ILE  41  97.732  -1.585   0.998
  329   HD13  ILE  41          HD13      ILE  41  97.516  -2.255   2.613
  330    H    LEU  42           HN       LEU  42 100.280   1.976   1.674
  331    HA   LEU  42           HA       LEU  42  98.977   3.098   4.092
  332    HB2  LEU  42           HB2      LEU  42 100.895   4.354   2.521
  333    HB3  LEU  42           HB1      LEU  42  99.388   4.936   1.823
  334    HG   LEU  42           HG       LEU  42  99.906   5.001   4.798
  335   HD11  LEU  42          HD11      LEU  42 100.627   7.303   4.553
  336   HD12  LEU  42          HD12      LEU  42 100.339   7.250   2.814
  337   HD13  LEU  42          HD13      LEU  42 101.646   6.301   3.520
  338   HD21  LEU  42          HD21      LEU  42  98.160   6.755   4.699
  339   HD22  LEU  42          HD22      LEU  42  97.568   5.214   4.085
  340   HD23  LEU  42          HD23      LEU  42  98.014   6.496   2.961
  341    H    VAL  43           HN       VAL  43  96.799   3.572   3.879
  342    HA   VAL  43           HA       VAL  43  95.601   3.359   1.204
  343    HB   VAL  43           HB       VAL  43  93.907   1.766   1.954
  344   HG11  VAL  43          HG11      VAL  43  95.278  -0.178   1.922
  345   HG12  VAL  43          HG12      VAL  43  96.615   0.656   2.712
  346   HG13  VAL  43          HG13      VAL  43  96.199   1.042   1.042
  347   HG21  VAL  43          HG21      VAL  43  95.488   1.816   4.544
  348   HG22  VAL  43          HG22      VAL  43  94.226   0.644   4.171
  349   HG23  VAL  43          HG23      VAL  43  93.823   2.352   4.320
  350    H    GLY  44           HN       GLY  44  93.141   3.674   1.411
  351    HA2  GLY  44           HA2      GLY  44  92.700   6.121   3.026
  352    HA3  GLY  44           HA1      GLY  44  91.744   5.627   1.628
  353    H    GLN  45           HN       GLN  45  90.929   6.228   4.564
  354    HA   GLN  45           HA       GLN  45  90.102   3.648   5.535
  355    HB2  GLN  45           HB2      GLN  45  90.856   5.503   7.007
  356    HB3  GLN  45           HB1      GLN  45  89.411   6.403   6.557
  357    HG2  GLN  45           HG2      GLN  45  88.897   3.629   7.465
  358    HG3  GLN  45           HG1      GLN  45  89.559   4.695   8.700
  359   HE21  GLN  45          HE21      GLN  45  87.609   6.123   6.147
  360   HE22  GLN  45          HE22      GLN  45  86.238   6.412   7.105
  361    HA   PRO  46           HA       PRO  46  86.160   4.421   3.435
  362    HB2  PRO  46           HB2      PRO  46  85.238   1.876   3.285
  363    HB3  PRO  46           HB1      PRO  46  86.596   2.422   2.276
  364    HG2  PRO  46           HG2      PRO  46  86.635   0.811   4.785
  365    HG3  PRO  46           HG1      PRO  46  87.630   0.651   3.330
  366    HD2  PRO  46           HD2      PRO  46  88.427   1.961   5.688
  367    HD3  PRO  46           HD1      PRO  46  89.186   2.166   4.097
  368    H    GLN  47           HN       GLN  47  83.840   4.161   4.021
  369    HA   GLN  47           HA       GLN  47  83.365   4.660   6.763
  370    HB2  GLN  47           HB2      GLN  47  81.487   4.026   4.486
  371    HB3  GLN  47           HB1      GLN  47  80.946   4.503   6.095
  372    HG2  GLN  47           HG2      GLN  47  81.005   6.528   4.864
  373    HG3  GLN  47           HG1      GLN  47  82.487   6.549   5.816
  374   HE21  GLN  47          HE21      GLN  47  82.908   8.143   3.808
  375   HE22  GLN  47          HE22      GLN  47  83.684   7.417   2.483
  376    H    ASP  48           HN       ASP  48  82.849   1.761   4.782
  377    HA   ASP  48           HA       ASP  48  81.492   0.296   6.827
  378    HB2  ASP  48           HB2      ASP  48  82.786  -0.475   4.220
  379    HB3  ASP  48           HB1      ASP  48  82.061  -1.674   5.292
  380    H    TRP  49           HN       TRP  49  84.501   1.370   7.012
  381    HA   TRP  49           HA       TRP  49  86.138  -0.864   7.509
  382    HB2  TRP  49           HB2      TRP  49  86.896   1.508   7.262
  383    HB3  TRP  49           HB1      TRP  49  86.288   1.817   8.884
  384    HD1  TRP  49           HD1      TRP  49  87.602   0.859  10.886
  385    HE1  TRP  49           HE1      TRP  49  90.007  -0.156  11.125
  386    HE3  TRP  49           HE3      TRP  49  88.532  -0.119   6.025
  387    HZ2  TRP  49           HZ2      TRP  49  92.068  -1.267   9.315
  388    HZ3  TRP  49           HZ3      TRP  49  90.652  -1.153   5.287
  389    HH2  TRP  49           HH2      TRP  49  92.392  -1.734   6.939
  390    H    ASN  50           HN       ASN  50  84.287  -2.116   8.663
  391    HA   ASN  50           HA       ASN  50  84.145  -1.407  11.508
  392    HB2  ASN  50           HB2      ASN  50  82.030  -2.058  10.427
  393    HB3  ASN  50           HB1      ASN  50  82.731  -3.610   9.974
  394   HD21  ASN  50          HD21      ASN  50  83.764  -4.792  12.048
  395   HD22  ASN  50          HD22      ASN  50  82.774  -4.780  13.428
  396    H    GLY  51           HN       GLY  51  86.419  -1.823  11.837
  397    HA2  GLY  51           HA2      GLY  51  86.920  -4.672  12.400
  398    HA3  GLY  51           HA1      GLY  51  88.095  -3.777  11.442
  399    H    ASP  52           HN       ASP  52  88.631  -5.032  13.920
  400    HA   ASP  52           HA       ASP  52  88.828  -2.883  15.900
  401    HB2  ASP  52           HB2      ASP  52  88.141  -5.267  16.466
  402    HB3  ASP  52           HB1      ASP  52  89.820  -5.713  16.173
  403    HA   PRO  53           HA       PRO  53  92.851  -1.823  14.123
  404    HB2  PRO  53           HB2      PRO  53  93.027  -0.491  16.806
  405    HB3  PRO  53           HB1      PRO  53  93.423   0.159  15.206
  406    HG2  PRO  53           HG2      PRO  53  91.168   0.826  16.440
  407    HG3  PRO  53           HG1      PRO  53  91.225   0.589  14.685
  408    HD2  PRO  53           HD2      PRO  53  90.035  -1.169  16.780
  409    HD3  PRO  53           HD1      PRO  53  89.567  -0.958  15.077
  410    H    GLN  54           HN       GLN  54  92.170  -3.381  17.141
  411    HA   GLN  54           HA       GLN  54  94.914  -3.931  17.787
  412    HB2  GLN  54           HB2      GLN  54  92.283  -4.868  18.916
  413    HB3  GLN  54           HB1      GLN  54  93.823  -5.509  19.489
  414    HG2  GLN  54           HG2      GLN  54  94.518  -3.442  20.346
  415    HG3  GLN  54           HG1      GLN  54  93.407  -2.534  19.322
  416   HE21  GLN  54          HE21      GLN  54  91.520  -1.842  20.338
  417   HE22  GLN  54          HE22      GLN  54  90.885  -2.511  21.764
  418    H    ARG  55           HN       ARG  55  92.467  -5.499  15.878
  419    HA   ARG  55           HA       ARG  55  94.000  -8.004  15.849
  420    HB2  ARG  55           HB2      ARG  55  91.245  -7.204  14.952
  421    HB3  ARG  55           HB1      ARG  55  92.005  -8.610  14.211
  422    HG2  ARG  55           HG2      ARG  55  90.973  -9.648  16.002
  423    HG3  ARG  55           HG1      ARG  55  92.500  -9.233  16.773
  424    HD2  ARG  55           HD2      ARG  55  91.334  -7.007  17.409
  425    HD3  ARG  55           HD1      ARG  55  89.837  -7.843  17.008
  426    HE   ARG  55           HE       ARG  55  91.586  -9.244  18.868
  427   HH11  ARG  55          HH21      ARG  55  88.935  -7.075  18.366
  428   HH12  ARG  55          HH22      ARG  55  88.248  -7.333  19.935
  429   HH21  ARG  55          HH11      ARG  55  90.689  -9.585  20.929
  430   HH22  ARG  55          HH12      ARG  55  89.240  -8.753  21.385
  431    HA   PRO  56           HA       PRO  56  96.142  -7.097  12.167
  432    HB2  PRO  56           HB2      PRO  56  96.206  -9.568  10.938
  433    HB3  PRO  56           HB1      PRO  56  97.230  -9.112  12.313
  434    HG2  PRO  56           HG2      PRO  56  94.701 -10.688  12.278
  435    HG3  PRO  56           HG1      PRO  56  96.176 -10.941  13.229
  436    HD2  PRO  56           HD2      PRO  56  93.952  -9.802  14.300
  437    HD3  PRO  56           HD1      PRO  56  95.590  -9.347  14.819
  438    H    PHE  57           HN       PHE  57  96.052  -6.993   9.857
  439    HA   PHE  57           HA       PHE  57  93.355  -7.320   8.676
  440    HB2  PHE  57           HB2      PHE  57  95.236  -4.970   8.299
  441    HB3  PHE  57           HB1      PHE  57  93.692  -5.196   7.480
  442    HD1  PHE  57           HD2      PHE  57  95.233  -4.851  10.872
  443    HD2  PHE  57           HD1      PHE  57  91.681  -4.475   8.488
  444    HE1  PHE  57           HE2      PHE  57  94.062  -3.775  12.777
  445    HE2  PHE  57           HE1      PHE  57  90.512  -3.406  10.391
  446    HZ   PHE  57           HZ       PHE  57  91.700  -3.057  12.537
  447    H    GLU  58           HN       GLU  58  93.457  -7.648   6.307
  448    HA   GLU  58           HA       GLU  58  96.158  -8.401   5.373
  449    HB2  GLU  58           HB2      GLU  58  93.544  -9.732   4.592
  450    HB3  GLU  58           HB1      GLU  58  95.152 -10.196   4.036
  451    HG2  GLU  58           HG2      GLU  58  95.809 -10.928   6.196
  452    HG3  GLU  58           HG1      GLU  58  94.448 -10.119   6.970
  453    H    ALA  59           HN       ALA  59  96.787  -7.502   3.390
  454    HA   ALA  59           HA       ALA  59  94.744  -5.842   2.019
  455    HB1  ALA  59           HB1      ALA  59  96.894  -4.638   1.227
  456    HB2  ALA  59           HB2      ALA  59  97.658  -5.458   2.589
  457    HB3  ALA  59           HB3      ALA  59  96.311  -4.354   2.865
  458    H    ARG  60           HN       ARG  60  94.414  -6.084  -0.063
  459    HA   ARG  60           HA       ARG  60  96.229  -7.838  -1.618
  460    HB2  ARG  60           HB2      ARG  60  93.218  -7.702  -1.571
  461    HB3  ARG  60           HB1      ARG  60  94.060  -8.227  -3.024
  462    HG2  ARG  60           HG2      ARG  60  93.334 -10.079  -1.432
  463    HG3  ARG  60           HG1      ARG  60  95.027 -10.100  -1.909
  464    HD2  ARG  60           HD2      ARG  60  95.759  -9.408   0.181
  465    HD3  ARG  60           HD1      ARG  60  94.232  -8.633   0.583
  466    HE   ARG  60           HE       ARG  60  93.376 -11.081   0.612
  467   HH11  ARG  60          HH21      ARG  60  96.535  -9.991   1.547
  468   HH12  ARG  60          HH22      ARG  60  96.795 -11.287   2.664
  469   HH21  ARG  60          HH11      ARG  60  93.722 -12.774   2.078
  470   HH22  ARG  60          HH12      ARG  60  95.207 -12.859   2.964
  471    H    LEU  61           HN       LEU  61  97.125  -6.803  -3.352
  472    HA   LEU  61           HA       LEU  61  95.913  -4.227  -4.146
  473    HB2  LEU  61           HB2      LEU  61  98.705  -5.099  -4.842
  474    HB3  LEU  61           HB1      LEU  61  98.052  -3.468  -4.725
  475    HG   LEU  61           HG       LEU  61  98.436  -5.364  -2.387
  476   HD11  LEU  61          HD11      LEU  61 100.590  -4.608  -3.165
  477   HD12  LEU  61          HD12      LEU  61 100.180  -3.651  -1.741
  478   HD13  LEU  61          HD13      LEU  61 100.000  -2.955  -3.351
  479   HD21  LEU  61          HD21      LEU  61  96.612  -3.906  -1.887
  480   HD22  LEU  61          HD22      LEU  61  97.410  -2.530  -2.650
  481   HD23  LEU  61          HD23      LEU  61  98.019  -3.166  -1.123
  482    H    TYR  62           HN       TYR  62  95.302  -3.860  -6.200
  483    HA   TYR  62           HA       TYR  62  95.737  -6.034  -8.161
  484    HB2  TYR  62           HB2      TYR  62  93.349  -4.189  -8.189
  485    HB3  TYR  62           HB1      TYR  62  93.551  -5.736  -9.009
  486    HD1  TYR  62           HD1      TYR  62  93.585  -4.291  -5.540
  487    HD2  TYR  62           HD2      TYR  62  92.592  -7.642  -8.044
  488    HE1  TYR  62           HE1      TYR  62  92.584  -5.463  -3.593
  489    HE2  TYR  62           HE2      TYR  62  91.584  -8.800  -6.088
  490    HH   TYR  62           HH       TYR  62  90.781  -7.282  -3.270
  491    H    LEU  63           HN       LEU  63  97.197  -5.348  -9.575
  492    HA   LEU  63           HA       LEU  63  97.169  -2.523 -10.446
  493    HB2  LEU  63           HB2      LEU  63  99.288  -3.732  -9.498
  494    HB3  LEU  63           HB1      LEU  63  99.373  -4.469 -11.094
  495    HG   LEU  63           HG       LEU  63  99.307  -1.492 -10.511
  496   HD11  LEU  63          HD11      LEU  63 101.460  -2.556  -9.971
  497   HD12  LEU  63          HD12      LEU  63 101.613  -1.550 -11.411
  498   HD13  LEU  63          HD13      LEU  63 101.500  -3.303 -11.567
  499   HD21  LEU  63          HD21      LEU  63  99.251  -3.106 -13.064
  500   HD22  LEU  63          HD22      LEU  63  99.920  -1.474 -13.041
  501   HD23  LEU  63          HD23      LEU  63  98.234  -1.740 -12.602
  502    H    GLY  64           HN       GLY  64  98.454  -5.330 -12.170
  503    HA2  GLY  64           HA2      GLY  64  97.124  -4.535 -14.605
  504    HA3  GLY  64           HA1      GLY  64  98.155  -5.951 -14.388
  505    H    LEU  65           HN       LEU  65  96.141  -6.681 -15.831
  506    HA   LEU  65           HA       LEU  65  93.760  -7.223 -14.325
  507    HB2  LEU  65           HB2      LEU  65  94.710  -7.699 -17.095
  508    HB3  LEU  65           HB1      LEU  65  93.538  -8.870 -16.491
  509    HG   LEU  65           HG       LEU  65  93.027  -5.928 -16.105
  510   HD11  LEU  65          HD11      LEU  65  91.700  -6.087 -18.288
  511   HD12  LEU  65          HD12      LEU  65  92.639  -7.539 -18.637
  512   HD13  LEU  65          HD13      LEU  65  93.453  -5.984 -18.452
  513   HD21  LEU  65          HD21      LEU  65  91.649  -7.828 -15.066
  514   HD22  LEU  65          HD22      LEU  65  91.116  -8.199 -16.705
  515   HD23  LEU  65          HD23      LEU  65  90.745  -6.629 -15.991
  516    H    ASP  66           HN       ASP  66  96.727  -8.992 -15.105
  517    HA   ASP  66           HA       ASP  66  95.744 -11.459 -13.818
  518    HB2  ASP  66           HB2      ASP  66  98.223 -10.857 -15.422
  519    HB3  ASP  66           HB1      ASP  66  97.699 -12.437 -14.843
  520    H    VAL  67           HN       VAL  67  97.028  -8.651 -12.766
  521    HA   VAL  67           HA       VAL  67  99.121  -9.909 -11.103
  522    HB   VAL  67           HB       VAL  67  98.614  -7.078 -11.976
  523   HG11  VAL  67          HG11      VAL  67  99.020  -6.595  -9.726
  524   HG12  VAL  67          HG12      VAL  67 100.663  -6.643 -10.362
  525   HG13  VAL  67          HG13      VAL  67 100.015  -8.032  -9.491
  526   HG21  VAL  67          HG21      VAL  67 101.226  -8.588 -11.813
  527   HG22  VAL  67          HG22      VAL  67 100.801  -7.230 -12.858
  528   HG23  VAL  67          HG23      VAL  67 100.121  -8.827 -13.171
  529    H    LEU  68           HN       LEU  68  98.016 -10.873  -9.539
  530    HA   LEU  68           HA       LEU  68  96.401  -9.155  -7.756
  531    HB2  LEU  68           HB2      LEU  68  94.947 -10.874  -8.347
  532    HB3  LEU  68           HB1      LEU  68  96.243 -12.052  -8.522
  533    HG   LEU  68           HG       LEU  68  96.073 -11.045  -5.785
  534   HD11  LEU  68          HD11      LEU  68  93.720 -10.803  -6.104
  535   HD12  LEU  68          HD12      LEU  68  93.939 -12.362  -5.308
  536   HD13  LEU  68          HD13      LEU  68  93.624 -12.294  -7.042
  537   HD21  LEU  68          HD21      LEU  68  95.627 -13.853  -6.824
  538   HD22  LEU  68          HD22      LEU  68  96.261 -13.370  -5.250
  539   HD23  LEU  68          HD23      LEU  68  97.233 -13.135  -6.702
  540    H    ILE  69           HN       ILE  69  97.510  -8.540  -6.007
  541    HA   ILE  69           HA       ILE  69  99.665 -10.315  -5.019
  542    HB   ILE  69           HB       ILE  69  99.373  -7.304  -4.932
  543   HG12  ILE  69          HG12      ILE  69 101.829  -8.584  -5.970
  544   HG13  ILE  69          HG11      ILE  69 100.383  -8.957  -6.902
  545   HG21  ILE  69          HG21      ILE  69 100.598  -7.362  -3.029
  546   HG22  ILE  69          HG22      ILE  69 101.927  -7.979  -4.008
  547   HG23  ILE  69          HG23      ILE  69 100.860  -9.098  -3.169
  548   HD11  ILE  69          HD11      ILE  69 101.481  -6.209  -6.255
  549   HD12  ILE  69          HD12      ILE  69  99.895  -6.478  -6.979
  550   HD13  ILE  69          HD13      ILE  69 101.352  -6.964  -7.845
  551    H    ARG  70           HN       ARG  70  99.819 -10.762  -2.847
  552    HA   ARG  70           HA       ARG  70  97.625  -9.789  -1.120
  553    HB2  ARG  70           HB2      ARG  70  98.677 -12.620  -1.009
  554    HB3  ARG  70           HB1      ARG  70  97.248 -11.956  -0.217
  555    HG2  ARG  70           HG2      ARG  70  96.723 -11.385  -2.857
  556    HG3  ARG  70           HG1      ARG  70  97.584 -12.917  -2.992
  557    HD2  ARG  70           HD2      ARG  70  95.149 -12.382  -1.268
  558    HD3  ARG  70           HD1      ARG  70  95.182 -13.323  -2.757
  559    HE   ARG  70           HE       ARG  70  97.051 -14.484  -1.055
  560   HH11  ARG  70          HH21      ARG  70  93.660 -13.800  -1.115
  561   HH12  ARG  70          HH22      ARG  70  93.228 -15.163  -0.139
  562   HH21  ARG  70          HH11      ARG  70  96.490 -16.274   0.227
  563   HH22  ARG  70          HH12      ARG  70  94.829 -16.564   0.621
  564    H    MET  71           HN       MET  71  98.243  -9.044   0.796
  565    HA   MET  71           HA       MET  71 100.834  -9.861   1.933
  566    HB2  MET  71           HB2      MET  71 100.101  -6.961   2.074
  567    HB3  MET  71           HB1      MET  71 101.692  -7.716   2.117
  568    HG2  MET  71           HG2      MET  71 101.762  -7.970  -0.227
  569    HG3  MET  71           HG1      MET  71 100.019  -7.791  -0.393
  570    HE1  MET  71           HE1      MET  71 101.689  -5.325   2.170
  571    HE2  MET  71           HE2      MET  71 102.678  -4.347   1.091
  572    HE3  MET  71           HE3      MET  71 103.010  -6.066   1.259
  573    H    GLU  72           HN       GLU  72 100.938  -9.675   4.196
  574    HA   GLU  72           HA       GLU  72  98.310  -9.328   5.468
  575    HB2  GLU  72           HB2      GLU  72  99.620 -11.491   5.793
  576    HB3  GLU  72           HB1      GLU  72 100.774 -10.550   6.736
  577    HG2  GLU  72           HG2      GLU  72  97.804 -10.654   7.326
  578    HG3  GLU  72           HG1      GLU  72  98.996 -11.682   8.119
  579    H    ILE  73           HN       ILE  73  98.056  -7.610   6.959
  580    HA   ILE  73           HA       ILE  73 100.509  -6.185   7.765
  581    HB   ILE  73           HB       ILE  73  99.688  -4.092   6.958
  582   HG12  ILE  73          HG12      ILE  73  97.186  -5.690   6.347
  583   HG13  ILE  73          HG11      ILE  73  97.327  -4.279   7.389
  584   HG21  ILE  73          HG21      ILE  73  99.768  -4.498   4.590
  585   HG22  ILE  73          HG22      ILE  73  99.164  -6.140   4.791
  586   HG23  ILE  73          HG23      ILE  73 100.782  -5.719   5.347
  587   HD11  ILE  73          HD11      ILE  73  97.891  -4.178   4.417
  588   HD12  ILE  73          HD12      ILE  73  97.675  -2.825   5.513
  589   HD13  ILE  73          HD13      ILE  73  96.305  -3.846   5.103
  590    H    SER  74           HN       SER  74 100.272  -4.676   9.433
  591    HA   SER  74           HA       SER  74  97.845  -5.000  11.106
  592    HB2  SER  74           HB2      SER  74 100.658  -5.441  11.739
  593    HB3  SER  74           HB1      SER  74  99.917  -4.271  12.827
  594    HG   SER  74           HG       SER  74  99.591  -6.940  12.700
  595    H    LEU  75           HN       LEU  75  97.164  -3.143  12.251
  596    HA   LEU  75           HA       LEU  75  97.578  -0.687  10.855
  597    HB2  LEU  75           HB2      LEU  75  95.528  -1.500  12.319
  598    HB3  LEU  75           HB1      LEU  75  96.422  -0.722  13.623
  599    HG   LEU  75           HG       LEU  75  96.579   1.328  12.126
  600   HD11  LEU  75          HD11      LEU  75  94.695  -0.385  10.518
  601   HD12  LEU  75          HD12      LEU  75  96.085   0.544   9.956
  602   HD13  LEU  75          HD13      LEU  75  94.607   1.373  10.438
  603   HD21  LEU  75          HD21      LEU  75  94.246   2.033  12.625
  604   HD22  LEU  75          HD22      LEU  75  95.016   1.234  13.995
  605   HD23  LEU  75          HD23      LEU  75  93.851   0.356  13.002
  606    H    ALA  76           HN       ALA  76  99.048   0.759  11.020
  607    HA   ALA  76           HA       ALA  76 100.936   0.652  13.265
  608    HB1  ALA  76           HB1      ALA  76 102.420   2.005  11.802
  609    HB2  ALA  76           HB2      ALA  76 101.198   1.908  10.531
  610    HB3  ALA  76           HB3      ALA  76 101.998   0.446  11.101
  611    H    TRP  77           HN       TRP  77  98.958   2.878  11.398
  612    HA   TRP  77           HA       TRP  77  98.377   4.559  13.669
  613    HB2  TRP  77           HB2      TRP  77  99.496   6.597  12.843
  614    HB3  TRP  77           HB1      TRP  77 100.694   5.327  13.124
  615    HD1  TRP  77           HD1      TRP  77 101.924   4.306  11.050
  616    HE1  TRP  77           HE1      TRP  77 101.832   4.738   8.521
  617    HE3  TRP  77           HE3      TRP  77  98.072   7.655  10.840
  618    HZ2  TRP  77           HZ2      TRP  77 100.515   6.444   6.693
  619    HZ3  TRP  77           HZ3      TRP  77  97.429   8.684   8.675
  620    HH2  TRP  77           HH2      TRP  77  98.634   8.074   6.594
  621    H    ALA  78           HN       ALA  78  97.078   6.520  12.941
  622    HA   ALA  78           HA       ALA  78  95.891   6.295  10.250
  623    HB1  ALA  78           HB1      ALA  78  94.481   4.874  11.645
  624    HB2  ALA  78           HB2      ALA  78  93.617   6.342  11.189
  625    HB3  ALA  78           HB3      ALA  78  94.289   6.184  12.811
  626    H    ARG  79           HN       ARG  79  95.831   8.373   9.445
  627    HA   ARG  79           HA       ARG  79  94.980  10.521  11.205
  628    HB2  ARG  79           HB2      ARG  79  97.560  10.188  11.355
  629    HB3  ARG  79           HB1      ARG  79  97.587  10.926   9.755
  630    HG2  ARG  79           HG2      ARG  79  96.569  12.942  10.578
  631    HG3  ARG  79           HG1      ARG  79  96.220  12.199  12.140
  632    HD2  ARG  79           HD2      ARG  79  98.397  12.383  12.868
  633    HD3  ARG  79           HD1      ARG  79  99.068  12.211  11.249
  634    HE   ARG  79           HE       ARG  79  98.456  14.666  12.559
  635   HH11  ARG  79          HH21      ARG  79  98.340  13.038   9.509
  636   HH12  ARG  79          HH22      ARG  79  98.496  14.487   8.572
  637   HH21  ARG  79          HH11      ARG  79  98.651  16.575  11.337
  638   HH22  ARG  79          HH12      ARG  79  98.673  16.488   9.607
  639    H    ASP  80           HN       ASP  80  93.846  12.068  10.201
  640    HA   ASP  80           HA       ASP  80  92.783  13.222   8.545
  641    HB2  ASP  80           HB2      ASP  80  95.546  12.873   7.421
  642    HB3  ASP  80           HB1      ASP  80  94.304  13.752   6.532
  643    H    GLY  81           HN       GLY  81  91.918  10.584   8.474
  644    HA2  GLY  81           HA2      GLY  81  90.570   9.406   7.031
  645    HA3  GLY  81           HA1      GLY  81  91.124  10.429   5.717
  646    H    LEU  82           HN       LEU  82  94.018   9.734   6.374
  647    HA   LEU  82           HA       LEU  82  94.018   7.276   4.805
  648    HB2  LEU  82           HB2      LEU  82  96.504   8.679   5.731
  649    HB3  LEU  82           HB1      LEU  82  96.212   7.789   4.237
  650    HG   LEU  82           HG       LEU  82  95.045  10.490   4.970
  651   HD11  LEU  82          HD11      LEU  82  97.334  10.734   4.291
  652   HD12  LEU  82          HD12      LEU  82  96.351  11.149   2.887
  653   HD13  LEU  82          HD13      LEU  82  97.134   9.571   2.980
  654   HD21  LEU  82          HD21      LEU  82  93.386   9.324   3.696
  655   HD22  LEU  82          HD22      LEU  82  94.600   8.631   2.622
  656   HD23  LEU  82          HD23      LEU  82  94.235  10.354   2.544
  657    H    LEU  83           HN       LEU  83  95.235   5.427   5.390
  658    HA   LEU  83           HA       LEU  83  95.628   5.074   8.329
  659    HB2  LEU  83           HB2      LEU  83  94.695   3.005   6.361
  660    HB3  LEU  83           HB1      LEU  83  94.792   2.859   8.113
  661    HG   LEU  83           HG       LEU  83  93.034   4.852   6.655
  662   HD11  LEU  83          HD11      LEU  83  92.121   2.707   6.186
  663   HD12  LEU  83          HD12      LEU  83  91.211   3.287   7.582
  664   HD13  LEU  83          HD13      LEU  83  92.501   2.106   7.800
  665   HD21  LEU  83          HD21      LEU  83  91.948   4.824   9.018
  666   HD22  LEU  83          HD22      LEU  83  93.458   5.711   8.823
  667   HD23  LEU  83          HD23      LEU  83  93.466   4.105   9.552
  668    H    GLY  84           HN       GLY  84  97.643   4.212   8.879
  669    HA2  GLY  84           HA2      GLY  84  99.387   3.388   6.671
  670    HA3  GLY  84           HA1      GLY  84  99.893   3.808   8.301
  671    H    PHE  85           HN       PHE  85 100.545   1.435   6.783
  672    HA   PHE  85           HA       PHE  85  99.660  -0.545   8.766
  673    HB2  PHE  85           HB2      PHE  85  99.222  -0.667   5.795
  674    HB3  PHE  85           HB1      PHE  85  99.394  -2.137   6.742
  675    HD1  PHE  85           HD2      PHE  85  97.855  -2.494   8.738
  676    HD2  PHE  85           HD1      PHE  85  97.184   0.536   5.775
  677    HE1  PHE  85           HE2      PHE  85  95.487  -2.326   9.450
  678    HE2  PHE  85           HE1      PHE  85  94.813   0.699   6.485
  679    HZ   PHE  85           HZ       PHE  85  93.971  -0.724   8.320
  680    H    GLU  86           HN       GLU  86 101.265  -1.975   9.323
  681    HA   GLU  86           HA       GLU  86 103.793  -1.739   7.832
  682    HB2  GLU  86           HB2      GLU  86 103.784  -1.267  10.306
  683    HB3  GLU  86           HB1      GLU  86 103.292  -2.937  10.574
  684    HG2  GLU  86           HG2      GLU  86 105.349  -3.637   9.250
  685    HG3  GLU  86           HG1      GLU  86 105.875  -1.957   9.339
  686    H    CYS  87           HN       CYS  87 104.441  -3.455   6.619
  687    HA   CYS  87           HA       CYS  87 102.756  -5.753   6.385
  688    HB2  CYS  87           HB2      CYS  87 104.266  -4.582   4.597
  689    HB3  CYS  87           HB1      CYS  87 105.515  -5.656   5.226
  690    HG   CYS  87           HG       CYS  87 102.844  -6.671   3.950
  691    H    GLN  88           HN       GLN  88 102.797  -7.581   7.466
  692    HA   GLN  88           HA       GLN  88 105.114  -8.196   9.176
  693    HB2  GLN  88           HB2      GLN  88 102.481  -9.657   9.210
  694    HB3  GLN  88           HB1      GLN  88 103.667  -9.487  10.503
  695    HG2  GLN  88           HG2      GLN  88 101.931  -7.276   9.369
  696    HG3  GLN  88           HG1      GLN  88 101.749  -8.035  10.950
  697   HE21  GLN  88          HE21      GLN  88 102.390  -5.157  10.290
  698   HE22  GLN  88          HE22      GLN  88 103.852  -4.837  11.094
  699    H    HIS  89           HN       HIS  89 103.206  -9.409   6.482
  700    HA   HIS  89           HA       HIS  89 105.330 -11.180   5.711
  701    HB2  HIS  89           HB2      HIS  89 104.565 -13.186   6.410
  702    HB3  HIS  89           HB1      HIS  89 103.532 -12.276   7.507
  703    HD2  HIS  89           HD2      HIS  89 100.977 -13.246   7.243
  704    HE1  HIS  89           HE1      HIS  89 101.018 -14.006   3.090
  705    HE2  HIS  89           HE2      HIS  89  99.601 -14.098   5.194
  706    H    ILE  90           HN       ILE  90 105.230 -11.702   3.584
  707    HA   ILE  90           HA       ILE  90 102.802 -11.207   2.005
  708    HB   ILE  90           HB       ILE  90 103.817  -9.012   1.973
  709   HG12  ILE  90          HG12      ILE  90 104.596 -10.533  -0.540
  710   HG13  ILE  90          HG11      ILE  90 102.987  -9.909  -0.191
  711   HG21  ILE  90          HG21      ILE  90 106.226  -8.840   1.109
  712   HG22  ILE  90          HG22      ILE  90 106.356 -10.564   1.451
  713   HG23  ILE  90          HG23      ILE  90 106.022  -9.430   2.757
  714   HD11  ILE  90          HD11      ILE  90 105.528  -8.314  -0.587
  715   HD12  ILE  90          HD12      ILE  90 104.034  -7.618   0.036
  716   HD13  ILE  90          HD13      ILE  90 104.080  -8.288  -1.593
  717    H    ASP  91           HN       ASP  91 102.614 -12.333   0.234
  718    HA   ASP  91           HA       ASP  91 103.899 -14.783   0.031
  719    HB2  ASP  91           HB2      ASP  91 102.921 -13.821  -2.553
  720    HB3  ASP  91           HB1      ASP  91 102.375 -15.180  -1.575
  721    H    LEU  92           HN       LEU  92 105.526 -15.609  -1.071
  722    HA   LEU  92           HA       LEU  92 107.796 -14.102  -1.667
  723    HB2  LEU  92           HB2      LEU  92 107.727 -16.597  -1.313
  724    HB3  LEU  92           HB1      LEU  92 107.112 -16.751  -2.957
  725    HG   LEU  92           HG       LEU  92 109.176 -15.387  -3.678
  726   HD11  LEU  92          HD11      LEU  92 110.017 -14.511  -1.648
  727   HD12  LEU  92          HD12      LEU  92 111.118 -15.835  -2.019
  728   HD13  LEU  92          HD13      LEU  92 109.854 -16.054  -0.810
  729   HD21  LEU  92          HD21      LEU  92 109.456 -18.170  -2.504
  730   HD22  LEU  92          HD22      LEU  92 110.622 -17.435  -3.604
  731   HD23  LEU  92          HD23      LEU  92 108.979 -17.767  -4.153
  732    H    ASP  93           HN       ASP  93 105.236 -15.247  -3.827
  733    HA   ASP  93           HA       ASP  93 106.394 -14.212  -6.218
  734    HB2  ASP  93           HB2      ASP  93 104.204 -14.625  -7.218
  735    HB3  ASP  93           HB1      ASP  93 104.674 -15.997  -6.214
  736    H    SER  94           HN       SER  94 104.057 -13.004  -3.857
  737    HA   SER  94           HA       SER  94 103.357 -10.622  -5.223
  738    HB2  SER  94           HB2      SER  94 103.208 -11.552  -2.375
  739    HB3  SER  94           HB1      SER  94 102.867  -9.870  -2.761
  740    HG   SER  94           HG       SER  94 101.505 -10.995  -4.516
  741    H    ILE  95           HN       ILE  95 105.960 -11.477  -3.020
  742    HA   ILE  95           HA       ILE  95 106.954  -8.912  -2.456
  743    HB   ILE  95           HB       ILE  95 108.268 -11.627  -2.624
  744   HG12  ILE  95          HG12      ILE  95 107.766  -9.717  -0.320
  745   HG13  ILE  95          HG11      ILE  95 106.736 -11.085  -0.729
  746   HG21  ILE  95          HG21      ILE  95 109.518  -8.919  -2.159
  747   HG22  ILE  95          HG22      ILE  95 110.082 -10.228  -3.196
  748   HG23  ILE  95          HG23      ILE  95 110.215 -10.373  -1.446
  749   HD11  ILE  95          HD11      ILE  95 108.964 -12.466  -0.568
  750   HD12  ILE  95          HD12      ILE  95 108.123 -12.008   0.912
  751   HD13  ILE  95          HD13      ILE  95 109.528 -11.089   0.376
  752    H    SER  96           HN       SER  96 107.424 -11.074  -5.181
  753    HA   SER  96           HA       SER  96 109.478  -9.479  -6.356
  754    HB2  SER  96           HB2      SER  96 108.466 -12.025  -6.847
  755    HB3  SER  96           HB1      SER  96 107.939 -11.109  -8.259
  756    HG   SER  96           HG       SER  96 110.192 -12.142  -8.120
  757    H    HIS  97           HN       HIS  97 105.960  -9.640  -6.874
  758    HA   HIS  97           HA       HIS  97 105.979  -7.865  -9.072
  759    HB2  HIS  97           HB2      HIS  97 103.878  -8.590  -7.033
  760    HB3  HIS  97           HB1      HIS  97 103.585  -7.348  -8.234
  761    HD2  HIS  97           HD2      HIS  97 103.938 -11.232  -8.053
  762    HE1  HIS  97           HE1      HIS  97 102.945 -10.187 -12.019
  763    HE2  HIS  97           HE2      HIS  97 103.249 -12.127 -10.408
  764    H    LEU  98           HN       LEU  98 106.006  -7.341  -5.600
  765    HA   LEU  98           HA       LEU  98 105.689  -4.470  -5.722
  766    HB2  LEU  98           HB2      LEU  98 106.346  -6.498  -3.648
  767    HB3  LEU  98           HB1      LEU  98 107.058  -4.905  -3.399
  768    HG   LEU  98           HG       LEU  98 104.763  -3.912  -3.722
  769   HD11  LEU  98          HD11      LEU  98 103.412  -6.447  -3.091
  770   HD12  LEU  98          HD12      LEU  98 104.127  -6.426  -4.702
  771   HD13  LEU  98          HD13      LEU  98 102.961  -5.188  -4.240
  772   HD21  LEU  98          HD21      LEU  98 105.200  -5.913  -1.487
  773   HD22  LEU  98          HD22      LEU  98 103.927  -4.693  -1.475
  774   HD23  LEU  98          HD23      LEU  98 105.620  -4.200  -1.477
  775    H    ARG  99           HN       ARG  99 108.432  -6.658  -5.974
  776    HA   ARG  99           HA       ARG  99 110.424  -4.640  -5.739
  777    HB2  ARG  99           HB2      ARG  99 110.325  -7.403  -6.896
  778    HB3  ARG  99           HB1      ARG  99 111.702  -6.373  -7.280
  779    HG2  ARG  99           HG2      ARG  99 112.388  -6.231  -5.043
  780    HG3  ARG  99           HG1      ARG  99 110.798  -6.683  -4.424
  781    HD2  ARG  99           HD2      ARG  99 112.825  -8.432  -4.516
  782    HD3  ARG  99           HD1      ARG  99 111.153  -8.928  -4.752
  783    HE   ARG  99           HE       ARG  99 111.759  -8.486  -7.258
  784   HH11  ARG  99          HH21      ARG  99 113.811  -9.793  -4.785
  785   HH12  ARG  99          HH22      ARG  99 114.745 -10.753  -5.882
  786   HH21  ARG  99          HH11      ARG  99 112.978  -9.747  -8.690
  787   HH22  ARG  99          HH12      ARG  99 114.274 -10.728  -8.089
  788    H    ARG 100           HN       ARG 100 108.478  -5.870  -8.385
  789    HA   ARG 100           HA       ARG 100 109.736  -4.606 -10.577
  790    HB2  ARG 100           HB2      ARG 100 106.852  -5.369 -10.132
  791    HB3  ARG 100           HB1      ARG 100 107.519  -4.837 -11.672
  792    HG2  ARG 100           HG2      ARG 100 109.118  -6.698 -11.650
  793    HG3  ARG 100           HG1      ARG 100 108.509  -7.222 -10.083
  794    HD2  ARG 100           HD2      ARG 100 106.182  -7.140 -11.485
  795    HD3  ARG 100           HD1      ARG 100 107.308  -7.544 -12.778
  796    HE   ARG 100           HE       ARG 100 106.400  -9.315 -10.775
  797   HH11  ARG 100          HH21      ARG 100 109.288  -8.302 -12.393
  798   HH12  ARG 100          HH22      ARG 100 110.095  -9.822 -12.199
  799   HH21  ARG 100          HH11      ARG 100 107.452 -11.311 -10.520
  800   HH22  ARG 100          HH12      ARG 100 109.055 -11.525 -11.140
  801    H    LEU 101           HN       LEU 101 107.077  -3.521  -8.466
  802    HA   LEU 101           HA       LEU 101 106.631  -1.067  -9.795
  803    HB2  LEU 101           HB2      LEU 101 105.854  -2.278  -7.205
  804    HB3  LEU 101           HB1      LEU 101 105.886  -0.517  -7.210
  805    HG   LEU 101           HG       LEU 101 104.514  -2.010  -9.441
  806   HD11  LEU 101          HD11      LEU 101 103.476  -1.456  -6.658
  807   HD12  LEU 101          HD12      LEU 101 103.422  -2.968  -7.564
  808   HD13  LEU 101          HD13      LEU 101 102.390  -1.619  -8.039
  809   HD21  LEU 101          HD21      LEU 101 103.814   0.627  -8.131
  810   HD22  LEU 101          HD22      LEU 101 103.330   0.042  -9.723
  811   HD23  LEU 101          HD23      LEU 101 105.002   0.518  -9.429
  812    H    VAL 102           HN       VAL 102 108.851  -2.051  -7.271
  813    HA   VAL 102           HA       VAL 102 109.760   0.547  -6.548
  814    HB   VAL 102           HB       VAL 102 111.061  -2.174  -6.311
  815   HG11  VAL 102          HG11      VAL 102 112.835  -0.590  -6.194
  816   HG12  VAL 102          HG12      VAL 102 112.418  -0.938  -4.515
  817   HG13  VAL 102          HG13      VAL 102 111.857   0.552  -5.273
  818   HG21  VAL 102          HG21      VAL 102 109.999  -0.600  -3.996
  819   HG22  VAL 102          HG22      VAL 102 110.059  -2.345  -4.232
  820   HG23  VAL 102          HG23      VAL 102 108.828  -1.389  -5.054
  821    H    GLU 103           HN       GLU 103 110.899  -1.893  -8.845
  822    HA   GLU 103           HA       GLU 103 113.256  -0.554  -9.639
  823    HB2  GLU 103           HB2      GLU 103 111.535  -2.648 -10.959
  824    HB3  GLU 103           HB1      GLU 103 113.004  -2.029 -11.712
  825    HG2  GLU 103           HG2      GLU 103 114.263  -2.646  -9.634
  826    HG3  GLU 103           HG1      GLU 103 112.792  -3.394  -9.016
  827    H    LEU 104           HN       LEU 104 109.974  -0.559 -11.054
  828    HA   LEU 104           HA       LEU 104 110.705   1.110 -13.242
  829    HB2  LEU 104           HB2      LEU 104 107.992   0.546 -12.025
  830    HB3  LEU 104           HB1      LEU 104 108.253   1.365 -13.563
  831    HG   LEU 104           HG       LEU 104 109.433  -1.363 -13.028
  832   HD11  LEU 104          HD11      LEU 104 107.022  -1.563 -12.634
  833   HD12  LEU 104          HD12      LEU 104 107.440  -2.311 -14.176
  834   HD13  LEU 104          HD13      LEU 104 106.686  -0.717 -14.144
  835   HD21  LEU 104          HD21      LEU 104 108.766   0.289 -15.478
  836   HD22  LEU 104          HD22      LEU 104 109.117  -1.435 -15.576
  837   HD23  LEU 104          HD23      LEU 104 110.342  -0.320 -14.976
  838    H    ASN 105           HN       ASN 105 109.179   1.799 -10.085
  839    HA   ASN 105           HA       ASN 105 108.776   4.557 -10.613
  840    HB2  ASN 105           HB2      ASN 105 108.952   2.975  -8.048
  841    HB3  ASN 105           HB1      ASN 105 108.583   4.698  -8.093
  842   HD21  ASN 105          HD21      ASN 105 107.498   1.858 -10.055
  843   HD22  ASN 105          HD22      ASN 105 105.845   2.209  -9.899
  844    H    LEU 106           HN       LEU 106 111.530   2.708  -9.573
  845    HA   LEU 106           HA       LEU 106 113.047   4.661  -8.278
  846    HB2  LEU 106           HB2      LEU 106 113.623   2.215  -8.509
  847    HB3  LEU 106           HB1      LEU 106 114.134   2.556 -10.160
  848    HG   LEU 106           HG       LEU 106 115.620   4.407  -9.082
  849   HD11  LEU 106          HD11      LEU 106 116.367   3.663  -6.757
  850   HD12  LEU 106          HD12      LEU 106 114.907   2.678  -6.701
  851   HD13  LEU 106          HD13      LEU 106 114.784   4.431  -6.841
  852   HD21  LEU 106          HD21      LEU 106 116.448   2.304 -10.132
  853   HD22  LEU 106          HD22      LEU 106 116.259   1.484  -8.582
  854   HD23  LEU 106          HD23      LEU 106 117.429   2.792  -8.750
  855    H    GLY 107           HN       GLY 107 112.330   4.197 -11.661
  856    HA2  GLY 107           HA2      GLY 107 112.397   6.061 -13.181
  857    HA3  GLY 107           HA1      GLY 107 113.763   6.706 -12.275
  858    H    ASP 108           HN       ASP 108 113.522   6.124 -15.151
  859    HA   ASP 108           HA       ASP 108 115.128   3.793 -15.689
  860    HB2  ASP 108           HB2      ASP 108 114.251   6.110 -17.423
  861    HB3  ASP 108           HB1      ASP 108 115.169   4.728 -18.019
  862    H    GLU 109           HN       GLU 109 115.666   7.297 -15.596
  863    HA   GLU 109           HA       GLU 109 118.236   7.478 -16.566
  864    HB2  GLU 109           HB2      GLU 109 116.953   9.445 -15.908
  865    HB3  GLU 109           HB1      GLU 109 117.026   8.958 -14.216
  866    HG2  GLU 109           HG2      GLU 109 118.716  10.700 -14.772
  867    HG3  GLU 109           HG1      GLU 109 119.458   9.204 -14.213
  868    H    GLU 110           HN       GLU 110 120.187   6.777 -15.945
  869    HA   GLU 110           HA       GLU 110 120.400   5.206 -13.494
  870    HB2  GLU 110           HB2      GLU 110 122.281   5.660 -15.817
  871    HB3  GLU 110           HB1      GLU 110 122.689   4.681 -14.408
  872    HG2  GLU 110           HG2      GLU 110 120.196   4.190 -16.044
  873    HG3  GLU 110           HG1      GLU 110 121.735   3.418 -16.421
  874    H    LEU 111           HN       LEU 111 120.205   7.040 -12.042
  875    HA   LEU 111           HA       LEU 111 121.942   9.242 -11.993
  876    HB2  LEU 111           HB2      LEU 111 120.316   7.813  -9.910
  877    HB3  LEU 111           HB1      LEU 111 121.413   9.108  -9.431
  878    HG   LEU 111           HG       LEU 111 119.556   9.600 -11.735
  879   HD11  LEU 111          HD11      LEU 111 118.778   9.508  -8.813
  880   HD12  LEU 111          HD12      LEU 111 117.979   8.724 -10.176
  881   HD13  LEU 111          HD13      LEU 111 117.894  10.475  -9.994
  882   HD21  LEU 111          HD21      LEU 111 121.388  11.185 -10.843
  883   HD22  LEU 111          HD22      LEU 111 120.337  11.416  -9.446
  884   HD23  LEU 111          HD23      LEU 111 119.776  11.869 -11.054
  885    H    LEU 112           HN       LEU 112 123.992   9.536 -11.311
  886    HA   LEU 112           HA       LEU 112 125.784   7.408 -11.055
  887    HB2  LEU 112           HB2      LEU 112 125.871  10.335 -10.488
  888    HB3  LEU 112           HB1      LEU 112 127.149   9.343  -9.789
  889    HG   LEU 112           HG       LEU 112 127.694  10.272 -12.069
  890   HD11  LEU 112          HD11      LEU 112 128.376   7.875 -11.000
  891   HD12  LEU 112          HD12      LEU 112 128.959   8.429 -12.568
  892   HD13  LEU 112          HD13      LEU 112 127.588   7.326 -12.479
  893   HD21  LEU 112          HD21      LEU 112 126.492   9.664 -13.972
  894   HD22  LEU 112          HD22      LEU 112 125.195   9.803 -12.786
  895   HD23  LEU 112          HD23      LEU 112 125.827   8.215 -13.219
  896    H    GLU 113           HN       GLU 113 123.672   8.847  -8.731
  897    HA   GLU 113           HA       GLU 113 124.741   7.027  -6.667
  898    HB2  GLU 113           HB2      GLU 113 124.724   9.932  -6.602
  899    HB3  GLU 113           HB1      GLU 113 123.756   9.272  -5.285
  900    HG2  GLU 113           HG2      GLU 113 125.658   7.799  -4.657
  901    HG3  GLU 113           HG1      GLU 113 126.625   8.534  -5.934
  902    H    ARG 114           HN       ARG 114 123.099   6.972  -4.761
  903    HA   ARG 114           HA       ARG 114 120.378   7.541  -5.195
  904    HB2  ARG 114           HB2      ARG 114 119.626   5.128  -5.560
  905    HB3  ARG 114           HB1      ARG 114 120.317   5.956  -6.955
  906    HG2  ARG 114           HG2      ARG 114 122.563   4.930  -6.273
  907    HG3  ARG 114           HG1      ARG 114 121.646   3.914  -5.163
  908    HD2  ARG 114           HD2      ARG 114 120.858   4.076  -8.064
  909    HD3  ARG 114           HD1      ARG 114 122.168   3.015  -7.560
  910    HE   ARG 114           HE       ARG 114 120.144   2.380  -5.844
  911   HH11  ARG 114          HH21      ARG 114 120.452   2.671  -9.278
  912   HH12  ARG 114          HH22      ARG 114 119.276   1.448  -9.627
  913   HH21  ARG 114          HH11      ARG 114 118.603   0.772  -6.293
  914   HH22  ARG 114          HH12      ARG 114 118.229   0.372  -7.936
  915    H    GLU 115           HN       GLU 115 118.958   6.135  -3.711
  916    HA   GLU 115           HA       GLU 115 120.116   6.204  -1.091
  917    HB2  GLU 115           HB2      GLU 115 117.439   5.281  -2.145
  918    HB3  GLU 115           HB1      GLU 115 117.854   5.288  -0.434
  919    HG2  GLU 115           HG2      GLU 115 118.441   7.753  -0.713
  920    HG3  GLU 115           HG1      GLU 115 117.695   7.659  -2.305
  921    H    LEU 116           HN       LEU 116 121.540   4.387  -2.704
  922    HA   LEU 116           HA       LEU 116 120.698   1.708  -2.352
  923    HB2  LEU 116           HB2      LEU 116 122.988   3.109  -3.455
  924    HB3  LEU 116           HB1      LEU 116 123.499   1.676  -2.569
  925    HG   LEU 116           HG       LEU 116 121.243   1.585  -4.583
  926   HD11  LEU 116          HD11      LEU 116 124.167   0.956  -5.087
  927   HD12  LEU 116          HD12      LEU 116 123.361   2.422  -5.643
  928   HD13  LEU 116          HD13      LEU 116 122.847   0.849  -6.253
  929   HD21  LEU 116          HD21      LEU 116 121.996  -0.836  -4.643
  930   HD22  LEU 116          HD22      LEU 116 121.322  -0.323  -3.097
  931   HD23  LEU 116          HD23      LEU 116 123.069  -0.468  -3.294
  932    H    ALA 117           HN       ALA 117 122.834   3.793  -0.377
  933    HA   ALA 117           HA       ALA 117 123.619   1.665   1.360
  934    HB1  ALA 117           HB1      ALA 117 124.404   3.579   2.831
  935    HB2  ALA 117           HB2      ALA 117 123.800   4.673   1.586
  936    HB3  ALA 117           HB3      ALA 117 125.096   3.537   1.210
  937    H    LEU 118           HN       LEU 118 120.900   3.808   1.252
  938    HA   LEU 118           HA       LEU 118 120.158   3.828   3.941
  939    HB2  LEU 118           HB2      LEU 118 118.249   3.724   1.600
  940    HB3  LEU 118           HB1      LEU 118 117.909   4.345   3.213
  941    HG   LEU 118           HG       LEU 118 119.620   5.544   1.045
  942   HD11  LEU 118          HD11      LEU 118 118.351   7.532   1.566
  943   HD12  LEU 118          HD12      LEU 118 117.693   6.788   3.022
  944   HD13  LEU 118          HD13      LEU 118 117.213   6.194   1.436
  945   HD21  LEU 118          HD21      LEU 118 121.161   5.558   2.899
  946   HD22  LEU 118          HD22      LEU 118 119.885   6.021   4.028
  947   HD23  LEU 118          HD23      LEU 118 120.450   7.168   2.814
  948    H    LEU 119           HN       LEU 119 119.551   1.279   1.517
  949    HA   LEU 119           HA       LEU 119 117.704  -0.197   2.949
  950    HB2  LEU 119           HB2      LEU 119 119.932  -1.080   1.111
  951    HB3  LEU 119           HB1      LEU 119 118.739  -2.203   1.764
  952    HG   LEU 119           HG       LEU 119 117.753   0.314   0.461
  953   HD11  LEU 119          HD11      LEU 119 118.737  -2.141  -1.025
  954   HD12  LEU 119          HD12      LEU 119 119.384  -0.505  -1.158
  955   HD13  LEU 119          HD13      LEU 119 117.757  -0.860  -1.739
  956   HD21  LEU 119          HD21      LEU 119 116.325  -1.478   1.637
  957   HD22  LEU 119          HD22      LEU 119 116.710  -2.520   0.268
  958   HD23  LEU 119          HD23      LEU 119 115.828  -1.015   0.010
  959    H    VAL 120           HN       VAL 120 120.878   0.547   3.831
  960    HA   VAL 120           HA       VAL 120 121.837  -1.661   5.223
  961    HB   VAL 120           HB       VAL 120 122.039   1.301   5.687
  962   HG11  VAL 120          HG11      VAL 120 123.984   0.564   7.236
  963   HG12  VAL 120          HG12      VAL 120 123.143  -0.984   7.324
  964   HG13  VAL 120          HG13      VAL 120 122.347   0.486   7.887
  965   HG21  VAL 120          HG21      VAL 120 124.244  -0.640   5.017
  966   HG22  VAL 120          HG22      VAL 120 124.131   1.081   4.646
  967   HG23  VAL 120          HG23      VAL 120 123.154  -0.080   3.748
  968    H    SER 121           HN       SER 121 119.033   0.226   5.825
  969    HA   SER 121           HA       SER 121 118.901  -0.182   8.680
  970    HB2  SER 121           HB2      SER 121 116.967   1.090   8.616
  971    HB3  SER 121           HB1      SER 121 117.784   1.674   7.169
  972    HG   SER 121           HG       SER 121 115.563   0.006   7.447
  973    H    ALA 122           HN       ALA 122 117.705  -1.778   5.799
  974    HA   ALA 122           HA       ALA 122 117.129  -4.183   7.266
  975    HB1  ALA 122           HB1      ALA 122 115.084  -2.722   7.647
  976    HB2  ALA 122           HB2      ALA 122 114.772  -4.301   6.926
  977    HB3  ALA 122           HB3      ALA 122 114.777  -2.856   5.915
  978    H    HIS 123           HN       HIS 123 116.533  -5.956   5.843
  979    HA   HIS 123           HA       HIS 123 117.280  -5.434   3.023
  980    HB2  HIS 123           HB2      HIS 123 118.232  -7.670   2.956
  981    HB3  HIS 123           HB1      HIS 123 118.955  -6.761   4.283
  982    HD2  HIS 123           HD2      HIS 123 118.021  -7.566   6.909
  983    HE1  HIS 123           HE1      HIS 123 116.254 -11.151   5.550
  984    HE2  HIS 123           HE2      HIS 123 116.968  -9.851   7.611
  985    H    ASP 124           HN       ASP 124 115.617  -7.950   4.949
  986    HA   ASP 124           HA       ASP 124 113.671  -9.106   4.573
  987    HB2  ASP 124           HB2      ASP 124 112.804  -6.913   2.701
  988    HB3  ASP 124           HB1      ASP 124 111.817  -7.905   3.774
  989    H    ASP 125           HN       ASP 125 116.049  -9.072   2.628
  990    HA   ASP 125           HA       ASP 125 114.766 -10.780   0.622
  991    HB2  ASP 125           HB2      ASP 125 114.839  -8.540  -0.409
  992    HB3  ASP 125           HB1      ASP 125 116.577  -8.469  -0.120
  993   H5'1  C2E 501          H5'1      C2E 501 104.354   0.860  11.464
  994   H5'2  C2E 501          H5'2      C2E 501 105.881   1.012  12.355
  995    H4'  C2E 501           H4'      C2E 501 106.731  -0.096  10.554
  996    H3'  C2E 501           H3'      C2E 501 106.559   2.765   9.633
  997    H2'  C2E 501           H2'      C2E 501 107.055   2.168   7.408
  998   HO2'  C2E 501          HO2'      C2E 501 108.396   0.572   7.046
  999    H1'  C2E 501           H1'      C2E 501 105.442   0.000   7.228
 1000    H8   C2E 501           H8       C2E 501 103.729   2.414   9.584
 1001    HN1  C2E 501           HN1      C2E 501 103.179   4.111   3.437
 1002   HN21  C2E 501          HN21      C2E 501 104.498   2.844   2.179
 1003   HN22  C2E 501          HN22      C2E 501 105.500   1.578   2.851
 1004   H511  C2E 501          H511      C2E 501 107.955   4.423  10.154
 1005   H512  C2E 501          H512      C2E 501 109.444   5.377  10.258
 1006    H4A  C2E 501           H4A      C2E 501 108.621   5.096  12.923
 1007    H3A  C2E 501           H3A      C2E 501 106.159   5.444  11.179
 1008    H2A  C2E 501           H2A      C2E 501 105.376   7.112  12.626
 1009   HO2A  C2E 501          HO2A      C2E 501 106.413   7.550  14.620
 1010    H1A  C2E 501           H1A      C2E 501 107.647   8.527  12.792
 1011    H81  C2E 501           H81      C2E 501 107.990   6.898   9.436
 1012   HN11  C2E 501          HN11      C2E 501 103.891  11.806   9.285
 1013   HN24  C2E 501          HN24      C2E 501 104.013  11.623  12.771
 1014   HN23  C2E 501          HN23      C2E 501 103.349  12.409  11.355
 1015   H5'1  C2E 502          H5'1      C2E 502 101.273  10.858   4.583
 1016   H5'2  C2E 502          H5'2      C2E 502  99.625  11.460   4.311
 1017    H4'  C2E 502           H4'      C2E 502  99.444  12.248   6.557
 1018    H3'  C2E 502           H3'      C2E 502 102.418  11.754   6.739
 1019    H2'  C2E 502           H2'      C2E 502 102.096  11.363   9.089
 1020   HO2'  C2E 502          HO2'      C2E 502 100.387  13.152   9.102
 1021    H1'  C2E 502           H1'      C2E 502  99.938   9.774   8.804
 1022    H8   C2E 502           H8       C2E 502 102.128   8.960   5.808
 1023    HN1  C2E 502           HN1      C2E 502 103.922   6.106  11.243
 1024   HN21  C2E 502          HN21      C2E 502 102.816   6.968  12.967
 1025   HN22  C2E 502          HN22      C2E 502 101.639   8.249  12.779
 1026   H511  C2E 502          H511      C2E 502 104.060  16.622   6.605
 1027   H512  C2E 502          H512      C2E 502 102.553  15.978   5.925
 1028    H4A  C2E 502           H4A      C2E 502 104.016  16.325   4.081
 1029    H3A  C2E 502           H3A      C2E 502 103.869  13.411   4.895
 1030    H2A  C2E 502           H2A      C2E 502 105.439  12.836   3.258
 1031   HO2A  C2E 502          HO2A      C2E 502 105.427  13.819   1.385
 1032    H1A  C2E 502           H1A      C2E 502 107.099  15.015   3.504
 1033    H81  C2E 502           H81      C2E 502 106.339  14.246   7.042
 1034   HN11  C2E 502          HN11      C2E 502 110.349  10.007   4.407
 1035   HN24  C2E 502          HN24      C2E 502 110.317  10.203   2.193
 1036   HN23  C2E 502          HN23      C2E 502 109.313  11.375   1.369
  Start of MODEL   13
    1    H    MET   1           H        MET   1 113.628  28.017   3.069
    2    HA   MET   1           HA       MET   1 115.767  26.744   3.475
    3    HB2  MET   1           HB2      MET   1 115.390  29.284   3.499
    4    HB3  MET   1           HB1      MET   1 115.312  29.150   5.255
    5    HG2  MET   1           HG2      MET   1 117.555  28.452   5.427
    6    HG3  MET   1           HG1      MET   1 117.639  27.987   3.729
    7    HE1  MET   1           HE1      MET   1 120.163  30.750   3.477
    8    HE2  MET   1           HE2      MET   1 119.728  29.057   3.254
    9    HE3  MET   1           HE3      MET   1 119.988  29.687   4.880
   10    H    SER   2           HN       SER   2 113.568  25.617   5.246
   11    HA   SER   2           HA       SER   2 115.267  24.457   7.218
   12    HB2  SER   2           HB2      SER   2 113.095  26.192   8.377
   13    HB3  SER   2           HB1      SER   2 114.417  25.386   9.215
   14    HG   SER   2           HG       SER   2 114.350  27.795   7.922
   15    H    ASP   3           HN       ASP   3 113.064  24.006   5.120
   16    HA   ASP   3           HA       ASP   3 111.191  22.509   6.813
   17    HB2  ASP   3           HB2      ASP   3 111.087  23.225   3.868
   18    HB3  ASP   3           HB1      ASP   3 109.902  22.192   4.665
   19    H    GLN   4           HN       GLN   4 111.853  20.573   7.310
   20    HA   GLN   4           HA       GLN   4 113.309  18.966   5.293
   21    HB2  GLN   4           HB2      GLN   4 113.255  18.075   8.128
   22    HB3  GLN   4           HB1      GLN   4 114.574  18.042   6.959
   23    HG2  GLN   4           HG2      GLN   4 115.257  19.682   8.508
   24    HG3  GLN   4           HG1      GLN   4 114.564  20.627   7.191
   25   HE21  GLN   4          HE21      GLN   4 111.920  19.204   8.545
   26   HE22  GLN   4          HE22      GLN   4 111.507  20.384   9.693
   27    H    HIS   5           HN       HIS   5 110.314  19.456   5.980
   28    HA   HIS   5           HA       HIS   5 108.377  18.230   6.243
   29    HB2  HIS   5           HB2      HIS   5 108.583  16.033   4.742
   30    HB3  HIS   5           HB1      HIS   5 108.472  17.636   4.022
   31    HD2  HIS   5           HD2      HIS   5 111.259  14.924   4.753
   32    HE1  HIS   5           HE1      HIS   5 112.778  17.710   1.968
   33    HE2  HIS   5           HE2      HIS   5 113.241  15.518   3.161
   34    H    ASP   6           HN       ASP   6 110.785  17.565   8.047
   35    HA   ASP   6           HA       ASP   6 111.399  15.944   9.593
   36    HB2  ASP   6           HB2      ASP   6 108.390  15.705   9.770
   37    HB3  ASP   6           HB1      ASP   6 109.557  15.328  11.036
   38    H    GLU   7           HN       GLU   7 112.295  14.402   8.030
   39    HA   GLU   7           HA       GLU   7 110.499  12.282   7.162
   40    HB2  GLU   7           HB2      GLU   7 111.934  12.010   5.458
   41    HB3  GLU   7           HB1      GLU   7 112.788  13.417   6.060
   42    HG2  GLU   7           HG2      GLU   7 113.360  10.594   7.005
   43    HG3  GLU   7           HG1      GLU   7 114.241  11.390   5.707
   44    H    ARG   8           HN       ARG   8 110.234  10.402   8.118
   45    HA   ARG   8           HA       ARG   8 112.138   9.623  10.247
   46    HB2  ARG   8           HB2      ARG   8 109.133   9.553  10.237
   47    HB3  ARG   8           HB1      ARG   8 110.097   8.547  11.307
   48    HG2  ARG   8           HG2      ARG   8 109.683  10.447  12.615
   49    HG3  ARG   8           HG1      ARG   8 111.301  10.730  11.987
   50    HD2  ARG   8           HD2      ARG   8 109.512  12.646  11.890
   51    HD3  ARG   8           HD1      ARG   8 110.587  12.397  10.526
   52    HE   ARG   8           HE       ARG   8 108.580  10.958   9.668
   53   HH11  ARG   8          HH21      ARG   8 108.422  13.874  11.541
   54   HH12  ARG   8          HH22      ARG   8 106.922  14.392  10.850
   55   HH21  ARG   8          HH11      ARG   8 106.630  11.652   8.752
   56   HH22  ARG   8          HH12      ARG   8 105.912  13.139   9.274
   57    H    ARG   9           HN       ARG   9 110.700   8.775   7.309
   58    HA   ARG   9           HA       ARG   9 111.096   5.880   7.820
   59    HB2  ARG   9           HB2      ARG   9 109.760   5.725   5.558
   60    HB3  ARG   9           HB1      ARG   9 108.906   5.967   7.072
   61    HG2  ARG   9           HG2      ARG   9 108.909   8.415   6.658
   62    HG3  ARG   9           HG1      ARG   9 109.680   8.116   5.099
   63    HD2  ARG   9           HD2      ARG   9 107.774   7.140   4.195
   64    HD3  ARG   9           HD1      ARG   9 107.146   6.662   5.765
   65    HE   ARG   9           HE       ARG   9 106.561   9.020   6.143
   66   HH11  ARG   9          HH21      ARG   9 107.349   8.031   2.904
   67   HH12  ARG   9          HH22      ARG   9 106.483   9.331   2.160
   68   HH21  ARG   9          HH11      ARG   9 105.434  10.716   5.155
   69   HH22  ARG   9          HH12      ARG   9 105.403  10.846   3.428
   70    H    ARG  10           HN       ARG  10 113.197   5.660   7.421
   71    HA   ARG  10           HA       ARG  10 115.239   6.150   6.270
   72    HB2  ARG  10           HB2      ARG  10 114.195   4.373   4.144
   73    HB3  ARG  10           HB1      ARG  10 115.594   4.185   5.189
   74    HG2  ARG  10           HG2      ARG  10 114.264   2.507   6.042
   75    HG3  ARG  10           HG1      ARG  10 113.702   3.836   7.051
   76    HD2  ARG  10           HD2      ARG  10 111.942   4.247   5.208
   77    HD3  ARG  10           HD1      ARG  10 112.388   2.659   4.599
   78    HE   ARG  10           HE       ARG  10 110.946   3.231   7.072
   79   HH11  ARG  10          HH21      ARG  10 112.697   0.975   5.114
   80   HH12  ARG  10          HH22      ARG  10 112.021  -0.423   5.880
   81   HH21  ARG  10          HH11      ARG  10 110.054   1.401   8.076
   82   HH22  ARG  10          HH12      ARG  10 110.525  -0.183   7.556
   83    H    PHE  11           HN       PHE  11 112.945   5.743   3.563
   84    HA   PHE  11           HA       PHE  11 113.503   8.437   2.617
   85    HB2  PHE  11           HB2      PHE  11 113.930   7.138   0.269
   86    HB3  PHE  11           HB1      PHE  11 115.227   7.684   1.325
   87    HD1  PHE  11           HD2      PHE  11 116.240   6.091   2.978
   88    HD2  PHE  11           HD1      PHE  11 113.485   4.808  -0.057
   89    HE1  PHE  11           HE2      PHE  11 116.984   3.748   3.296
   90    HE2  PHE  11           HE1      PHE  11 114.230   2.462   0.261
   91    HZ   PHE  11           HZ       PHE  11 115.979   1.934   1.939
   92    H    HIS  12           HN       HIS  12 112.227   8.815   0.515
   93    HA   HIS  12           HA       HIS  12 109.545   8.540   0.912
   94    HB2  HIS  12           HB2      HIS  12 109.392   8.625  -1.685
   95    HB3  HIS  12           HB1      HIS  12 110.132   9.979  -0.833
   96    HD2  HIS  12           HD2      HIS  12 112.325   6.769  -1.288
   97    HE1  HIS  12           HE1      HIS  12 113.735   9.683  -3.995
   98    HE2  HIS  12           HE2      HIS  12 114.204   7.401  -2.985
   99    H    ARG  13           HN       ARG  13 107.905   7.222  -0.186
  100    HA   ARG  13           HA       ARG  13 108.789   4.408  -0.428
  101    HB2  ARG  13           HB2      ARG  13 105.952   5.251   0.139
  102    HB3  ARG  13           HB1      ARG  13 106.735   3.707   0.466
  103    HG2  ARG  13           HG2      ARG  13 107.932   4.558   2.310
  104    HG3  ARG  13           HG1      ARG  13 107.696   6.232   1.812
  105    HD2  ARG  13           HD2      ARG  13 105.360   4.469   2.539
  106    HD3  ARG  13           HD1      ARG  13 106.251   5.370   3.763
  107    HE   ARG  13           HE       ARG  13 105.367   6.975   1.516
  108   HH11  ARG  13          HH21      ARG  13 104.627   5.655   4.627
  109   HH12  ARG  13          HH22      ARG  13 103.456   6.871   5.017
  110   HH21  ARG  13          HH11      ARG  13 103.833   8.573   2.018
  111   HH22  ARG  13          HH12      ARG  13 103.008   8.523   3.540
  112    H    ILE  14           HN       ILE  14 107.972   3.145  -2.105
  113    HA   ILE  14           HA       ILE  14 107.669   4.331  -4.605
  114    HB   ILE  14           HB       ILE  14 106.822   1.633  -3.562
  115   HG12  ILE  14          HG12      ILE  14 108.770   0.839  -4.736
  116   HG13  ILE  14          HG11      ILE  14 109.005   2.400  -5.521
  117   HG21  ILE  14          HG21      ILE  14 106.761   1.117  -6.125
  118   HG22  ILE  14          HG22      ILE  14 106.494   2.852  -6.295
  119   HG23  ILE  14          HG23      ILE  14 105.353   1.870  -5.377
  120   HD11  ILE  14          HD11      ILE  14 109.630   3.439  -3.453
  121   HD12  ILE  14          HD12      ILE  14 110.530   1.926  -3.537
  122   HD13  ILE  14          HD13      ILE  14 109.099   2.040  -2.517
  123    H    ALA  15           HN       ALA  15 106.177   5.999  -4.554
  124    HA   ALA  15           HA       ALA  15 103.413   5.352  -3.819
  125    HB1  ALA  15           HB1      ALA  15 104.828   7.943  -4.415
  126    HB2  ALA  15           HB2      ALA  15 104.134   7.405  -2.884
  127    HB3  ALA  15           HB3      ALA  15 103.077   7.838  -4.229
  128    H    PHE  16           HN       PHE  16 102.038   4.711  -5.235
  129    HA   PHE  16           HA       PHE  16 101.836   5.975  -7.833
  130    HB2  PHE  16           HB2      PHE  16 101.965   4.016  -9.162
  131    HB3  PHE  16           HB1      PHE  16 103.381   3.959  -8.119
  132    HD1  PHE  16           HD2      PHE  16 102.958   2.744  -5.770
  133    HD2  PHE  16           HD1      PHE  16 100.670   2.092  -9.347
  134    HE1  PHE  16           HE2      PHE  16 102.250   0.529  -4.919
  135    HE2  PHE  16           HE1      PHE  16  99.970  -0.128  -8.495
  136    HZ   PHE  16           HZ       PHE  16 100.766  -0.912  -6.281
  137    H    ASP  17           HN       ASP  17  99.694   5.475  -8.825
  138    HA   ASP  17           HA       ASP  17  97.756   5.028  -6.675
  139    HB2  ASP  17           HB2      ASP  17  97.598   6.247  -9.423
  140    HB3  ASP  17           HB1      ASP  17  96.140   5.812  -8.533
  141    H    ALA  18           HN       ALA  18  96.107   3.511  -6.777
  142    HA   ALA  18           HA       ALA  18  95.492   1.869  -8.938
  143    HB1  ALA  18           HB1      ALA  18  96.512  -0.290  -8.059
  144    HB2  ALA  18           HB2      ALA  18  97.537   0.711  -7.030
  145    HB3  ALA  18           HB3      ALA  18  97.656   0.839  -8.785
  146    H    ASP  19           HN       ASP  19  94.404  -0.252  -8.067
  147    HA   ASP  19           HA       ASP  19  92.624   0.642  -5.884
  148    HB2  ASP  19           HB2      ASP  19  91.739  -1.824  -7.013
  149    HB3  ASP  19           HB1      ASP  19  91.016  -0.228  -7.187
  150    H    SER  20           HN       SER  20  92.535  -0.338  -3.940
  151    HA   SER  20           HA       SER  20  93.888  -2.939  -3.614
  152    HB2  SER  20           HB2      SER  20  95.518  -1.435  -2.768
  153    HB3  SER  20           HB1      SER  20  94.298  -0.448  -1.963
  154    HG   SER  20           HG       SER  20  94.569  -3.177  -1.333
  155    H    GLU  21           HN       GLU  21  93.117  -4.194  -1.883
  156    HA   GLU  21           HA       GLU  21  90.570  -3.309  -0.654
  157    HB2  GLU  21           HB2      GLU  21  91.103  -6.049  -1.849
  158    HB3  GLU  21           HB1      GLU  21  89.626  -5.537  -1.029
  159    HG2  GLU  21           HG2      GLU  21  89.164  -3.898  -2.743
  160    HG3  GLU  21           HG1      GLU  21  90.724  -4.187  -3.507
  161    H    ILE  22           HN       ILE  22  90.141  -4.274   1.397
  162    HA   ILE  22           HA       ILE  22  92.418  -5.777   2.532
  163    HB   ILE  22           HB       ILE  22  91.088  -3.323   3.680
  164   HG12  ILE  22          HG12      ILE  22  94.005  -4.004   3.214
  165   HG13  ILE  22          HG11      ILE  22  93.017  -3.104   2.065
  166   HG21  ILE  22          HG21      ILE  22  92.641  -3.780   5.649
  167   HG22  ILE  22          HG22      ILE  22  92.839  -5.407   5.005
  168   HG23  ILE  22          HG23      ILE  22  91.246  -4.852   5.517
  169   HD11  ILE  22          HD11      ILE  22  92.599  -1.370   3.730
  170   HD12  ILE  22          HD12      ILE  22  94.336  -1.607   3.547
  171   HD13  ILE  22          HD13      ILE  22  93.496  -2.286   4.941
  172    H    LEU  23           HN       LEU  23  91.954  -7.395   3.830
  173    HA   LEU  23           HA       LEU  23  89.119  -7.832   4.583
  174    HB2  LEU  23           HB2      LEU  23  90.983 -10.118   4.125
  175    HB3  LEU  23           HB1      LEU  23  89.235 -10.025   3.917
  176    HG   LEU  23           HG       LEU  23  89.904  -8.255   2.042
  177   HD11  LEU  23          HD11      LEU  23  91.957  -9.260   0.853
  178   HD12  LEU  23          HD12      LEU  23  92.365  -9.962   2.418
  179   HD13  LEU  23          HD13      LEU  23  92.260  -8.211   2.237
  180   HD21  LEU  23          HD21      LEU  23  90.150 -11.263   1.686
  181   HD22  LEU  23          HD22      LEU  23  89.812 -10.106   0.400
  182   HD23  LEU  23          HD23      LEU  23  88.636 -10.358   1.691
  183    H    GLN  24           HN       GLN  24  88.811  -7.936   6.647
  184    HA   GLN  24           HA       GLN  24  90.956  -9.027   8.392
  185    HB2  GLN  24           HB2      GLN  24  91.025  -6.679   8.810
  186    HB3  GLN  24           HB1      GLN  24  89.266  -6.565   8.858
  187    HG2  GLN  24           HG2      GLN  24  89.123  -7.636  10.942
  188    HG3  GLN  24           HG1      GLN  24  90.718  -8.367  10.784
  189   HE21  GLN  24          HE21      GLN  24  88.999  -5.603  11.980
  190   HE22  GLN  24          HE22      GLN  24  90.358  -4.716  12.479
  191    H    GLY  25           HN       GLY  25  90.069 -11.011   8.801
  192    HA2  GLY  25           HA2      GLY  25  88.721 -12.455  10.017
  193    HA3  GLY  25           HA1      GLY  25  87.685 -11.093  10.442
  194    H    GLU  26           HN       GLU  26  85.686 -11.459   9.714
  195    HA   GLU  26           HA       GLU  26  85.293 -12.851   7.143
  196    HB2  GLU  26           HB2      GLU  26  83.060 -13.276   7.890
  197    HB3  GLU  26           HB1      GLU  26  84.128 -13.629   9.244
  198    HG2  GLU  26           HG2      GLU  26  82.521 -12.340  10.310
  199    HG3  GLU  26           HG1      GLU  26  83.692 -11.101   9.867
  200    H    ARG  27           HN       ARG  27  85.940  -9.855   7.916
  201    HA   ARG  27           HA       ARG  27  83.758  -8.604   6.357
  202    HB2  ARG  27           HB2      ARG  27  85.683  -7.396   8.323
  203    HB3  ARG  27           HB1      ARG  27  84.414  -6.540   7.447
  204    HG2  ARG  27           HG2      ARG  27  82.701  -7.553   8.639
  205    HG3  ARG  27           HG1      ARG  27  83.664  -8.982   9.013
  206    HD2  ARG  27           HD2      ARG  27  84.903  -7.849  10.673
  207    HD3  ARG  27           HD1      ARG  27  84.360  -6.273  10.111
  208    HE   ARG  27           HE       ARG  27  82.962  -8.014  11.924
  209   HH11  ARG  27          HH21      ARG  27  82.645  -5.598   9.468
  210   HH12  ARG  27          HH22      ARG  27  81.105  -5.036  10.026
  211   HH21  ARG  27          HH11      ARG  27  80.941  -7.283  12.661
  212   HH22  ARG  27          HH12      ARG  27  80.140  -5.990  11.833
  213    H    ARG  28           HN       ARG  28  84.218  -7.582   4.495
  214    HA   ARG  28           HA       ARG  28  87.045  -7.005   3.798
  215    HB2  ARG  28           HB2      ARG  28  86.501  -8.933   2.497
  216    HB3  ARG  28           HB1      ARG  28  84.910  -8.294   2.087
  217    HG2  ARG  28           HG2      ARG  28  85.754  -6.801   0.521
  218    HG3  ARG  28           HG1      ARG  28  87.305  -6.653   1.344
  219    HD2  ARG  28           HD2      ARG  28  88.173  -8.542   0.355
  220    HD3  ARG  28           HD1      ARG  28  86.601  -9.313   0.176
  221    HE   ARG  28           HE       ARG  28  87.815  -7.365  -1.652
  222   HH11  ARG  28          HH21      ARG  28  85.072  -9.239  -0.671
  223   HH12  ARG  28          HH22      ARG  28  84.284  -9.144  -2.210
  224   HH21  ARG  28          HH11      ARG  28  86.781  -7.235  -3.671
  225   HH22  ARG  28          HH12      ARG  28  85.249  -8.009  -3.905
  226    H    TRP  29           HN       TRP  29  87.384  -5.227   2.497
  227    HA   TRP  29           HA       TRP  29  85.118  -3.500   1.837
  228    HB2  TRP  29           HB2      TRP  29  87.445  -2.647   3.559
  229    HB3  TRP  29           HB1      TRP  29  86.148  -1.596   2.988
  230    HD1  TRP  29           HD1      TRP  29  83.593  -2.499   3.793
  231    HE1  TRP  29           HE1      TRP  29  82.923  -3.334   6.153
  232    HE3  TRP  29           HE3      TRP  29  88.183  -3.746   5.594
  233    HZ2  TRP  29           HZ2      TRP  29  84.207  -4.396   8.497
  234    HZ3  TRP  29           HZ3      TRP  29  88.451  -4.659   7.875
  235    HH2  TRP  29           HH2      TRP  29  86.469  -4.995   9.334
  236    H    GLU  30           HN       GLU  30  85.695  -1.808   0.375
  237    HA   GLU  30           HA       GLU  30  88.063  -2.456  -1.231
  238    HB2  GLU  30           HB2      GLU  30  85.891  -0.522  -2.022
  239    HB3  GLU  30           HB1      GLU  30  86.974  -1.454  -3.058
  240    HG2  GLU  30           HG2      GLU  30  85.863  -3.546  -2.108
  241    HG3  GLU  30           HG1      GLU  30  84.648  -2.473  -1.415
  242    H    VAL  31           HN       VAL  31  89.719  -0.924  -1.488
  243    HA   VAL  31           HA       VAL  31  89.302   1.813  -0.501
  244    HB   VAL  31           HB       VAL  31  91.445   1.601   0.832
  245   HG11  VAL  31          HG11      VAL  31  89.156   1.668   1.828
  246   HG12  VAL  31          HG12      VAL  31  90.292   0.711   2.781
  247   HG13  VAL  31          HG13      VAL  31  89.109  -0.094   1.753
  248   HG21  VAL  31          HG21      VAL  31  90.795  -1.354   0.602
  249   HG22  VAL  31          HG22      VAL  31  92.111  -0.635   1.530
  250   HG23  VAL  31          HG23      VAL  31  92.134  -0.565  -0.232
  251    H    LEU  32           HN       LEU  32  90.970   3.265  -1.094
  252    HA   LEU  32           HA       LEU  32  92.354   2.450  -3.565
  253    HB2  LEU  32           HB2      LEU  32  92.716   4.951  -3.802
  254    HB3  LEU  32           HB1      LEU  32  91.033   4.437  -3.881
  255    HG   LEU  32           HG       LEU  32  92.305   5.336  -1.289
  256   HD11  LEU  32          HD11      LEU  32  92.531   7.128  -3.004
  257   HD12  LEU  32          HD12      LEU  32  91.424   7.572  -1.706
  258   HD13  LEU  32          HD13      LEU  32  90.788   7.059  -3.268
  259   HD21  LEU  32          HD21      LEU  32  90.278   4.771  -0.478
  260   HD22  LEU  32          HD22      LEU  32  89.705   4.350  -2.090
  261   HD23  LEU  32          HD23      LEU  32  89.551   6.006  -1.503
  262    H    LEU  33           HN       LEU  33  94.530   2.243  -3.577
  263    HA   LEU  33           HA       LEU  33  95.930   2.781  -1.054
  264    HB2  LEU  33           HB2      LEU  33  96.328   0.579  -1.876
  265    HB3  LEU  33           HB1      LEU  33  96.619   1.156  -3.513
  266    HG   LEU  33           HG       LEU  33  98.427   2.344  -1.490
  267   HD11  LEU  33          HD11      LEU  33  99.759   0.384  -1.109
  268   HD12  LEU  33          HD12      LEU  33  98.767  -0.578  -2.202
  269   HD13  LEU  33          HD13      LEU  33  98.106  -0.033  -0.660
  270   HD21  LEU  33          HD21      LEU  33  98.863   0.888  -4.121
  271   HD22  LEU  33          HD22      LEU  33 100.087   1.806  -3.242
  272   HD23  LEU  33          HD23      LEU  33  98.693   2.632  -3.933
  273    H    HIS  34           HN       HIS  34  97.148   4.480  -0.794
  274    HA   HIS  34           HA       HIS  34  97.679   6.211  -3.082
  275    HB2  HIS  34           HB2      HIS  34  97.955   6.561  -0.090
  276    HB3  HIS  34           HB1      HIS  34  98.383   7.822  -1.256
  277    HD2  HIS  34           HD2      HIS  34  95.103   5.576  -0.925
  278    HE1  HIS  34           HE1      HIS  34  93.965   9.604  -1.426
  279    HE2  HIS  34           HE2      HIS  34  93.104   7.237  -1.148
  280    H    ASP  35           HN       ASP  35  99.481   4.084  -0.961
  281    HA   ASP  35           HA       ASP  35 101.625   4.123  -2.760
  282    HB2  ASP  35           HB2      ASP  35 103.370   5.326  -1.603
  283    HB3  ASP  35           HB1      ASP  35 101.965   6.395  -1.639
  284    H    VAL  36           HN       VAL  36 103.494   2.833  -2.063
  285    HA   VAL  36           HA       VAL  36 103.016   1.136   0.273
  286    HB   VAL  36           HB       VAL  36 101.882   0.161  -1.818
  287   HG11  VAL  36          HG11      VAL  36 103.276  -0.859  -3.475
  288   HG12  VAL  36          HG12      VAL  36 104.735  -0.537  -2.542
  289   HG13  VAL  36          HG13      VAL  36 103.858   0.795  -3.293
  290   HG21  VAL  36          HG21      VAL  36 102.420  -2.062  -1.173
  291   HG22  VAL  36          HG22      VAL  36 102.648  -1.104   0.284
  292   HG23  VAL  36          HG23      VAL  36 104.044  -1.608  -0.664
  293    H    SER  37           HN       SER  37 104.829  -0.465   0.537
  294    HA   SER  37           HA       SER  37 107.385   0.417  -0.572
  295    HB2  SER  37           HB2      SER  37 107.074   1.625   1.609
  296    HB3  SER  37           HB1      SER  37 106.919   0.060   2.405
  297    HG   SER  37           HG       SER  37 109.097   1.180   2.212
  298    H    LEU  38           HN       LEU  38 109.095  -1.273   0.069
  299    HA   LEU  38           HA       LEU  38 108.077  -3.814  -0.630
  300    HB2  LEU  38           HB2      LEU  38 110.544  -4.415   0.387
  301    HB3  LEU  38           HB1      LEU  38 110.280  -3.794  -1.242
  302    HG   LEU  38           HG       LEU  38 110.557  -1.847   1.034
  303   HD11  LEU  38          HD11      LEU  38 112.834  -3.252  -0.392
  304   HD12  LEU  38          HD12      LEU  38 112.475  -3.317   1.334
  305   HD13  LEU  38          HD13      LEU  38 113.018  -1.807   0.602
  306   HD21  LEU  38          HD21      LEU  38 109.963  -1.345  -1.471
  307   HD22  LEU  38          HD22      LEU  38 111.679  -1.626  -1.756
  308   HD23  LEU  38          HD23      LEU  38 111.166  -0.340  -0.665
  309    H    HIS  39           HN       HIS  39 107.743  -2.230   2.237
  310    HA   HIS  39           HA       HIS  39 107.020  -4.674   3.618
  311    HB2  HIS  39           HB2      HIS  39 109.535  -4.291   3.970
  312    HB3  HIS  39           HB1      HIS  39 109.064  -2.900   4.945
  313    HD2  HIS  39           HD2      HIS  39 107.923  -3.541   7.454
  314    HE1  HIS  39           HE1      HIS  39 108.323  -7.728   7.085
  315    HE2  HIS  39           HE2      HIS  39 107.753  -5.840   8.684
  316    H    GLY  40           HN       GLY  40 105.464  -2.465   2.772
  317    HA2  GLY  40           HA2      GLY  40 103.992  -1.879   5.087
  318    HA3  GLY  40           HA1      GLY  40 105.048  -0.510   4.767
  319    H    ILE  41           HN       ILE  41 102.194  -0.402   4.680
  320    HA   ILE  41           HA       ILE  41 101.809   0.527   1.917
  321    HB   ILE  41           HB       ILE  41 100.732  -1.380   1.369
  322   HG12  ILE  41          HG12      ILE  41  98.628  -0.475   3.360
  323   HG13  ILE  41          HG11      ILE  41  98.858   0.275   1.777
  324   HG21  ILE  41          HG21      ILE  41 101.548  -2.744   3.103
  325   HG22  ILE  41          HG22      ILE  41  99.798  -2.921   3.216
  326   HG23  ILE  41          HG23      ILE  41 100.652  -1.866   4.341
  327   HD11  ILE  41          HD11      ILE  41  98.154  -2.621   2.319
  328   HD12  ILE  41          HD12      ILE  41  98.535  -1.971   0.724
  329   HD13  ILE  41          HD13      ILE  41  97.111  -1.399   1.591
  330    H    LEU  42           HN       LEU  42 100.252   2.054   1.640
  331    HA   LEU  42           HA       LEU  42  99.005   3.159   4.095
  332    HB2  LEU  42           HB2      LEU  42 100.948   4.441   2.721
  333    HB3  LEU  42           HB1      LEU  42  99.556   4.950   1.775
  334    HG   LEU  42           HG       LEU  42  99.669   5.195   4.788
  335   HD11  LEU  42          HD11      LEU  42 101.469   6.523   3.584
  336   HD12  LEU  42          HD12      LEU  42 100.322   7.495   4.505
  337   HD13  LEU  42          HD13      LEU  42 100.172   7.380   2.753
  338   HD21  LEU  42          HD21      LEU  42  97.422   5.337   4.112
  339   HD22  LEU  42          HD22      LEU  42  97.827   6.157   2.605
  340   HD23  LEU  42          HD23      LEU  42  97.935   7.020   4.137
  341    H    VAL  43           HN       VAL  43  96.824   3.551   3.950
  342    HA   VAL  43           HA       VAL  43  95.582   3.480   1.277
  343    HB   VAL  43           HB       VAL  43  93.886   1.883   2.014
  344   HG11  VAL  43          HG11      VAL  43  96.083   1.137   0.981
  345   HG12  VAL  43          HG12      VAL  43  95.252  -0.089   1.940
  346   HG13  VAL  43          HG13      VAL  43  96.637   0.771   2.615
  347   HG21  VAL  43          HG21      VAL  43  94.309   0.652   4.180
  348   HG22  VAL  43          HG22      VAL  43  93.829   2.336   4.390
  349   HG23  VAL  43          HG23      VAL  43  95.522   1.873   4.567
  350    H    GLY  44           HN       GLY  44  93.143   3.810   1.519
  351    HA2  GLY  44           HA2      GLY  44  92.725   6.188   3.245
  352    HA3  GLY  44           HA1      GLY  44  91.771   5.773   1.818
  353    H    GLN  45           HN       GLN  45  90.948   6.240   4.763
  354    HA   GLN  45           HA       GLN  45  90.102   3.612   5.568
  355    HB2  GLN  45           HB2      GLN  45  89.467   4.569   7.607
  356    HB3  GLN  45           HB1      GLN  45  90.887   5.483   7.110
  357    HG2  GLN  45           HG2      GLN  45  89.424   7.177   7.759
  358    HG3  GLN  45           HG1      GLN  45  89.138   7.108   6.023
  359   HE21  GLN  45          HE21      GLN  45  86.899   7.677   5.999
  360   HE22  GLN  45          HE22      GLN  45  85.701   6.757   6.776
  361    HA   PRO  46           HA       PRO  46  86.168   4.531   3.538
  362    HB2  PRO  46           HB2      PRO  46  85.186   1.998   3.340
  363    HB3  PRO  46           HB1      PRO  46  86.518   2.560   2.308
  364    HG2  PRO  46           HG2      PRO  46  86.604   0.847   4.744
  365    HG3  PRO  46           HG1      PRO  46  87.577   0.758   3.267
  366    HD2  PRO  46           HD2      PRO  46  88.409   1.950   5.677
  367    HD3  PRO  46           HD1      PRO  46  89.153   2.214   4.089
  368    H    GLN  47           HN       GLN  47  83.824   4.295   4.152
  369    HA   GLN  47           HA       GLN  47  83.434   4.741   6.918
  370    HB2  GLN  47           HB2      GLN  47  81.729   4.564   4.506
  371    HB3  GLN  47           HB1      GLN  47  80.914   4.216   6.029
  372    HG2  GLN  47           HG2      GLN  47  80.751   6.601   5.571
  373    HG3  GLN  47           HG1      GLN  47  81.816   6.356   6.953
  374   HE21  GLN  47          HE21      GLN  47  83.604   7.706   6.812
  375   HE22  GLN  47          HE22      GLN  47  84.403   8.119   5.373
  376    H    ASP  48           HN       ASP  48  82.848   1.896   4.891
  377    HA   ASP  48           HA       ASP  48  81.547   0.370   6.915
  378    HB2  ASP  48           HB2      ASP  48  82.864  -0.355   4.303
  379    HB3  ASP  48           HB1      ASP  48  82.131  -1.563   5.355
  380    H    TRP  49           HN       TRP  49  84.549   1.505   7.128
  381    HA   TRP  49           HA       TRP  49  86.189  -0.754   7.574
  382    HB2  TRP  49           HB2      TRP  49  86.980   1.604   7.323
  383    HB3  TRP  49           HB1      TRP  49  86.397   1.922   8.954
  384    HD1  TRP  49           HD1      TRP  49  87.704   0.933  10.934
  385    HE1  TRP  49           HE1      TRP  49  90.093  -0.123  11.160
  386    HE3  TRP  49           HE3      TRP  49  88.589  -0.059   6.068
  387    HZ2  TRP  49           HZ2      TRP  49  92.121  -1.276   9.338
  388    HZ3  TRP  49           HZ3      TRP  49  90.682  -1.133   5.316
  389    HH2  TRP  49           HH2      TRP  49  92.421  -1.749   6.955
  390    H    ASN  50           HN       ASN  50  84.334  -1.977   8.736
  391    HA   ASN  50           HA       ASN  50  84.224  -1.306  11.594
  392    HB2  ASN  50           HB2      ASN  50  82.097  -1.915  10.563
  393    HB3  ASN  50           HB1      ASN  50  82.775  -3.442  10.005
  394   HD21  ASN  50          HD21      ASN  50  84.152  -2.836  13.000
  395   HD22  ASN  50          HD22      ASN  50  83.066  -3.707  13.971
  396    H    GLY  51           HN       GLY  51  86.512  -1.762  11.901
  397    HA2  GLY  51           HA2      GLY  51  86.959  -4.629  12.421
  398    HA3  GLY  51           HA1      GLY  51  88.148  -3.741  11.477
  399    H    ASP  52           HN       ASP  52  88.724  -5.038  13.897
  400    HA   ASP  52           HA       ASP  52  88.943  -2.935  15.930
  401    HB2  ASP  52           HB2      ASP  52  88.225  -5.322  16.449
  402    HB3  ASP  52           HB1      ASP  52  89.900  -5.784  16.147
  403    HA   PRO  53           HA       PRO  53  92.953  -1.881  14.123
  404    HB2  PRO  53           HB2      PRO  53  93.163  -0.602  16.833
  405    HB3  PRO  53           HB1      PRO  53  93.568   0.071  15.244
  406    HG2  PRO  53           HG2      PRO  53  91.324   0.750  16.485
  407    HG3  PRO  53           HG1      PRO  53  91.373   0.528  14.727
  408    HD2  PRO  53           HD2      PRO  53  90.169  -1.236  16.809
  409    HD3  PRO  53           HD1      PRO  53  89.695  -1.003  15.112
  410    H    GLN  54           HN       GLN  54  92.322  -3.490  17.135
  411    HA   GLN  54           HA       GLN  54  95.088  -4.087  17.675
  412    HB2  GLN  54           HB2      GLN  54  92.515  -5.083  18.903
  413    HB3  GLN  54           HB1      GLN  54  94.109  -5.604  19.441
  414    HG2  GLN  54           HG2      GLN  54  94.152  -3.789  20.790
  415    HG3  GLN  54           HG1      GLN  54  94.289  -2.799  19.340
  416   HE21  GLN  54          HE21      GLN  54  92.767  -2.342  21.961
  417   HE22  GLN  54          HE22      GLN  54  91.180  -1.998  21.463
  418    H    ARG  55           HN       ARG  55  92.530  -5.589  15.858
  419    HA   ARG  55           HA       ARG  55  93.986  -8.132  15.770
  420    HB2  ARG  55           HB2      ARG  55  91.253  -7.233  14.914
  421    HB3  ARG  55           HB1      ARG  55  91.963  -8.637  14.123
  422    HG2  ARG  55           HG2      ARG  55  92.459  -9.382  16.634
  423    HG3  ARG  55           HG1      ARG  55  91.115  -8.295  16.981
  424    HD2  ARG  55           HD2      ARG  55  89.926  -9.583  15.026
  425    HD3  ARG  55           HD1      ARG  55  91.135 -10.821  15.350
  426    HE   ARG  55           HE       ARG  55  88.841 -10.251  16.946
  427   HH11  ARG  55          HH21      ARG  55  92.183 -11.139  17.076
  428   HH12  ARG  55          HH22      ARG  55  92.043 -11.978  18.585
  429   HH21  ARG  55          HH11      ARG  55  88.651 -11.354  18.924
  430   HH22  ARG  55          HH12      ARG  55  90.045 -12.099  19.630
  431    HA   PRO  56           HA       PRO  56  96.128  -7.240  12.089
  432    HB2  PRO  56           HB2      PRO  56  96.128  -9.702  10.840
  433    HB3  PRO  56           HB1      PRO  56  97.167  -9.286  12.215
  434    HG2  PRO  56           HG2      PRO  56  94.599 -10.798  12.176
  435    HG3  PRO  56           HG1      PRO  56  96.070 -11.094  13.120
  436    HD2  PRO  56           HD2      PRO  56  93.874  -9.909  14.201
  437    HD3  PRO  56           HD1      PRO  56  95.524  -9.505  14.725
  438    H    PHE  57           HN       PHE  57  96.028  -7.116   9.783
  439    HA   PHE  57           HA       PHE  57  93.320  -7.385   8.617
  440    HB2  PHE  57           HB2      PHE  57  95.239  -5.070   8.237
  441    HB3  PHE  57           HB1      PHE  57  93.689  -5.267   7.424
  442    HD1  PHE  57           HD2      PHE  57  95.246  -4.972  10.811
  443    HD2  PHE  57           HD1      PHE  57  91.701  -4.497   8.438
  444    HE1  PHE  57           HE2      PHE  57  94.110  -3.874  12.724
  445    HE2  PHE  57           HE1      PHE  57  90.565  -3.403  10.347
  446    HZ   PHE  57           HZ       PHE  57  91.767  -3.092  12.491
  447    H    GLU  58           HN       GLU  58  93.399  -7.747   6.254
  448    HA   GLU  58           HA       GLU  58  96.088  -8.525   5.304
  449    HB2  GLU  58           HB2      GLU  58  93.470  -9.822   4.482
  450    HB3  GLU  58           HB1      GLU  58  95.091 -10.329   4.009
  451    HG2  GLU  58           HG2      GLU  58  95.645 -10.875   6.317
  452    HG3  GLU  58           HG1      GLU  58  94.087 -10.260   6.867
  453    H    ALA  59           HN       ALA  59  96.710  -7.644   3.323
  454    HA   ALA  59           HA       ALA  59  94.692  -5.939   1.960
  455    HB1  ALA  59           HB1      ALA  59  96.236  -4.429   2.724
  456    HB2  ALA  59           HB2      ALA  59  96.956  -4.839   1.170
  457    HB3  ALA  59           HB3      ALA  59  97.569  -5.580   2.647
  458    H    ARG  60           HN       ARG  60  94.395  -6.128  -0.141
  459    HA   ARG  60           HA       ARG  60  96.191  -7.898  -1.700
  460    HB2  ARG  60           HB2      ARG  60  93.189  -7.733  -1.655
  461    HB3  ARG  60           HB1      ARG  60  94.026  -8.242  -3.117
  462    HG2  ARG  60           HG2      ARG  60  93.356 -10.163  -1.675
  463    HG3  ARG  60           HG1      ARG  60  95.097 -10.075  -1.918
  464    HD2  ARG  60           HD2      ARG  60  95.510  -9.548   0.273
  465    HD3  ARG  60           HD1      ARG  60  94.014  -8.640   0.454
  466    HE   ARG  60           HE       ARG  60  92.898 -10.931   0.448
  467   HH11  ARG  60          HH21      ARG  60  96.166 -10.405   1.499
  468   HH12  ARG  60          HH22      ARG  60  96.177 -11.766   2.568
  469   HH21  ARG  60          HH11      ARG  60  92.922 -12.707   1.851
  470   HH22  ARG  60          HH12      ARG  60  94.347 -13.066   2.768
  471    H    LEU  61           HN       LEU  61  97.107  -6.847  -3.409
  472    HA   LEU  61           HA       LEU  61  95.912  -4.261  -4.212
  473    HB2  LEU  61           HB2      LEU  61  98.730  -5.079  -4.852
  474    HB3  LEU  61           HB1      LEU  61  98.054  -3.461  -4.684
  475    HG   LEU  61           HG       LEU  61  98.380  -5.432  -2.399
  476   HD11  LEU  61          HD11      LEU  61 100.551  -4.641  -3.289
  477   HD12  LEU  61          HD12      LEU  61 100.228  -3.976  -1.688
  478   HD13  LEU  61          HD13      LEU  61 100.004  -2.973  -3.121
  479   HD21  LEU  61          HD21      LEU  61  97.943  -3.359  -1.042
  480   HD22  LEU  61          HD22      LEU  61  96.561  -3.862  -2.014
  481   HD23  LEU  61          HD23      LEU  61  97.566  -2.513  -2.542
  482    H    TYR  62           HN       TYR  62  95.413  -3.873  -6.308
  483    HA   TYR  62           HA       TYR  62  95.880  -6.085  -8.222
  484    HB2  TYR  62           HB2      TYR  62  93.535  -4.179  -8.282
  485    HB3  TYR  62           HB1      TYR  62  93.746  -5.666  -9.206
  486    HD1  TYR  62           HD1      TYR  62  93.504  -4.393  -5.691
  487    HD2  TYR  62           HD2      TYR  62  92.929  -7.703  -8.370
  488    HE1  TYR  62           HE1      TYR  62  92.418  -5.686  -3.868
  489    HE2  TYR  62           HE2      TYR  62  91.846  -8.991  -6.548
  490    HH   TYR  62           HH       TYR  62  90.533  -8.249  -4.304
  491    H    LEU  63           HN       LEU  63  97.391  -5.473  -9.616
  492    HA   LEU  63           HA       LEU  63  97.463  -2.668 -10.547
  493    HB2  LEU  63           HB2      LEU  63  99.531  -3.791  -9.515
  494    HB3  LEU  63           HB1      LEU  63  99.611  -4.742 -10.993
  495    HG   LEU  63           HG       LEU  63  99.471  -1.716 -11.007
  496   HD11  LEU  63          HD11      LEU  63 101.996  -2.005 -11.571
  497   HD12  LEU  63          HD12      LEU  63 101.834  -3.570 -10.774
  498   HD13  LEU  63          HD13      LEU  63 101.498  -2.085  -9.883
  499   HD21  LEU  63          HD21      LEU  63 100.692  -2.282 -13.272
  500   HD22  LEU  63          HD22      LEU  63  98.942  -2.458 -13.164
  501   HD23  LEU  63          HD23      LEU  63  99.980  -3.879 -13.041
  502    H    GLY  64           HN       GLY  64  98.707  -5.562 -12.146
  503    HA2  GLY  64           HA2      GLY  64  97.477  -4.797 -14.647
  504    HA3  GLY  64           HA1      GLY  64  98.473  -6.226 -14.361
  505    H    LEU  65           HN       LEU  65  96.409  -6.834 -15.877
  506    HA   LEU  65           HA       LEU  65  94.021  -7.347 -14.396
  507    HB2  LEU  65           HB2      LEU  65  94.556  -7.184 -17.056
  508    HB3  LEU  65           HB1      LEU  65  94.517  -8.935 -16.861
  509    HG   LEU  65           HG       LEU  65  92.333  -7.033 -15.956
  510   HD11  LEU  65          HD11      LEU  65  91.079  -7.746 -17.849
  511   HD12  LEU  65          HD12      LEU  65  92.214  -9.048 -18.205
  512   HD13  LEU  65          HD13      LEU  65  92.684  -7.370 -18.476
  513   HD21  LEU  65          HD21      LEU  65  92.206  -8.922 -14.544
  514   HD22  LEU  65          HD22      LEU  65  92.716 -10.025 -15.822
  515   HD23  LEU  65          HD23      LEU  65  91.098  -9.326 -15.854
  516    H    ASP  66           HN       ASP  66  96.936  -9.183 -15.181
  517    HA   ASP  66           HA       ASP  66  95.911 -11.633 -13.893
  518    HB2  ASP  66           HB2      ASP  66  97.021 -11.561 -16.188
  519    HB3  ASP  66           HB1      ASP  66  98.514 -11.203 -15.324
  520    H    VAL  67           HN       VAL  67  97.236  -8.845 -12.828
  521    HA   VAL  67           HA       VAL  67  99.277 -10.145 -11.132
  522    HB   VAL  67           HB       VAL  67  98.878  -7.310 -12.050
  523   HG11  VAL  67          HG11      VAL  67 100.897  -6.908 -10.395
  524   HG12  VAL  67          HG12      VAL  67 100.197  -8.269  -9.521
  525   HG13  VAL  67          HG13      VAL  67  99.243  -6.811  -9.794
  526   HG21  VAL  67          HG21      VAL  67 100.365  -9.151 -13.160
  527   HG22  VAL  67          HG22      VAL  67 101.448  -8.875 -11.794
  528   HG23  VAL  67          HG23      VAL  67 101.064  -7.553 -12.897
  529    H    LEU  68           HN       LEU  68  98.138 -11.035  -9.525
  530    HA   LEU  68           HA       LEU  68  96.552  -9.212  -7.814
  531    HB2  LEU  68           HB2      LEU  68  95.048 -10.906  -8.392
  532    HB3  LEU  68           HB1      LEU  68  96.308 -12.135  -8.479
  533    HG   LEU  68           HG       LEU  68  96.539 -12.089  -6.031
  534   HD11  LEU  68          HD11      LEU  68  95.996  -9.902  -5.356
  535   HD12  LEU  68          HD12      LEU  68  94.590 -10.824  -4.828
  536   HD13  LEU  68          HD13      LEU  68  94.514  -9.873  -6.312
  537   HD21  LEU  68          HD21      LEU  68  93.716 -12.437  -7.078
  538   HD22  LEU  68          HD22      LEU  68  94.239 -12.971  -5.482
  539   HD23  LEU  68          HD23      LEU  68  94.956 -13.682  -6.927
  540    H    ILE  69           HN       ILE  69  97.686  -8.582  -6.075
  541    HA   ILE  69           HA       ILE  69  99.773 -10.406  -5.032
  542    HB   ILE  69           HB       ILE  69  99.549  -7.389  -5.015
  543   HG12  ILE  69          HG12      ILE  69 102.076  -8.563  -5.865
  544   HG13  ILE  69          HG11      ILE  69 100.741  -9.248  -6.788
  545   HG21  ILE  69          HG21      ILE  69 101.004  -9.201  -3.192
  546   HG22  ILE  69          HG22      ILE  69 100.580  -7.507  -2.987
  547   HG23  ILE  69          HG23      ILE  69 102.008  -7.949  -3.920
  548   HD11  ILE  69          HD11      ILE  69 101.544  -7.254  -7.925
  549   HD12  ILE  69          HD12      ILE  69 101.373  -6.303  -6.448
  550   HD13  ILE  69          HD13      ILE  69  99.941  -6.927  -7.265
  551    H    ARG  70           HN       ARG  70  99.895 -10.839  -2.855
  552    HA   ARG  70           HA       ARG  70  97.700  -9.803  -1.164
  553    HB2  ARG  70           HB2      ARG  70  98.685 -12.641  -0.928
  554    HB3  ARG  70           HB1      ARG  70  97.191 -11.934  -0.311
  555    HG2  ARG  70           HG2      ARG  70  96.726 -11.465  -2.880
  556    HG3  ARG  70           HG1      ARG  70  97.873 -12.785  -3.108
  557    HD2  ARG  70           HD2      ARG  70  95.219 -12.837  -1.675
  558    HD3  ARG  70           HD1      ARG  70  95.762 -13.850  -3.010
  559    HE   ARG  70           HE       ARG  70  96.421 -14.189  -0.184
  560   HH11  ARG  70          HH21      ARG  70  97.046 -14.991  -3.495
  561   HH12  ARG  70          HH22      ARG  70  97.833 -16.488  -3.126
  562   HH21  ARG  70          HH11      ARG  70  97.452 -16.152   0.304
  563   HH22  ARG  70          HH12      ARG  70  98.063 -17.146  -0.976
  564    H    MET  71           HN       MET  71  98.317  -9.032   0.735
  565    HA   MET  71           HA       MET  71 100.871  -9.902   1.926
  566    HB2  MET  71           HB2      MET  71 100.262  -6.989   2.077
  567    HB3  MET  71           HB1      MET  71 101.816  -7.812   1.999
  568    HG2  MET  71           HG2      MET  71 100.975  -8.403  -0.465
  569    HG3  MET  71           HG1      MET  71 100.009  -6.950  -0.227
  570    HE1  MET  71           HE1      MET  71 101.096  -4.702   0.751
  571    HE2  MET  71           HE2      MET  71 102.829  -4.382   0.817
  572    HE3  MET  71           HE3      MET  71 102.111  -5.544   1.930
  573    H    GLU  72           HN       GLU  72 100.935  -9.695   4.183
  574    HA   GLU  72           HA       GLU  72  98.295  -9.294   5.432
  575    HB2  GLU  72           HB2      GLU  72  99.321 -11.480   5.888
  576    HB3  GLU  72           HB1      GLU  72 100.773 -10.685   6.499
  577    HG2  GLU  72           HG2      GLU  72  99.630  -9.794   8.376
  578    HG3  GLU  72           HG1      GLU  72  98.049 -10.127   7.672
  579    H    ILE  73           HN       ILE  73  98.022  -7.466   6.753
  580    HA   ILE  73           HA       ILE  73 100.495  -6.116   7.631
  581    HB   ILE  73           HB       ILE  73  99.465  -3.971   6.976
  582   HG12  ILE  73          HG12      ILE  73  97.374  -5.827   5.800
  583   HG13  ILE  73          HG11      ILE  73  97.125  -4.610   7.046
  584   HG21  ILE  73          HG21      ILE  73  99.363  -5.307   4.380
  585   HG22  ILE  73          HG22      ILE  73 100.725  -5.869   5.342
  586   HG23  ILE  73          HG23      ILE  73 100.546  -4.156   4.995
  587   HD11  ILE  73          HD11      ILE  73  97.662  -2.833   5.438
  588   HD12  ILE  73          HD12      ILE  73  96.340  -3.822   4.841
  589   HD13  ILE  73          HD13      ILE  73  97.963  -4.033   4.190
  590    H    SER  74           HN       SER  74 100.247  -4.626   9.321
  591    HA   SER  74           HA       SER  74  97.791  -4.913  10.971
  592    HB2  SER  74           HB2      SER  74  99.203  -4.751  12.956
  593    HB3  SER  74           HB1      SER  74  99.746  -6.097  11.958
  594    HG   SER  74           HG       SER  74 101.499  -4.811  12.611
  595    H    LEU  75           HN       LEU  75  97.140  -3.072  12.142
  596    HA   LEU  75           HA       LEU  75  97.531  -0.608  10.772
  597    HB2  LEU  75           HB2      LEU  75  95.557  -1.502  12.347
  598    HB3  LEU  75           HB1      LEU  75  96.468  -0.610  13.563
  599    HG   LEU  75           HG       LEU  75  96.425   1.385  12.040
  600   HD11  LEU  75          HD11      LEU  75  94.797  -0.539  10.403
  601   HD12  LEU  75          HD12      LEU  75  96.055   0.578   9.870
  602   HD13  LEU  75          HD13      LEU  75  94.461   1.189  10.310
  603   HD21  LEU  75          HD21      LEU  75  93.825   0.155  12.970
  604   HD22  LEU  75          HD22      LEU  75  93.941   1.813  12.378
  605   HD23  LEU  75          HD23      LEU  75  94.829   1.329  13.822
  606    H    ALA  76           HN       ALA  76  99.055   0.827  10.920
  607    HA   ALA  76           HA       ALA  76 100.912   0.695  13.188
  608    HB1  ALA  76           HB1      ALA  76 101.238   1.946  10.456
  609    HB2  ALA  76           HB2      ALA  76 102.009   0.476  11.043
  610    HB3  ALA  76           HB3      ALA  76 102.442   2.031  11.745
  611    H    TRP  77           HN       TRP  77  98.980   2.975  11.310
  612    HA   TRP  77           HA       TRP  77  98.460   4.632  13.626
  613    HB2  TRP  77           HB2      TRP  77  99.516   6.682  12.717
  614    HB3  TRP  77           HB1      TRP  77 100.729   5.429  13.008
  615    HD1  TRP  77           HD1      TRP  77 101.894   4.334  10.949
  616    HE1  TRP  77           HE1      TRP  77 101.780   4.720   8.404
  617    HE3  TRP  77           HE3      TRP  77  98.063   7.702  10.735
  618    HZ2  TRP  77           HZ2      TRP  77 100.450   6.428   6.570
  619    HZ3  TRP  77           HZ3      TRP  77  97.395   8.705   8.568
  620    HH2  TRP  77           HH2      TRP  77  98.564   8.060   6.476
  621    H    ALA  78           HN       ALA  78  97.163   6.648  12.911
  622    HA   ALA  78           HA       ALA  78  95.852   6.401  10.295
  623    HB1  ALA  78           HB1      ALA  78  94.606   4.893  11.854
  624    HB2  ALA  78           HB2      ALA  78  93.631   6.216  11.216
  625    HB3  ALA  78           HB3      ALA  78  94.258   6.297  12.861
  626    H    ARG  79           HN       ARG  79  95.637   8.471   9.508
  627    HA   ARG  79           HA       ARG  79  94.741  10.571  11.303
  628    HB2  ARG  79           HB2      ARG  79  96.886  11.180  11.779
  629    HB3  ARG  79           HB1      ARG  79  97.538  10.357  10.366
  630    HG2  ARG  79           HG2      ARG  79  96.936  12.189   8.921
  631    HG3  ARG  79           HG1      ARG  79  95.997  12.961  10.196
  632    HD2  ARG  79           HD2      ARG  79  97.839  13.877  11.165
  633    HD3  ARG  79           HD1      ARG  79  98.804  12.423  10.927
  634    HE   ARG  79           HE       ARG  79  99.730  13.555   9.145
  635   HH11  ARG  79          HH21      ARG  79  96.402  14.447   9.504
  636   HH12  ARG  79          HH22      ARG  79  96.385  15.462   8.102
  637   HH21  ARG  79          HH11      ARG  79  99.709  14.886   7.313
  638   HH22  ARG  79          HH12      ARG  79  98.254  15.711   6.863
  639    H    ASP  80           HN       ASP  80  93.440  12.001  10.355
  640    HA   ASP  80           HA       ASP  80  92.202  13.051   8.735
  641    HB2  ASP  80           HB2      ASP  80  94.993  13.081   7.636
  642    HB3  ASP  80           HB1      ASP  80  93.666  13.807   6.732
  643    H    GLY  81           HN       GLY  81  91.661  10.327   8.544
  644    HA2  GLY  81           HA2      GLY  81  90.588   8.933   7.062
  645    HA3  GLY  81           HA1      GLY  81  90.765  10.187   5.844
  646    H    LEU  82           HN       LEU  82  93.693   9.319   7.307
  647    HA   LEU  82           HA       LEU  82  94.376   7.546   5.035
  648    HB2  LEU  82           HB2      LEU  82  96.243   9.400   6.540
  649    HB3  LEU  82           HB1      LEU  82  96.628   8.438   5.116
  650    HG   LEU  82           HG       LEU  82  94.634  10.718   5.251
  651   HD11  LEU  82          HD11      LEU  82  96.173  11.920   3.869
  652   HD12  LEU  82          HD12      LEU  82  97.155  10.482   3.594
  653   HD13  LEU  82          HD13      LEU  82  97.133  11.243   5.185
  654   HD21  LEU  82          HD21      LEU  82  93.687   9.284   3.661
  655   HD22  LEU  82          HD22      LEU  82  95.252   8.648   3.155
  656   HD23  LEU  82          HD23      LEU  82  94.753  10.265   2.657
  657    H    LEU  83           HN       LEU  83  95.348   5.604   5.535
  658    HA   LEU  83           HA       LEU  83  95.829   5.076   8.436
  659    HB2  LEU  83           HB2      LEU  83  94.831   3.098   6.399
  660    HB3  LEU  83           HB1      LEU  83  94.944   2.891   8.144
  661    HG   LEU  83           HG       LEU  83  93.196   4.970   6.801
  662   HD11  LEU  83          HD11      LEU  83  92.696   2.115   7.615
  663   HD12  LEU  83          HD12      LEU  83  92.190   2.957   6.152
  664   HD13  LEU  83          HD13      LEU  83  91.384   3.290   7.685
  665   HD21  LEU  83          HD21      LEU  83  93.588   3.989   9.634
  666   HD22  LEU  83          HD22      LEU  83  92.093   4.783   9.139
  667   HD23  LEU  83          HD23      LEU  83  93.626   5.646   9.030
  668    H    GLY  84           HN       GLY  84  97.810   4.175   8.909
  669    HA2  GLY  84           HA2      GLY  84  99.510   3.408   6.653
  670    HA3  GLY  84           HA1      GLY  84 100.036   3.743   8.298
  671    H    PHE  85           HN       PHE  85 100.634   1.429   6.715
  672    HA   PHE  85           HA       PHE  85  99.677  -0.604   8.600
  673    HB2  PHE  85           HB2      PHE  85  99.230  -0.557   5.636
  674    HB3  PHE  85           HB1      PHE  85  99.440  -2.092   6.461
  675    HD1  PHE  85           HD2      PHE  85  97.943  -2.607   8.474
  676    HD2  PHE  85           HD1      PHE  85  97.175   0.601   5.725
  677    HE1  PHE  85           HE2      PHE  85  95.587  -2.517   9.238
  678    HE2  PHE  85           HE1      PHE  85  94.817   0.686   6.489
  679    HZ   PHE  85           HZ       PHE  85  94.030  -0.865   8.245
  680    H    GLU  86           HN       GLU  86 101.294  -1.953   9.205
  681    HA   GLU  86           HA       GLU  86 103.802  -1.774   7.679
  682    HB2  GLU  86           HB2      GLU  86 104.800  -2.774   9.768
  683    HB3  GLU  86           HB1      GLU  86 104.064  -1.191  10.011
  684    HG2  GLU  86           HG2      GLU  86 101.963  -2.368  10.753
  685    HG3  GLU  86           HG1      GLU  86 102.858  -3.883  10.689
  686    H    CYS  87           HN       CYS  87 104.474  -3.516   6.544
  687    HA   CYS  87           HA       CYS  87 102.791  -5.828   6.360
  688    HB2  CYS  87           HB2      CYS  87 104.217  -4.693   4.518
  689    HB3  CYS  87           HB1      CYS  87 105.546  -5.651   5.170
  690    HG   CYS  87           HG       CYS  87 104.484  -7.758   4.318
  691    H    GLN  88           HN       GLN  88 102.865  -7.637   7.492
  692    HA   GLN  88           HA       GLN  88 105.267  -8.220   9.104
  693    HB2  GLN  88           HB2      GLN  88 103.159 -10.025   9.752
  694    HB3  GLN  88           HB1      GLN  88 103.807  -8.719  10.741
  695    HG2  GLN  88           HG2      GLN  88 101.709  -8.294   8.601
  696    HG3  GLN  88           HG1      GLN  88 101.323  -8.581  10.296
  697   HE21  GLN  88          HE21      GLN  88 104.252  -6.797   9.575
  698   HE22  GLN  88          HE22      GLN  88 103.661  -5.274  10.032
  699    H    HIS  89           HN       HIS  89 103.209  -9.464   6.545
  700    HA   HIS  89           HA       HIS  89 105.259 -11.369   5.819
  701    HB2  HIS  89           HB2      HIS  89 104.384 -13.076   7.033
  702    HB3  HIS  89           HB1      HIS  89 102.879 -12.210   7.327
  703    HD2  HIS  89           HD2      HIS  89 100.949 -13.919   6.309
  704    HE1  HIS  89           HE1      HIS  89 102.813 -14.775   2.617
  705    HE2  HIS  89           HE2      HIS  89 100.717 -15.132   4.009
  706    H    ILE  90           HN       ILE  90 105.183 -11.856   3.690
  707    HA   ILE  90           HA       ILE  90 102.787 -11.295   2.080
  708    HB   ILE  90           HB       ILE  90 103.912  -9.153   2.080
  709   HG12  ILE  90          HG12      ILE  90 104.625 -10.700  -0.435
  710   HG13  ILE  90          HG11      ILE  90 103.047  -9.995  -0.094
  711   HG21  ILE  90          HG21      ILE  90 106.089  -9.753   2.879
  712   HG22  ILE  90          HG22      ILE  90 106.323  -9.070   1.272
  713   HG23  ILE  90          HG23      ILE  90 106.371 -10.816   1.504
  714   HD11  ILE  90          HD11      ILE  90 103.993  -8.282  -1.331
  715   HD12  ILE  90          HD12      ILE  90 105.625  -8.639  -0.769
  716   HD13  ILE  90          HD13      ILE  90 104.496  -7.799   0.289
  717    H    ASP  91           HN       ASP  91 102.589 -12.479   0.326
  718    HA   ASP  91           HA       ASP  91 103.842 -14.949   0.181
  719    HB2  ASP  91           HB2      ASP  91 101.865 -13.514  -1.300
  720    HB3  ASP  91           HB1      ASP  91 102.977 -14.253  -2.447
  721    H    LEU  92           HN       LEU  92 105.458 -15.832  -0.944
  722    HA   LEU  92           HA       LEU  92 107.780 -14.383  -1.491
  723    HB2  LEU  92           HB2      LEU  92 107.601 -16.888  -1.180
  724    HB3  LEU  92           HB1      LEU  92 107.036 -16.979  -2.847
  725    HG   LEU  92           HG       LEU  92 109.212 -15.552  -3.342
  726   HD11  LEU  92          HD11      LEU  92 109.878 -15.213  -1.022
  727   HD12  LEU  92          HD12      LEU  92 111.064 -16.250  -1.813
  728   HD13  LEU  92          HD13      LEU  92 109.863 -16.952  -0.730
  729   HD21  LEU  92          HD21      LEU  92 110.478 -17.720  -3.585
  730   HD22  LEU  92          HD22      LEU  92 108.854 -17.757  -4.275
  731   HD23  LEU  92          HD23      LEU  92 109.168 -18.518  -2.715
  732    H    ASP  93           HN       ASP  93 105.224 -15.437  -3.705
  733    HA   ASP  93           HA       ASP  93 106.443 -14.409  -6.064
  734    HB2  ASP  93           HB2      ASP  93 104.170 -14.660  -7.047
  735    HB3  ASP  93           HB1      ASP  93 104.718 -16.114  -6.216
  736    H    SER  94           HN       SER  94 104.057 -13.149  -3.773
  737    HA   SER  94           HA       SER  94 103.439 -10.761  -5.121
  738    HB2  SER  94           HB2      SER  94 103.024  -9.974  -2.644
  739    HB3  SER  94           HB1      SER  94 101.992 -11.207  -3.365
  740    HG   SER  94           HG       SER  94 102.992 -11.608  -1.202
  741    H    ILE  95           HN       ILE  95 106.046 -11.618  -2.903
  742    HA   ILE  95           HA       ILE  95 107.105  -9.058  -2.452
  743    HB   ILE  95           HB       ILE  95 108.409 -11.782  -2.554
  744   HG12  ILE  95          HG12      ILE  95 107.853  -9.912  -0.232
  745   HG13  ILE  95          HG11      ILE  95 106.777 -11.220  -0.713
  746   HG21  ILE  95          HG21      ILE  95 110.223 -10.355  -3.046
  747   HG22  ILE  95          HG22      ILE  95 110.284 -10.492  -1.289
  748   HG23  ILE  95          HG23      ILE  95 109.591  -9.054  -2.038
  749   HD11  ILE  95          HD11      ILE  95 108.075 -12.251   0.939
  750   HD12  ILE  95          HD12      ILE  95 109.536 -11.385   0.469
  751   HD13  ILE  95          HD13      ILE  95 108.935 -12.705  -0.530
  752    H    SER  96           HN       SER  96 107.566 -11.354  -5.090
  753    HA   SER  96           HA       SER  96 109.649  -9.843  -6.301
  754    HB2  SER  96           HB2      SER  96 108.603 -12.377  -6.701
  755    HB3  SER  96           HB1      SER  96 108.063 -11.512  -8.140
  756    HG   SER  96           HG       SER  96 110.365 -10.763  -8.201
  757    H    HIS  97           HN       HIS  97 106.142  -9.938  -6.793
  758    HA   HIS  97           HA       HIS  97 106.168  -8.251  -9.067
  759    HB2  HIS  97           HB2      HIS  97 104.071  -8.918  -7.004
  760    HB3  HIS  97           HB1      HIS  97 103.769  -7.719  -8.246
  761    HD2  HIS  97           HD2      HIS  97 103.979 -11.573  -7.887
  762    HE1  HIS  97           HE1      HIS  97 103.214 -10.701 -11.944
  763    HE2  HIS  97           HE2      HIS  97 103.350 -12.563 -10.220
  764    H    LEU  98           HN       LEU  98 105.880  -7.578  -5.599
  765    HA   LEU  98           HA       LEU  98 105.629  -4.747  -5.906
  766    HB2  LEU  98           HB2      LEU  98 105.224  -6.419  -3.827
  767    HB3  LEU  98           HB1      LEU  98 106.849  -5.872  -3.429
  768    HG   LEU  98           HG       LEU  98 105.248  -4.401  -2.348
  769   HD11  LEU  98          HD11      LEU  98 107.350  -3.495  -3.584
  770   HD12  LEU  98          HD12      LEU  98 106.134  -2.341  -3.038
  771   HD13  LEU  98          HD13      LEU  98 106.193  -2.822  -4.733
  772   HD21  LEU  98          HD21      LEU  98 104.126  -3.354  -4.900
  773   HD22  LEU  98          HD22      LEU  98 103.353  -3.566  -3.331
  774   HD23  LEU  98          HD23      LEU  98 103.557  -4.949  -4.403
  775    H    ARG  99           HN       ARG  99 108.381  -6.928  -5.579
  776    HA   ARG  99           HA       ARG  99 110.326  -4.911  -5.126
  777    HB2  ARG  99           HB2      ARG  99 110.402  -7.771  -5.986
  778    HB3  ARG  99           HB1      ARG  99 111.855  -6.795  -6.188
  779    HG2  ARG  99           HG2      ARG  99 111.761  -6.165  -3.799
  780    HG3  ARG  99           HG1      ARG  99 110.319  -7.159  -3.596
  781    HD2  ARG  99           HD2      ARG  99 111.959  -8.650  -2.915
  782    HD3  ARG  99           HD1      ARG  99 111.858  -9.049  -4.626
  783    HE   ARG  99           HE       ARG  99 113.998  -7.485  -3.329
  784   HH11  ARG  99          HH21      ARG  99 112.640  -9.030  -6.122
  785   HH12  ARG  99          HH22      ARG  99 114.112  -8.976  -7.031
  786   HH21  ARG  99          HH11      ARG  99 115.922  -7.414  -4.523
  787   HH22  ARG  99          HH12      ARG  99 115.966  -8.063  -6.130
  788    H    ARG 100           HN       ARG 100 109.099  -6.396  -8.116
  789    HA   ARG 100           HA       ARG 100 110.931  -4.875  -9.759
  790    HB2  ARG 100           HB2      ARG 100 109.552  -5.633 -11.693
  791    HB3  ARG 100           HB1      ARG 100 110.046  -6.988 -10.678
  792    HG2  ARG 100           HG2      ARG 100 107.823  -6.731  -9.474
  793    HG3  ARG 100           HG1      ARG 100 107.347  -5.636 -10.769
  794    HD2  ARG 100           HD2      ARG 100 107.858  -8.585 -10.873
  795    HD3  ARG 100           HD1      ARG 100 106.551  -7.654 -11.595
  796    HE   ARG 100           HE       ARG 100 108.007  -7.053 -13.381
  797   HH11  ARG 100          HH21      ARG 100 109.477  -9.107 -11.003
  798   HH12  ARG 100          HH22      ARG 100 110.786  -9.583 -12.032
  799   HH21  ARG 100          HH11      ARG 100 109.720  -7.676 -14.724
  800   HH22  ARG 100          HH12      ARG 100 110.925  -8.772 -14.134
  801    H    LEU 101           HN       LEU 101 107.680  -4.332  -8.527
  802    HA   LEU 101           HA       LEU 101 107.033  -2.042 -10.073
  803    HB2  LEU 101           HB2      LEU 101 106.204  -3.263  -7.521
  804    HB3  LEU 101           HB1      LEU 101 106.041  -1.511  -7.563
  805    HG   LEU 101           HG       LEU 101 104.615  -1.591  -9.478
  806   HD11  LEU 101          HD11      LEU 101 105.814  -4.280  -9.812
  807   HD12  LEU 101          HD12      LEU 101 105.283  -3.123 -11.031
  808   HD13  LEU 101          HD13      LEU 101 104.105  -4.162 -10.229
  809   HD21  LEU 101          HD21      LEU 101 103.222  -2.047  -7.671
  810   HD22  LEU 101          HD22      LEU 101 104.006  -3.585  -7.314
  811   HD23  LEU 101          HD23      LEU 101 102.908  -3.453  -8.686
  812    H    VAL 102           HN       VAL 102 109.092  -2.570  -7.274
  813    HA   VAL 102           HA       VAL 102 109.573   0.180  -6.702
  814    HB   VAL 102           HB       VAL 102 111.221  -2.278  -6.069
  815   HG11  VAL 102          HG11      VAL 102 112.678  -0.450  -5.782
  816   HG12  VAL 102          HG12      VAL 102 111.999  -0.687  -4.173
  817   HG13  VAL 102          HG13      VAL 102 111.389   0.605  -5.206
  818   HG21  VAL 102          HG21      VAL 102 108.676  -1.495  -5.128
  819   HG22  VAL 102          HG22      VAL 102 109.802  -1.035  -3.851
  820   HG23  VAL 102          HG23      VAL 102 109.740  -2.705  -4.410
  821    H    GLU 103           HN       GLU 103 111.339  -2.285  -8.548
  822    HA   GLU 103           HA       GLU 103 113.534  -0.655  -9.268
  823    HB2  GLU 103           HB2      GLU 103 112.320  -3.109 -10.542
  824    HB3  GLU 103           HB1      GLU 103 113.782  -2.336 -11.155
  825    HG2  GLU 103           HG2      GLU 103 114.976  -2.760  -9.143
  826    HG3  GLU 103           HG1      GLU 103 113.501  -3.172  -8.268
  827    H    LEU 104           HN       LEU 104 110.360  -1.169 -10.709
  828    HA   LEU 104           HA       LEU 104 110.944   0.235 -13.131
  829    HB2  LEU 104           HB2      LEU 104 108.347  -0.563 -11.802
  830    HB3  LEU 104           HB1      LEU 104 108.422   0.242 -13.369
  831    HG   LEU 104           HG       LEU 104 110.137  -2.179 -12.984
  832   HD11  LEU 104          HD11      LEU 104 107.134  -2.268 -13.402
  833   HD12  LEU 104          HD12      LEU 104 108.019  -2.928 -12.028
  834   HD13  LEU 104          HD13      LEU 104 108.219  -3.639 -13.629
  835   HD21  LEU 104          HD21      LEU 104 109.700  -2.460 -15.340
  836   HD22  LEU 104          HD22      LEU 104 110.046  -0.751 -15.077
  837   HD23  LEU 104          HD23      LEU 104 108.380  -1.291 -15.289
  838    H    ASN 105           HN       ASN 105 109.366   1.100 -10.064
  839    HA   ASN 105           HA       ASN 105 108.530   3.680 -10.762
  840    HB2  ASN 105           HB2      ASN 105 108.707   2.095  -8.389
  841    HB3  ASN 105           HB1      ASN 105 109.385   3.680  -8.031
  842   HD21  ASN 105          HD21      ASN 105 106.603   2.526 -10.039
  843   HD22  ASN 105          HD22      ASN 105 105.490   3.619  -9.369
  844    H    LEU 106           HN       LEU 106 111.567   2.629  -9.214
  845    HA   LEU 106           HA       LEU 106 112.751   5.188  -9.088
  846    HB2  LEU 106           HB2      LEU 106 113.706   2.372  -8.894
  847    HB3  LEU 106           HB1      LEU 106 114.922   3.607  -9.220
  848    HG   LEU 106           HG       LEU 106 114.113   4.888  -7.244
  849   HD11  LEU 106          HD11      LEU 106 111.789   3.996  -7.256
  850   HD12  LEU 106          HD12      LEU 106 112.557   3.815  -5.679
  851   HD13  LEU 106          HD13      LEU 106 112.410   2.423  -6.753
  852   HD21  LEU 106          HD21      LEU 106 115.982   3.262  -7.054
  853   HD22  LEU 106          HD22      LEU 106 114.822   1.999  -6.644
  854   HD23  LEU 106          HD23      LEU 106 115.054   3.369  -5.558
  855    H    GLY 107           HN       GLY 107 112.355   2.921 -11.684
  856    HA2  GLY 107           HA2      GLY 107 112.475   3.782 -13.960
  857    HA3  GLY 107           HA1      GLY 107 113.880   4.726 -13.470
  858    H    ASP 108           HN       ASP 108 115.076   3.757 -15.201
  859    HA   ASP 108           HA       ASP 108 115.648   0.886 -14.949
  860    HB2  ASP 108           HB2      ASP 108 115.150   1.694 -17.195
  861    HB3  ASP 108           HB1      ASP 108 116.427   2.902 -17.069
  862    H    GLU 109           HN       GLU 109 118.018   0.300 -15.341
  863    HA   GLU 109           HA       GLU 109 119.578   1.396 -13.232
  864    HB2  GLU 109           HB2      GLU 109 121.385  -0.050 -14.146
  865    HB3  GLU 109           HB1      GLU 109 119.870  -0.917 -13.900
  866    HG2  GLU 109           HG2      GLU 109 119.689  -1.397 -16.106
  867    HG3  GLU 109           HG1      GLU 109 119.973   0.281 -16.559
  868    H    GLU 110           HN       GLU 110 119.014   3.632 -14.483
  869    HA   GLU 110           HA       GLU 110 120.434   4.554 -16.640
  870    HB2  GLU 110           HB2      GLU 110 118.854   5.721 -14.751
  871    HB3  GLU 110           HB1      GLU 110 120.423   6.404 -14.327
  872    HG2  GLU 110           HG2      GLU 110 120.654   6.880 -16.874
  873    HG3  GLU 110           HG1      GLU 110 118.911   6.632 -16.925
  874    H    LEU 111           HN       LEU 111 122.324   6.227 -16.430
  875    HA   LEU 111           HA       LEU 111 124.656   4.798 -15.761
  876    HB2  LEU 111           HB2      LEU 111 124.485   7.804 -16.001
  877    HB3  LEU 111           HB1      LEU 111 125.859   6.761 -16.359
  878    HG   LEU 111           HG       LEU 111 123.817   5.721 -17.962
  879   HD11  LEU 111          HD11      LEU 111 122.633   7.953 -17.337
  880   HD12  LEU 111          HD12      LEU 111 122.700   7.491 -19.037
  881   HD13  LEU 111          HD13      LEU 111 123.816   8.704 -18.408
  882   HD21  LEU 111          HD21      LEU 111 126.075   7.653 -18.557
  883   HD22  LEU 111          HD22      LEU 111 125.129   6.859 -19.815
  884   HD23  LEU 111          HD23      LEU 111 126.100   5.895 -18.701
  885    H    LEU 112           HN       LEU 112 122.718   7.102 -13.945
  886    HA   LEU 112           HA       LEU 112 124.041   6.297 -11.499
  887    HB2  LEU 112           HB2      LEU 112 125.179   8.202 -10.978
  888    HB3  LEU 112           HB1      LEU 112 125.236   8.387 -12.728
  889    HG   LEU 112           HG       LEU 112 123.207   9.648 -10.853
  890   HD11  LEU 112          HD11      LEU 112 125.286  10.948 -12.628
  891   HD12  LEU 112          HD12      LEU 112 125.538  10.616 -10.915
  892   HD13  LEU 112          HD13      LEU 112 124.269  11.732 -11.418
  893   HD21  LEU 112          HD21      LEU 112 123.068  10.820 -13.416
  894   HD22  LEU 112          HD22      LEU 112 121.862   9.777 -12.670
  895   HD23  LEU 112          HD23      LEU 112 123.103   9.083 -13.709
  896    H    GLU 113           HN       GLU 113 123.021   7.399  -9.577
  897    HA   GLU 113           HA       GLU 113 120.565   8.777  -9.777
  898    HB2  GLU 113           HB2      GLU 113 119.969   6.443 -10.707
  899    HB3  GLU 113           HB1      GLU 113 120.151   5.882  -9.045
  900    HG2  GLU 113           HG2      GLU 113 117.845   6.415  -9.269
  901    HG3  GLU 113           HG1      GLU 113 118.549   7.773  -8.393
  902    H    ARG 114           HN       ARG 114 121.052   9.961  -8.000
  903    HA   ARG 114           HA       ARG 114 122.415   9.135  -5.721
  904    HB2  ARG 114           HB2      ARG 114 120.662  11.390  -6.454
  905    HB3  ARG 114           HB1      ARG 114 120.697  11.037  -4.727
  906    HG2  ARG 114           HG2      ARG 114 123.192  11.356  -6.419
  907    HG3  ARG 114           HG1      ARG 114 122.468  12.672  -5.498
  908    HD2  ARG 114           HD2      ARG 114 123.539  11.959  -3.647
  909    HD3  ARG 114           HD1      ARG 114 122.698  10.417  -3.752
  910    HE   ARG 114           HE       ARG 114 125.002  10.665  -5.505
  911   HH11  ARG 114          HH21      ARG 114 123.746   9.755  -2.415
  912   HH12  ARG 114          HH22      ARG 114 125.036   8.657  -2.056
  913   HH21  ARG 114          HH11      ARG 114 126.701   9.223  -5.044
  914   HH22  ARG 114          HH12      ARG 114 126.708   8.355  -3.545
  915    H    GLU 115           HN       GLU 115 120.995   9.512  -3.467
  916    HA   GLU 115           HA       GLU 115 119.572   8.503  -1.970
  917    HB2  GLU 115           HB2      GLU 115 117.876   7.579  -4.281
  918    HB3  GLU 115           HB1      GLU 115 117.372   8.019  -2.651
  919    HG2  GLU 115           HG2      GLU 115 118.366  10.372  -3.270
  920    HG3  GLU 115           HG1      GLU 115 118.168   9.811  -4.929
  921    H    LEU 116           HN       LEU 116 121.367   6.948  -4.213
  922    HA   LEU 116           HA       LEU 116 120.547   4.238  -4.002
  923    HB2  LEU 116           HB2      LEU 116 122.755   3.722  -4.919
  924    HB3  LEU 116           HB1      LEU 116 122.001   5.052  -5.795
  925    HG   LEU 116           HG       LEU 116 123.359   6.404  -3.813
  926   HD11  LEU 116          HD11      LEU 116 124.397   4.125  -3.221
  927   HD12  LEU 116          HD12      LEU 116 125.519   5.454  -3.505
  928   HD13  LEU 116          HD13      LEU 116 125.252   4.243  -4.758
  929   HD21  LEU 116          HD21      LEU 116 125.078   6.813  -5.636
  930   HD22  LEU 116          HD22      LEU 116 123.405   7.078  -6.123
  931   HD23  LEU 116          HD23      LEU 116 124.237   5.599  -6.600
  932    H    ALA 117           HN       ALA 117 122.886   6.179  -2.146
  933    HA   ALA 117           HA       ALA 117 123.836   3.983  -0.612
  934    HB1  ALA 117           HB1      ALA 117 124.861   5.739   0.832
  935    HB2  ALA 117           HB2      ALA 117 123.993   6.965  -0.092
  936    HB3  ALA 117           HB3      ALA 117 125.221   5.973  -0.878
  937    H    LEU 118           HN       LEU 118 121.050   6.006  -0.337
  938    HA   LEU 118           HA       LEU 118 120.575   5.940   2.394
  939    HB2  LEU 118           HB2      LEU 118 118.591   5.813   0.119
  940    HB3  LEU 118           HB1      LEU 118 118.170   6.140   1.796
  941    HG   LEU 118           HG       LEU 118 120.096   7.793   0.137
  942   HD11  LEU 118          HD11      LEU 118 117.543   7.829  -0.391
  943   HD12  LEU 118          HD12      LEU 118 118.370   9.368  -0.153
  944   HD13  LEU 118          HD13      LEU 118 117.396   8.679   1.146
  945   HD21  LEU 118          HD21      LEU 118 119.219   7.834   3.005
  946   HD22  LEU 118          HD22      LEU 118 119.478   9.381   2.199
  947   HD23  LEU 118          HD23      LEU 118 120.794   8.214   2.309
  948    H    LEU 119           HN       LEU 119 120.066   3.339   0.024
  949    HA   LEU 119           HA       LEU 119 118.372   1.711   1.529
  950    HB2  LEU 119           HB2      LEU 119 120.519   1.132  -0.498
  951    HB3  LEU 119           HB1      LEU 119 119.711  -0.199   0.329
  952    HG   LEU 119           HG       LEU 119 118.654   0.476  -1.869
  953   HD11  LEU 119          HD11      LEU 119 116.781  -0.426  -1.013
  954   HD12  LEU 119          HD12      LEU 119 116.421   1.053  -0.126
  955   HD13  LEU 119          HD13      LEU 119 117.438  -0.187   0.605
  956   HD21  LEU 119          HD21      LEU 119 117.683   2.894  -0.329
  957   HD22  LEU 119          HD22      LEU 119 117.476   2.546  -2.045
  958   HD23  LEU 119          HD23      LEU 119 119.071   2.958  -1.417
  959    H    VAL 120           HN       VAL 120 121.591   2.654   2.116
  960    HA   VAL 120           HA       VAL 120 122.717   0.565   3.602
  961    HB   VAL 120           HB       VAL 120 122.942   3.559   3.857
  962   HG11  VAL 120          HG11      VAL 120 125.187   2.781   4.986
  963   HG12  VAL 120          HG12      VAL 120 124.284   1.307   5.333
  964   HG13  VAL 120          HG13      VAL 120 123.714   2.858   5.950
  965   HG21  VAL 120          HG21      VAL 120 125.015   1.643   2.806
  966   HG22  VAL 120          HG22      VAL 120 124.790   3.353   2.430
  967   HG23  VAL 120          HG23      VAL 120 123.689   2.150   1.759
  968    H    SER 121           HN       SER 121 119.810   2.046   4.180
  969    HA   SER 121           HA       SER 121 119.888   2.479   6.997
  970    HB2  SER 121           HB2      SER 121 118.197   3.422   5.343
  971    HB3  SER 121           HB1      SER 121 117.428   1.838   5.373
  972    HG   SER 121           HG       SER 121 117.078   2.078   7.561
  973    H    ALA 122           HN       ALA 122 119.657  -0.353   5.068
  974    HA   ALA 122           HA       ALA 122 119.661  -2.572   5.716
  975    HB1  ALA 122           HB1      ALA 122 119.051  -1.887   8.568
  976    HB2  ALA 122           HB2      ALA 122 120.643  -1.488   7.923
  977    HB3  ALA 122           HB3      ALA 122 120.083  -3.160   7.915
  978    H    HIS 123           HN       HIS 123 117.328  -0.758   5.174
  979    HA   HIS 123           HA       HIS 123 115.027  -0.786   5.149
  980    HB2  HIS 123           HB2      HIS 123 114.747  -2.575   3.806
  981    HB3  HIS 123           HB1      HIS 123 116.047  -3.460   4.605
  982    HD2  HIS 123           HD2      HIS 123 115.200  -5.229   6.650
  983    HE1  HIS 123           HE1      HIS 123 111.065  -4.507   6.215
  984    HE2  HIS 123           HE2      HIS 123 112.797  -5.990   7.333
  985    H    ASP 124           HN       ASP 124 113.397  -0.520   6.525
  986    HA   ASP 124           HA       ASP 124 112.514  -0.218   8.663
  987    HB2  ASP 124           HB2      ASP 124 111.112  -1.976   9.087
  988    HB3  ASP 124           HB1      ASP 124 111.596  -2.367   7.444
  989    H    ASP 125           HN       ASP 125 115.481  -0.559   8.693
  990    HA   ASP 125           HA       ASP 125 116.795  -2.060  10.387
  991    HB2  ASP 125           HB2      ASP 125 117.397   0.334  11.598
  992    HB3  ASP 125           HB1      ASP 125 118.113  -0.254  10.102
  993   H5'1  C2E 501          H5'1      C2E 501 105.373   3.245  10.368
  994   H5'2  C2E 501          H5'2      C2E 501 104.653   1.835  11.165
  995    H4'  C2E 501           H4'      C2E 501 106.958   0.693  10.478
  996    H3'  C2E 501           H3'      C2E 501 106.829   3.117   8.709
  997    H2'  C2E 501           H2'      C2E 501 106.981   1.942   6.706
  998   HO2'  C2E 501          HO2'      C2E 501 107.334  -0.571   7.187
  999    H1'  C2E 501           H1'      C2E 501 105.345  -0.120   7.247
 1000    H8   C2E 501           H8       C2E 501 103.587   2.432   9.244
 1001    HN1  C2E 501           HN1      C2E 501 103.122   3.726   2.998
 1002   HN21  C2E 501          HN21      C2E 501 104.561   2.487   1.855
 1003   HN22  C2E 501          HN22      C2E 501 105.629   1.338   2.627
 1004   H511  C2E 501          H511      C2E 501 108.107   4.434  10.101
 1005   H512  C2E 501          H512      C2E 501 109.799   4.472  10.635
 1006    H4A  C2E 501           H4A      C2E 501 108.922   5.142  12.936
 1007    H3A  C2E 501           H3A      C2E 501 106.277   5.269  11.469
 1008    H2A  C2E 501           H2A      C2E 501 105.758   7.281  12.470
 1009   HO2A  C2E 501          HO2A      C2E 501 106.512   6.614  14.591
 1010    H1A  C2E 501           H1A      C2E 501 108.176   8.503  12.258
 1011    H81  C2E 501           H81      C2E 501 108.260   6.519   9.142
 1012   HN11  C2E 501          HN11      C2E 501 104.262  11.490   8.616
 1013   HN24  C2E 501          HN24      C2E 501 104.492  11.668  12.089
 1014   HN23  C2E 501          HN23      C2E 501 103.806  12.318  10.617
 1015   H5'1  C2E 502          H5'1      C2E 502 100.944  10.657   4.377
 1016   H5'2  C2E 502          H5'2      C2E 502  99.978  12.143   4.268
 1017    H4'  C2E 502           H4'      C2E 502  99.659  12.196   6.506
 1018    H3'  C2E 502           H3'      C2E 502 102.610  11.613   6.708
 1019    H2'  C2E 502           H2'      C2E 502 102.258  11.103   9.029
 1020   HO2'  C2E 502          HO2'      C2E 502 100.795  12.731   9.591
 1021    H1'  C2E 502           H1'      C2E 502 100.084   9.556   8.610
 1022    H8   C2E 502           H8       C2E 502 102.273   8.837   5.594
 1023    HN1  C2E 502           HN1      C2E 502 104.192   5.907  10.941
 1024   HN21  C2E 502          HN21      C2E 502 103.091   6.669  12.689
 1025   HN22  C2E 502          HN22      C2E 502 101.874   7.922  12.562
 1026   H511  C2E 502          H511      C2E 502 105.219  15.403   6.942
 1027   H512  C2E 502          H512      C2E 502 104.403  16.865   6.358
 1028    H4A  C2E 502           H4A      C2E 502 104.670  16.305   4.164
 1029    H3A  C2E 502           H3A      C2E 502 104.290  13.403   5.004
 1030    H2A  C2E 502           H2A      C2E 502 105.529  12.683   3.157
 1031   HO2A  C2E 502          HO2A      C2E 502 104.438  14.115   1.650
 1032    H1A  C2E 502           H1A      C2E 502 107.475  14.628   3.194
 1033    H81  C2E 502           H81      C2E 502 106.770  13.765   6.777
 1034   HN11  C2E 502          HN11      C2E 502 110.726   9.669   3.873
 1035   HN24  C2E 502          HN24      C2E 502 110.691  10.003   1.675
 1036   HN23  C2E 502          HN23      C2E 502 109.691  11.229   0.928
  Start of MODEL   14
    1    H    MET   1           H        MET   1 108.928  29.710  11.537
    2    HA   MET   1           HA       MET   1 109.414  27.654  10.382
    3    HB2  MET   1           HB2      MET   1 109.649  27.622  13.402
    4    HB3  MET   1           HB1      MET   1 110.466  26.459  12.360
    5    HG2  MET   1           HG2      MET   1 110.809  29.314  11.612
    6    HG3  MET   1           HG1      MET   1 111.585  28.817  13.115
    7    HE1  MET   1           HE1      MET   1 113.090  28.327   8.988
    8    HE2  MET   1           HE2      MET   1 112.313  29.643   9.865
    9    HE3  MET   1           HE3      MET   1 111.339  28.314   9.240
   10    H    SER   2           HN       SER   2 107.981  26.301   9.455
   11    HA   SER   2           HA       SER   2 106.351  24.574  11.229
   12    HB2  SER   2           HB2      SER   2 105.114  26.224   9.713
   13    HB3  SER   2           HB1      SER   2 105.686  25.248   8.363
   14    HG   SER   2           HG       SER   2 103.920  24.590  10.451
   15    H    ASP   3           HN       ASP   3 107.053  22.560  11.266
   16    HA   ASP   3           HA       ASP   3 108.413  21.472   8.879
   17    HB2  ASP   3           HB2      ASP   3 108.583  20.672  11.800
   18    HB3  ASP   3           HB1      ASP   3 109.171  19.640  10.500
   19    H    GLN   4           HN       GLN   4 106.631  20.959   7.696
   20    HA   GLN   4           HA       GLN   4 104.631  19.203   8.949
   21    HB2  GLN   4           HB2      GLN   4 104.214  21.344   7.408
   22    HB3  GLN   4           HB1      GLN   4 104.325  20.127   6.137
   23    HG2  GLN   4           HG2      GLN   4 102.403  20.202   8.474
   24    HG3  GLN   4           HG1      GLN   4 102.016  20.218   6.756
   25   HE21  GLN   4          HE21      GLN   4 103.237  18.123   9.384
   26   HE22  GLN   4          HE22      GLN   4 102.896  16.662   8.589
   27    H    HIS   5           HN       HIS   5 107.027  19.247   6.348
   28    HA   HIS   5           HA       HIS   5 106.252  16.528   5.572
   29    HB2  HIS   5           HB2      HIS   5 108.496  18.079   4.326
   30    HB3  HIS   5           HB1      HIS   5 107.479  16.833   3.610
   31    HD2  HIS   5           HD2      HIS   5 104.523  17.956   3.964
   32    HE1  HIS   5           HE1      HIS   5 105.942  21.662   2.523
   33    HE2  HIS   5           HE2      HIS   5 103.860  20.276   2.962
   34    H    ASP   6           HN       ASP   6 107.310  16.749   8.142
   35    HA   ASP   6           HA       ASP   6 110.067  16.307   8.373
   36    HB2  ASP   6           HB2      ASP   6 107.693  15.418  10.002
   37    HB3  ASP   6           HB1      ASP   6 109.342  14.992  10.462
   38    H    GLU   7           HN       GLU   7 111.281  14.728   7.517
   39    HA   GLU   7           HA       GLU   7 110.012  12.324   6.478
   40    HB2  GLU   7           HB2      GLU   7 111.619  13.293   5.025
   41    HB3  GLU   7           HB1      GLU   7 112.812  13.429   6.318
   42    HG2  GLU   7           HG2      GLU   7 113.245  11.118   6.335
   43    HG3  GLU   7           HG1      GLU   7 111.727  10.732   5.529
   44    H    ARG   8           HN       ARG   8 109.706  10.607   7.701
   45    HA   ARG   8           HA       ARG   8 111.678   9.976   9.822
   46    HB2  ARG   8           HB2      ARG   8 108.674   9.860   9.855
   47    HB3  ARG   8           HB1      ARG   8 109.640   8.843  10.915
   48    HG2  ARG   8           HG2      ARG   8 109.209  10.757  12.219
   49    HG3  ARG   8           HG1      ARG   8 110.847  11.004  11.624
   50    HD2  ARG   8           HD2      ARG   8 109.119  12.959  11.470
   51    HD3  ARG   8           HD1      ARG   8 110.193  12.658  10.121
   52    HE   ARG   8           HE       ARG   8 108.296  11.466   9.046
   53   HH11  ARG   8          HH21      ARG   8 107.637  13.566  11.730
   54   HH12  ARG   8          HH22      ARG   8 106.069  14.020  11.157
   55   HH21  ARG   8          HH11      ARG   8 106.255  12.084   8.292
   56   HH22  ARG   8          HH12      ARG   8 105.286  13.182   9.218
   57    H    ARG   9           HN       ARG   9 110.429   8.988   6.913
   58    HA   ARG   9           HA       ARG   9 110.414   6.127   7.540
   59    HB2  ARG   9           HB2      ARG   9 109.925   7.508   4.893
   60    HB3  ARG   9           HB1      ARG   9 109.608   5.813   5.273
   61    HG2  ARG   9           HG2      ARG   9 107.906   6.405   6.868
   62    HG3  ARG   9           HG1      ARG   9 108.329   8.113   6.769
   63    HD2  ARG   9           HD2      ARG   9 107.804   7.407   4.123
   64    HD3  ARG   9           HD1      ARG   9 106.581   6.534   5.037
   65    HE   ARG   9           HE       ARG   9 106.139   8.827   6.114
   66   HH11  ARG   9          HH21      ARG   9 107.308   8.369   2.873
   67   HH12  ARG   9          HH22      ARG   9 106.610   9.837   2.279
   68   HH21  ARG   9          HH11      ARG   9 105.229  10.740   5.325
   69   HH22  ARG   9          HH12      ARG   9 105.436  11.176   3.662
   70    H    ARG  10           HN       ARG  10 112.357   5.260   7.729
   71    HA   ARG  10           HA       ARG  10 114.823   5.721   7.208
   72    HB2  ARG  10           HB2      ARG  10 114.091   3.308   5.630
   73    HB3  ARG  10           HB1      ARG  10 115.291   3.501   6.901
   74    HG2  ARG  10           HG2      ARG  10 113.707   2.178   7.971
   75    HG3  ARG  10           HG1      ARG  10 113.185   3.784   8.464
   76    HD2  ARG  10           HD2      ARG  10 111.420   3.802   6.837
   77    HD3  ARG  10           HD1      ARG  10 112.087   2.408   5.998
   78    HE   ARG  10           HE       ARG  10 110.471   2.370   8.411
   79   HH11  ARG  10          HH21      ARG  10 112.715   0.727   6.350
   80   HH12  ARG  10          HH22      ARG  10 112.261  -0.856   6.886
   81   HH21  ARG  10          HH11      ARG  10 109.869   0.294   9.116
   82   HH22  ARG  10          HH12      ARG  10 110.651  -1.102   8.452
   83    H    PHE  11           HN       PHE  11 112.843   4.710   4.420
   84    HA   PHE  11           HA       PHE  11 114.386   6.544   2.715
   85    HB2  PHE  11           HB2      PHE  11 114.993   3.889   2.722
   86    HB3  PHE  11           HB1      PHE  11 113.735   3.925   1.486
   87    HD1  PHE  11           HD1      PHE  11 116.712   5.958   2.547
   88    HD2  PHE  11           HD2      PHE  11 114.418   4.343  -0.707
   89    HE1  PHE  11           HE1      PHE  11 118.338   6.904   0.932
   90    HE2  PHE  11           HE2      PHE  11 116.045   5.290  -2.323
   91    HZ   PHE  11           HZ       PHE  11 118.003   6.570  -1.503
   92    H    HIS  12           HN       HIS  12 113.232   7.432   1.045
   93    HA   HIS  12           HA       HIS  12 110.485   7.744   1.289
   94    HB2  HIS  12           HB2      HIS  12 111.601   7.949  -1.458
   95    HB3  HIS  12           HB1      HIS  12 110.656   9.117  -0.535
   96    HD2  HIS  12           HD2      HIS  12 114.428   7.957  -0.825
   97    HE1  HIS  12           HE1      HIS  12 114.299  11.632   1.247
   98    HE2  HIS  12           HE2      HIS  12 115.836   9.890   0.223
   99    H    ARG  13           HN       ARG  13 108.869   6.348   1.000
  100    HA   ARG  13           HA       ARG  13 109.226   3.812  -0.249
  101    HB2  ARG  13           HB2      ARG  13 106.484   4.214  -0.170
  102    HB3  ARG  13           HB1      ARG  13 107.447   3.499   1.116
  103    HG2  ARG  13           HG2      ARG  13 107.669   5.601   2.244
  104    HG3  ARG  13           HG1      ARG  13 107.018   6.482   0.862
  105    HD2  ARG  13           HD2      ARG  13 105.260   4.351   1.928
  106    HD3  ARG  13           HD1      ARG  13 105.516   5.713   3.010
  107    HE   ARG  13           HE       ARG  13 104.224   5.800   0.373
  108   HH11  ARG  13          HH21      ARG  13 105.385   7.459   3.197
  109   HH12  ARG  13          HH22      ARG  13 104.433   8.874   2.913
  110   HH21  ARG  13          HH11      ARG  13 102.988   7.658   0.011
  111   HH22  ARG  13          HH12      ARG  13 103.080   8.988   1.116
  112    H    ILE  14           HN       ILE  14 107.402   3.165  -1.918
  113    HA   ILE  14           HA       ILE  14 107.782   4.947  -4.225
  114    HB   ILE  14           HB       ILE  14 107.210   2.026  -3.887
  115   HG12  ILE  14          HG12      ILE  14 109.093   1.877  -5.496
  116   HG13  ILE  14          HG11      ILE  14 109.162   3.635  -5.561
  117   HG21  ILE  14          HG21      ILE  14 105.573   2.437  -5.508
  118   HG22  ILE  14          HG22      ILE  14 106.995   2.112  -6.500
  119   HG23  ILE  14          HG23      ILE  14 106.477   3.775  -6.221
  120   HD11  ILE  14          HD11      ILE  14 109.888   3.810  -3.326
  121   HD12  ILE  14          HD12      ILE  14 110.785   2.423  -3.943
  122   HD13  ILE  14          HD13      ILE  14 109.362   2.173  -2.932
  123    H    ALA  15           HN       ALA  15 106.198   6.347  -4.580
  124    HA   ALA  15           HA       ALA  15 103.476   5.682  -3.721
  125    HB1  ALA  15           HB1      ALA  15 104.141   7.851  -3.024
  126    HB2  ALA  15           HB2      ALA  15 103.054   8.107  -4.388
  127    HB3  ALA  15           HB3      ALA  15 104.798   8.241  -4.614
  128    H    PHE  16           HN       PHE  16 102.118   4.833  -5.067
  129    HA   PHE  16           HA       PHE  16 101.904   5.767  -7.806
  130    HB2  PHE  16           HB2      PHE  16 102.154   3.659  -8.867
  131    HB3  PHE  16           HB1      PHE  16 103.543   3.814  -7.799
  132    HD1  PHE  16           HD2      PHE  16 102.563   3.100  -5.165
  133    HD2  PHE  16           HD1      PHE  16 101.534   1.419  -8.984
  134    HE1  PHE  16           HE2      PHE  16 101.947   0.971  -4.066
  135    HE2  PHE  16           HE1      PHE  16 100.924  -0.709  -7.880
  136    HZ   PHE  16           HZ       PHE  16 101.144  -0.935  -5.425
  137    H    ASP  17           HN       ASP  17  99.784   5.373  -8.673
  138    HA   ASP  17           HA       ASP  17  97.859   4.868  -6.532
  139    HB2  ASP  17           HB2      ASP  17  97.741   6.228  -9.201
  140    HB3  ASP  17           HB1      ASP  17  96.249   5.677  -8.439
  141    H    ALA  18           HN       ALA  18  96.136   3.431  -6.718
  142    HA   ALA  18           HA       ALA  18  95.526   1.800  -8.899
  143    HB1  ALA  18           HB1      ALA  18  97.611   0.691  -8.773
  144    HB2  ALA  18           HB2      ALA  18  96.501  -0.376  -7.913
  145    HB3  ALA  18           HB3      ALA  18  97.591   0.675  -7.010
  146    H    ASP  19           HN       ASP  19  94.409  -0.326  -8.019
  147    HA   ASP  19           HA       ASP  19  92.610   0.600  -5.865
  148    HB2  ASP  19           HB2      ASP  19  91.805  -1.915  -7.019
  149    HB3  ASP  19           HB1      ASP  19  90.989  -0.356  -7.090
  150    H    SER  20           HN       SER  20  92.504  -0.350  -3.911
  151    HA   SER  20           HA       SER  20  93.863  -2.939  -3.525
  152    HB2  SER  20           HB2      SER  20  94.685  -2.041  -1.309
  153    HB3  SER  20           HB1      SER  20  95.468  -1.354  -2.729
  154    HG   SER  20           HG       SER  20  93.987   0.405  -2.556
  155    H    GLU  21           HN       GLU  21  93.097  -4.143  -1.738
  156    HA   GLU  21           HA       GLU  21  90.570  -3.221  -0.512
  157    HB2  GLU  21           HB2      GLU  21  91.003  -5.946  -1.778
  158    HB3  GLU  21           HB1      GLU  21  89.566  -5.434  -0.891
  159    HG2  GLU  21           HG2      GLU  21  89.576  -3.448  -2.639
  160    HG3  GLU  21           HG1      GLU  21  90.524  -4.577  -3.602
  161    H    ILE  22           HN       ILE  22  90.220  -4.039   1.569
  162    HA   ILE  22           HA       ILE  22  92.472  -5.631   2.646
  163    HB   ILE  22           HB       ILE  22  91.121  -3.212   3.847
  164   HG12  ILE  22          HG12      ILE  22  93.963  -3.867   3.018
  165   HG13  ILE  22          HG11      ILE  22  92.878  -2.724   2.231
  166   HG21  ILE  22          HG21      ILE  22  92.583  -3.589   5.811
  167   HG22  ILE  22          HG22      ILE  22  93.144  -5.100   5.101
  168   HG23  ILE  22          HG23      ILE  22  91.461  -4.929   5.595
  169   HD11  ILE  22          HD11      ILE  22  94.446  -1.517   3.652
  170   HD12  ILE  22          HD12      ILE  22  93.990  -2.499   5.041
  171   HD13  ILE  22          HD13      ILE  22  92.823  -1.385   4.329
  172    H    LEU  23           HN       LEU  23  92.033  -7.272   3.926
  173    HA   LEU  23           HA       LEU  23  89.201  -7.762   4.664
  174    HB2  LEU  23           HB2      LEU  23  91.096 -10.036   4.296
  175    HB3  LEU  23           HB1      LEU  23  89.361  -9.947   3.995
  176    HG   LEU  23           HG       LEU  23  90.163  -8.191   2.139
  177   HD11  LEU  23          HD11      LEU  23  92.249  -9.005   1.082
  178   HD12  LEU  23          HD12      LEU  23  92.488 -10.120   2.425
  179   HD13  LEU  23          HD13      LEU  23  92.549  -8.381   2.699
  180   HD21  LEU  23          HD21      LEU  23  90.338 -11.206   1.803
  181   HD22  LEU  23          HD22      LEU  23  90.080 -10.037   0.509
  182   HD23  LEU  23          HD23      LEU  23  88.847 -10.264   1.749
  183    H    GLN  24           HN       GLN  24  88.848  -7.876   6.724
  184    HA   GLN  24           HA       GLN  24  90.993  -8.860   8.524
  185    HB2  GLN  24           HB2      GLN  24  90.793  -6.365   8.632
  186    HB3  GLN  24           HB1      GLN  24  89.123  -6.561   9.156
  187    HG2  GLN  24           HG2      GLN  24  91.069  -8.175  10.692
  188    HG3  GLN  24           HG1      GLN  24  91.286  -6.436  10.857
  189   HE21  GLN  24          HE21      GLN  24  90.474  -6.459  13.083
  190   HE22  GLN  24          HE22      GLN  24  88.826  -6.704  13.409
  191    H    GLY  25           HN       GLY  25  90.119 -10.856   8.976
  192    HA2  GLY  25           HA2      GLY  25  88.759 -12.289  10.189
  193    HA3  GLY  25           HA1      GLY  25  87.721 -10.923  10.594
  194    H    GLU  26           HN       GLU  26  85.723 -11.330   9.877
  195    HA   GLU  26           HA       GLU  26  85.340 -12.748   7.320
  196    HB2  GLU  26           HB2      GLU  26  82.909 -12.743   8.133
  197    HB3  GLU  26           HB1      GLU  26  84.049 -13.734   9.042
  198    HG2  GLU  26           HG2      GLU  26  84.195 -12.149  10.803
  199    HG3  GLU  26           HG1      GLU  26  83.451 -10.882   9.830
  200    H    ARG  27           HN       ARG  27  85.974  -9.736   8.045
  201    HA   ARG  27           HA       ARG  27  83.784  -8.521   6.466
  202    HB2  ARG  27           HB2      ARG  27  85.693  -7.302   8.438
  203    HB3  ARG  27           HB1      ARG  27  84.501  -6.418   7.490
  204    HG2  ARG  27           HG2      ARG  27  82.764  -7.113   8.784
  205    HG3  ARG  27           HG1      ARG  27  83.394  -8.757   8.902
  206    HD2  ARG  27           HD2      ARG  27  84.911  -8.149  10.635
  207    HD3  ARG  27           HD1      ARG  27  84.621  -6.433  10.377
  208    HE   ARG  27           HE       ARG  27  82.168  -7.236  11.056
  209   HH11  ARG  27          HH21      ARG  27  85.269  -8.047  12.372
  210   HH12  ARG  27          HH22      ARG  27  84.671  -8.311  13.975
  211   HH21  ARG  27          HH11      ARG  27  81.382  -7.579  13.160
  212   HH22  ARG  27          HH12      ARG  27  82.473  -8.046  14.421
  213    H    ARG  28           HN       ARG  28  84.236  -7.529   4.588
  214    HA   ARG  28           HA       ARG  28  87.059  -6.972   3.873
  215    HB2  ARG  28           HB2      ARG  28  86.094  -9.042   2.738
  216    HB3  ARG  28           HB1      ARG  28  84.957  -7.962   1.933
  217    HG2  ARG  28           HG2      ARG  28  87.196  -6.627   1.342
  218    HG3  ARG  28           HG1      ARG  28  87.917  -8.216   1.563
  219    HD2  ARG  28           HD2      ARG  28  85.855  -8.945   0.016
  220    HD3  ARG  28           HD1      ARG  28  85.998  -7.275  -0.520
  221    HE   ARG  28           HE       ARG  28  88.148  -7.770  -1.397
  222   HH11  ARG  28          HH21      ARG  28  86.663 -10.454   0.222
  223   HH12  ARG  28          HH22      ARG  28  87.737 -11.630  -0.457
  224   HH21  ARG  28          HH11      ARG  28  89.556  -9.312  -2.281
  225   HH22  ARG  28          HH12      ARG  28  89.373 -10.985  -1.871
  226    H    TRP  29           HN       TRP  29  87.421  -5.181   2.595
  227    HA   TRP  29           HA       TRP  29  85.147  -3.471   1.899
  228    HB2  TRP  29           HB2      TRP  29  87.476  -2.614   3.619
  229    HB3  TRP  29           HB1      TRP  29  86.190  -1.559   3.034
  230    HD1  TRP  29           HD1      TRP  29  83.626  -2.432   3.841
  231    HE1  TRP  29           HE1      TRP  29  82.945  -3.232   6.206
  232    HE3  TRP  29           HE3      TRP  29  88.200  -3.704   5.667
  233    HZ2  TRP  29           HZ2      TRP  29  84.206  -4.277   8.563
  234    HZ3  TRP  29           HZ3      TRP  29  88.451  -4.593   7.963
  235    HH2  TRP  29           HH2      TRP  29  86.456  -4.890   9.415
  236    H    GLU  30           HN       GLU  30  85.717  -1.796   0.417
  237    HA   GLU  30           HA       GLU  30  88.100  -2.445  -1.170
  238    HB2  GLU  30           HB2      GLU  30  85.865  -0.574  -1.962
  239    HB3  GLU  30           HB1      GLU  30  87.020  -1.400  -3.008
  240    HG2  GLU  30           HG2      GLU  30  86.025  -3.589  -2.083
  241    HG3  GLU  30           HG1      GLU  30  84.705  -2.589  -1.477
  242    H    VAL  31           HN       VAL  31  89.760  -0.921  -1.429
  243    HA   VAL  31           HA       VAL  31  89.331   1.836  -0.501
  244    HB   VAL  31           HB       VAL  31  91.433   1.691   0.859
  245   HG11  VAL  31          HG11      VAL  31  89.127   1.600   1.826
  246   HG12  VAL  31          HG12      VAL  31  90.323   0.731   2.793
  247   HG13  VAL  31          HG13      VAL  31  89.208  -0.161   1.757
  248   HG21  VAL  31          HG21      VAL  31  92.335  -0.437   1.455
  249   HG22  VAL  31          HG22      VAL  31  92.145  -0.487  -0.297
  250   HG23  VAL  31          HG23      VAL  31  90.971  -1.297   0.740
  251    H    LEU  32           HN       LEU  32  91.001   3.285  -1.111
  252    HA   LEU  32           HA       LEU  32  92.371   2.472  -3.595
  253    HB2  LEU  32           HB2      LEU  32  91.140   4.461  -3.950
  254    HB3  LEU  32           HB1      LEU  32  91.555   5.115  -2.368
  255    HG   LEU  32           HG       LEU  32  93.888   5.424  -3.089
  256   HD11  LEU  32          HD11      LEU  32  94.457   3.839  -4.664
  257   HD12  LEU  32          HD12      LEU  32  94.085   5.174  -5.749
  258   HD13  LEU  32          HD13      LEU  32  92.888   3.910  -5.466
  259   HD21  LEU  32          HD21      LEU  32  93.507   7.265  -4.591
  260   HD22  LEU  32          HD22      LEU  32  92.098   7.163  -3.535
  261   HD23  LEU  32          HD23      LEU  32  92.011   6.545  -5.185
  262    H    LEU  33           HN       LEU  33  94.546   2.170  -3.583
  263    HA   LEU  33           HA       LEU  33  95.966   2.717  -1.077
  264    HB2  LEU  33           HB2      LEU  33  96.340   0.504  -1.858
  265    HB3  LEU  33           HB1      LEU  33  96.624   1.042  -3.510
  266    HG   LEU  33           HG       LEU  33  98.453   2.225  -1.488
  267   HD11  LEU  33          HD11      LEU  33  98.220  -0.058  -0.593
  268   HD12  LEU  33          HD12      LEU  33  99.814   0.177  -1.305
  269   HD13  LEU  33          HD13      LEU  33  98.581  -0.725  -2.184
  270   HD21  LEU  33          HD21      LEU  33  99.241   0.686  -3.952
  271   HD22  LEU  33          HD22      LEU  33  99.993   2.114  -3.244
  272   HD23  LEU  33          HD23      LEU  33  98.477   2.265  -4.129
  273    H    HIS  34           HN       HIS  34  97.212   4.398  -0.842
  274    HA   HIS  34           HA       HIS  34  97.768   6.079  -3.162
  275    HB2  HIS  34           HB2      HIS  34  97.916   6.462  -0.174
  276    HB3  HIS  34           HB1      HIS  34  98.576   7.664  -1.292
  277    HD2  HIS  34           HD2      HIS  34  95.056   6.135  -0.331
  278    HE1  HIS  34           HE1      HIS  34  94.416   9.632  -2.603
  279    HE2  HIS  34           HE2      HIS  34  93.280   7.815  -1.243
  280    H    ASP  35           HN       ASP  35  99.531   3.909  -1.063
  281    HA   ASP  35           HA       ASP  35 101.679   3.935  -2.839
  282    HB2  ASP  35           HB2      ASP  35 103.453   5.058  -1.541
  283    HB3  ASP  35           HB1      ASP  35 102.124   6.177  -1.855
  284    H    VAL  36           HN       VAL  36 103.587   2.701  -2.084
  285    HA   VAL  36           HA       VAL  36 103.108   0.982   0.239
  286    HB   VAL  36           HB       VAL  36 101.991   0.004  -1.863
  287   HG11  VAL  36          HG11      VAL  36 104.057   0.687  -3.265
  288   HG12  VAL  36          HG12      VAL  36 103.357  -0.904  -3.564
  289   HG13  VAL  36          HG13      VAL  36 104.819  -0.751  -2.588
  290   HG21  VAL  36          HG21      VAL  36 104.163  -1.751  -0.711
  291   HG22  VAL  36          HG22      VAL  36 102.540  -2.213  -1.219
  292   HG23  VAL  36          HG23      VAL  36 102.766  -1.259   0.242
  293    H    SER  37           HN       SER  37 104.918  -0.595   0.528
  294    HA   SER  37           HA       SER  37 107.488   0.273  -0.552
  295    HB2  SER  37           HB2      SER  37 106.959   1.445   1.701
  296    HB3  SER  37           HB1      SER  37 107.157  -0.148   2.419
  297    HG   SER  37           HG       SER  37 109.172   0.610   2.438
  298    H    LEU  38           HN       LEU  38 109.198  -1.415   0.237
  299    HA   LEU  38           HA       LEU  38 108.161  -3.969  -0.439
  300    HB2  LEU  38           HB2      LEU  38 110.577  -4.629   0.556
  301    HB3  LEU  38           HB1      LEU  38 110.383  -3.903  -1.038
  302    HG   LEU  38           HG       LEU  38 110.618  -2.072   1.324
  303   HD11  LEU  38          HD11      LEU  38 113.145  -2.142   0.931
  304   HD12  LEU  38          HD12      LEU  38 112.872  -3.671   0.096
  305   HD13  LEU  38          HD13      LEU  38 112.458  -3.512   1.803
  306   HD21  LEU  38          HD21      LEU  38 110.232  -1.461  -1.186
  307   HD22  LEU  38          HD22      LEU  38 111.941  -1.843  -1.379
  308   HD23  LEU  38          HD23      LEU  38 111.444  -0.555  -0.282
  309    H    HIS  39           HN       HIS  39 107.840  -2.282   2.382
  310    HA   HIS  39           HA       HIS  39 107.079  -4.685   3.823
  311    HB2  HIS  39           HB2      HIS  39 109.640  -4.044   4.170
  312    HB3  HIS  39           HB1      HIS  39 108.951  -2.905   5.325
  313    HD2  HIS  39           HD2      HIS  39 106.959  -4.431   7.115
  314    HE1  HIS  39           HE1      HIS  39 109.472  -7.823   7.029
  315    HE2  HIS  39           HE2      HIS  39 107.522  -6.724   8.229
  316    H    GLY  40           HN       GLY  40 105.583  -2.419   2.855
  317    HA2  GLY  40           HA2      GLY  40 104.053  -1.816   5.152
  318    HA3  GLY  40           HA1      GLY  40 105.106  -0.454   4.804
  319    H    ILE  41           HN       ILE  41 102.244  -0.363   4.705
  320    HA   ILE  41           HA       ILE  41 101.872   0.537   1.937
  321    HB   ILE  41           HB       ILE  41 100.815  -1.365   1.353
  322   HG12  ILE  41          HG12      ILE  41  98.736  -0.474   3.381
  323   HG13  ILE  41          HG11      ILE  41  98.896   0.185   1.752
  324   HG21  ILE  41          HG21      ILE  41 101.779  -2.578   3.256
  325   HG22  ILE  41          HG22      ILE  41 100.119  -3.090   2.964
  326   HG23  ILE  41          HG23      ILE  41 100.480  -1.993   4.298
  327   HD11  ILE  41          HD11      ILE  41  97.670  -2.318   2.634
  328   HD12  ILE  41          HD12      ILE  41  98.833  -2.565   1.330
  329   HD13  ILE  41          HD13      ILE  41  97.482  -1.454   1.110
  330    H    LEU  42           HN       LEU  42 100.256   1.998   1.626
  331    HA   LEU  42           HA       LEU  42  98.974   3.110   4.058
  332    HB2  LEU  42           HB2      LEU  42 100.896   4.413   2.676
  333    HB3  LEU  42           HB1      LEU  42  99.497   4.888   1.723
  334    HG   LEU  42           HG       LEU  42  99.511   5.137   4.733
  335   HD11  LEU  42          HD11      LEU  42  99.909   7.685   3.918
  336   HD12  LEU  42          HD12      LEU  42 100.845   6.839   2.687
  337   HD13  LEU  42          HD13      LEU  42 101.230   6.621   4.392
  338   HD21  LEU  42          HD21      LEU  42  97.859   6.209   2.451
  339   HD22  LEU  42          HD22      LEU  42  97.907   7.045   4.001
  340   HD23  LEU  42          HD23      LEU  42  97.321   5.387   3.916
  341    H    VAL  43           HN       VAL  43  96.786   3.624   3.844
  342    HA   VAL  43           HA       VAL  43  95.567   3.414   1.180
  343    HB   VAL  43           HB       VAL  43  93.916   1.790   1.906
  344   HG11  VAL  43          HG11      VAL  43  95.335  -0.143   1.990
  345   HG12  VAL  43          HG12      VAL  43  96.652   0.778   2.716
  346   HG13  VAL  43          HG13      VAL  43  96.197   1.065   1.036
  347   HG21  VAL  43          HG21      VAL  43  94.219   0.689   4.147
  348   HG22  VAL  43          HG22      VAL  43  93.745   2.383   4.259
  349   HG23  VAL  43          HG23      VAL  43  95.423   1.915   4.534
  350    H    GLY  44           HN       GLY  44  93.113   3.735   1.405
  351    HA2  GLY  44           HA2      GLY  44  92.678   6.148   3.075
  352    HA3  GLY  44           HA1      GLY  44  91.748   5.714   1.639
  353    H    GLN  45           HN       GLN  45  90.880   6.252   4.556
  354    HA   GLN  45           HA       GLN  45  89.981   3.675   5.465
  355    HB2  GLN  45           HB2      GLN  45  90.706   5.525   6.978
  356    HB3  GLN  45           HB1      GLN  45  89.257   6.410   6.515
  357    HG2  GLN  45           HG2      GLN  45  88.822   3.599   7.396
  358    HG3  GLN  45           HG1      GLN  45  89.354   4.719   8.645
  359   HE21  GLN  45          HE21      GLN  45  87.528   6.177   6.070
  360   HE22  GLN  45          HE22      GLN  45  86.064   6.314   6.916
  361    HA   PRO  46           HA       PRO  46  86.095   4.532   3.313
  362    HB2  PRO  46           HB2      PRO  46  85.139   2.003   3.090
  363    HB3  PRO  46           HB1      PRO  46  86.525   2.547   2.120
  364    HG2  PRO  46           HG2      PRO  46  86.484   0.873   4.585
  365    HG3  PRO  46           HG1      PRO  46  87.522   0.750   3.158
  366    HD2  PRO  46           HD2      PRO  46  88.233   1.998   5.585
  367    HD3  PRO  46           HD1      PRO  46  89.074   2.203   4.038
  368    H    GLN  47           HN       GLN  47  83.880   4.631   3.936
  369    HA   GLN  47           HA       GLN  47  83.326   4.989   6.638
  370    HB2  GLN  47           HB2      GLN  47  80.881   4.828   5.828
  371    HB3  GLN  47           HB1      GLN  47  81.910   6.081   5.135
  372    HG2  GLN  47           HG2      GLN  47  82.264   4.825   3.136
  373    HG3  GLN  47           HG1      GLN  47  81.583   3.365   3.850
  374   HE21  GLN  47          HE21      GLN  47  80.477   6.788   3.447
  375   HE22  GLN  47          HE22      GLN  47  78.934   6.366   2.881
  376    H    ASP  48           HN       ASP  48  83.533   2.008   4.955
  377    HA   ASP  48           HA       ASP  48  81.733   0.640   6.832
  378    HB2  ASP  48           HB2      ASP  48  83.118  -0.235   4.303
  379    HB3  ASP  48           HB1      ASP  48  82.249  -1.354   5.354
  380    H    TRP  49           HN       TRP  49  84.765   1.632   7.135
  381    HA   TRP  49           HA       TRP  49  86.324  -0.640   7.678
  382    HB2  TRP  49           HB2      TRP  49  87.134   1.734   7.512
  383    HB3  TRP  49           HB1      TRP  49  86.495   1.997   9.132
  384    HD1  TRP  49           HD1      TRP  49  87.757   0.949  11.131
  385    HE1  TRP  49           HE1      TRP  49  90.116  -0.156  11.376
  386    HE3  TRP  49           HE3      TRP  49  88.736   0.079   6.256
  387    HZ2  TRP  49           HZ2      TRP  49  92.174  -1.289   9.564
  388    HZ3  TRP  49           HZ3      TRP  49  90.828  -1.007   5.524
  389    HH2  TRP  49           HH2      TRP  49  92.518  -1.698   7.185
  390    H    ASN  50           HN       ASN  50  84.391  -1.866   8.757
  391    HA   ASN  50           HA       ASN  50  84.213  -1.203  11.615
  392    HB2  ASN  50           HB2      ASN  50  82.096  -1.766  10.490
  393    HB3  ASN  50           HB1      ASN  50  82.755  -3.328  10.012
  394   HD21  ASN  50          HD21      ASN  50  83.866  -4.433  12.190
  395   HD22  ASN  50          HD22      ASN  50  82.794  -4.486  13.506
  396    H    GLY  51           HN       GLY  51  86.483  -1.706  11.948
  397    HA2  GLY  51           HA2      GLY  51  86.872  -4.583  12.447
  398    HA3  GLY  51           HA1      GLY  51  88.076  -3.720  11.497
  399    H    ASP  52           HN       ASP  52  88.714  -5.018  13.851
  400    HA   ASP  52           HA       ASP  52  88.948  -2.962  15.913
  401    HB2  ASP  52           HB2      ASP  52  88.247  -5.297  16.492
  402    HB3  ASP  52           HB1      ASP  52  89.858  -5.838  16.026
  403    HA   PRO  53           HA       PRO  53  93.005  -1.991  14.250
  404    HB2  PRO  53           HB2      PRO  53  93.858  -0.462  16.405
  405    HB3  PRO  53           HB1      PRO  53  92.872   0.144  15.064
  406    HG2  PRO  53           HG2      PRO  53  92.043  -0.694  17.790
  407    HG3  PRO  53           HG1      PRO  53  91.429   0.622  16.773
  408    HD2  PRO  53           HD2      PRO  53  90.087  -1.719  17.087
  409    HD3  PRO  53           HD1      PRO  53  90.012  -0.781  15.578
  410    H    GLN  54           HN       GLN  54  92.363  -3.545  17.271
  411    HA   GLN  54           HA       GLN  54  95.123  -4.109  17.859
  412    HB2  GLN  54           HB2      GLN  54  92.566  -5.234  19.017
  413    HB3  GLN  54           HB1      GLN  54  94.182  -5.600  19.624
  414    HG2  GLN  54           HG2      GLN  54  94.573  -3.297  20.199
  415    HG3  GLN  54           HG1      GLN  54  93.107  -2.782  19.366
  416   HE21  GLN  54          HE21      GLN  54  92.464  -5.719  20.892
  417   HE22  GLN  54          HE22      GLN  54  91.777  -5.116  22.322
  418    H    ARG  55           HN       ARG  55  92.623  -5.638  15.982
  419    HA   ARG  55           HA       ARG  55  94.117  -8.161  15.884
  420    HB2  ARG  55           HB2      ARG  55  91.373  -7.287  15.077
  421    HB3  ARG  55           HB1      ARG  55  92.093  -8.623  14.187
  422    HG2  ARG  55           HG2      ARG  55  91.335  -9.953  15.863
  423    HG3  ARG  55           HG1      ARG  55  92.637  -9.283  16.841
  424    HD2  ARG  55           HD2      ARG  55  90.686  -8.931  18.133
  425    HD3  ARG  55           HD1      ARG  55  91.008  -7.368  17.388
  426    HE   ARG  55           HE       ARG  55  89.276  -8.893  15.730
  427   HH11  ARG  55          HH21      ARG  55  89.410  -7.159  18.721
  428   HH12  ARG  55          HH22      ARG  55  87.732  -6.730  18.705
  429   HH21  ARG  55          HH11      ARG  55  87.077  -8.334  15.703
  430   HH22  ARG  55          HH12      ARG  55  86.410  -7.395  16.996
  431    HA   PRO  56           HA       PRO  56  96.240  -7.236  12.195
  432    HB2  PRO  56           HB2      PRO  56  96.234  -9.680  10.911
  433    HB3  PRO  56           HB1      PRO  56  97.276  -9.284  12.291
  434    HG2  PRO  56           HG2      PRO  56  94.714 -10.803  12.230
  435    HG3  PRO  56           HG1      PRO  56  96.182 -11.100  13.178
  436    HD2  PRO  56           HD2      PRO  56  93.966  -9.932  14.251
  437    HD3  PRO  56           HD1      PRO  56  95.609  -9.549  14.805
  438    H    PHE  57           HN       PHE  57  96.138  -7.071   9.893
  439    HA   PHE  57           HA       PHE  57  93.429  -7.297   8.716
  440    HB2  PHE  57           HB2      PHE  57  95.368  -4.981   8.430
  441    HB3  PHE  57           HB1      PHE  57  93.842  -5.149   7.567
  442    HD1  PHE  57           HD2      PHE  57  95.296  -4.949  11.011
  443    HD2  PHE  57           HD1      PHE  57  91.825  -4.404   8.542
  444    HE1  PHE  57           HE2      PHE  57  94.096  -3.901  12.916
  445    HE2  PHE  57           HE1      PHE  57  90.628  -3.368  10.442
  446    HZ   PHE  57           HZ       PHE  57  91.759  -3.115  12.630
  447    H    GLU  58           HN       GLU  58  93.505  -7.573   6.340
  448    HA   GLU  58           HA       GLU  58  96.189  -8.323   5.355
  449    HB2  GLU  58           HB2      GLU  58  93.552  -9.745   5.032
  450    HB3  GLU  58           HB1      GLU  58  94.810  -9.943   3.812
  451    HG2  GLU  58           HG2      GLU  58  95.586 -10.253   6.689
  452    HG3  GLU  58           HG1      GLU  58  94.668 -11.556   5.938
  453    H    ALA  59           HN       ALA  59  96.763  -7.515   3.307
  454    HA   ALA  59           HA       ALA  59  94.729  -5.789   1.993
  455    HB1  ALA  59           HB1      ALA  59  97.066  -4.752   1.173
  456    HB2  ALA  59           HB2      ALA  59  97.560  -5.371   2.748
  457    HB3  ALA  59           HB3      ALA  59  96.231  -4.217   2.631
  458    H    ARG  60           HN       ARG  60  94.407  -5.987  -0.106
  459    HA   ARG  60           HA       ARG  60  96.194  -7.755  -1.681
  460    HB2  ARG  60           HB2      ARG  60  93.192  -7.611  -1.584
  461    HB3  ARG  60           HB1      ARG  60  94.022  -8.164  -3.038
  462    HG2  ARG  60           HG2      ARG  60  95.317  -9.752  -1.432
  463    HG3  ARG  60           HG1      ARG  60  94.026  -9.399  -0.285
  464    HD2  ARG  60           HD2      ARG  60  92.358 -10.275  -1.762
  465    HD3  ARG  60           HD1      ARG  60  93.496 -10.352  -3.104
  466    HE   ARG  60           HE       ARG  60  94.210 -12.391  -2.286
  467   HH11  ARG  60          HH21      ARG  60  92.608 -10.574   0.180
  468   HH12  ARG  60          HH22      ARG  60  92.670 -11.846   1.354
  469   HH21  ARG  60          HH11      ARG  60  94.304 -14.065  -0.751
  470   HH22  ARG  60          HH12      ARG  60  93.630 -13.824   0.826
  471    H    LEU  61           HN       LEU  61  97.048  -6.723  -3.427
  472    HA   LEU  61           HA       LEU  61  95.767  -4.186  -4.263
  473    HB2  LEU  61           HB2      LEU  61  98.423  -4.333  -5.279
  474    HB3  LEU  61           HB1      LEU  61  97.784  -3.227  -4.065
  475    HG   LEU  61           HG       LEU  61  98.641  -6.033  -3.341
  476   HD11  LEU  61          HD11      LEU  61 100.321  -3.514  -3.469
  477   HD12  LEU  61          HD12      LEU  61 100.577  -5.001  -4.382
  478   HD13  LEU  61          HD13      LEU  61 100.806  -4.990  -2.635
  479   HD21  LEU  61          HD21      LEU  61  98.736  -3.553  -1.629
  480   HD22  LEU  61          HD22      LEU  61  98.585  -5.236  -1.128
  481   HD23  LEU  61          HD23      LEU  61  97.211  -4.407  -1.857
  482    H    TYR  62           HN       TYR  62  95.508  -3.731  -6.422
  483    HA   TYR  62           HA       TYR  62  95.971  -5.979  -8.287
  484    HB2  TYR  62           HB2      TYR  62  93.625  -4.064  -8.352
  485    HB3  TYR  62           HB1      TYR  62  93.881  -5.465  -9.391
  486    HD1  TYR  62           HD1      TYR  62  93.430  -4.463  -5.815
  487    HD2  TYR  62           HD2      TYR  62  93.142  -7.605  -8.732
  488    HE1  TYR  62           HE1      TYR  62  92.304  -5.916  -4.143
  489    HE2  TYR  62           HE2      TYR  62  92.018  -9.053  -7.061
  490    HH   TYR  62           HH       TYR  62  92.043  -8.461  -3.804
  491    H    LEU  63           HN       LEU  63  97.588  -5.360  -9.552
  492    HA   LEU  63           HA       LEU  63  97.721  -2.559 -10.475
  493    HB2  LEU  63           HB2      LEU  63  99.705  -3.868  -9.337
  494    HB3  LEU  63           HB1      LEU  63  99.912  -4.561 -10.942
  495    HG   LEU  63           HG       LEU  63  99.876  -1.603 -10.273
  496   HD11  LEU  63          HD11      LEU  63 102.084  -3.511 -11.094
  497   HD12  LEU  63          HD12      LEU  63 101.953  -2.629  -9.572
  498   HD13  LEU  63          HD13      LEU  63 102.259  -1.756 -11.074
  499   HD21  LEU  63          HD21      LEU  63 100.026  -3.143 -12.871
  500   HD22  LEU  63          HD22      LEU  63 100.686  -1.514 -12.734
  501   HD23  LEU  63          HD23      LEU  63  98.969  -1.794 -12.456
  502    H    GLY  64           HN       GLY  64  99.082  -5.393 -12.080
  503    HA2  GLY  64           HA2      GLY  64  97.954  -4.600 -14.609
  504    HA3  GLY  64           HA1      GLY  64  98.903  -6.055 -14.298
  505    H    LEU  65           HN       LEU  65  96.793  -6.467 -15.917
  506    HA   LEU  65           HA       LEU  65  94.381  -7.007 -14.492
  507    HB2  LEU  65           HB2      LEU  65  95.398  -7.726 -17.235
  508    HB3  LEU  65           HB1      LEU  65  93.892  -8.414 -16.628
  509    HG   LEU  65           HG       LEU  65  92.946  -6.202 -16.302
  510   HD11  LEU  65          HD11      LEU  65  95.743  -5.302 -17.004
  511   HD12  LEU  65          HD12      LEU  65  94.785  -4.889 -15.582
  512   HD13  LEU  65          HD13      LEU  65  94.359  -4.219 -17.157
  513   HD21  LEU  65          HD21      LEU  65  92.740  -5.531 -18.590
  514   HD22  LEU  65          HD22      LEU  65  93.011  -7.274 -18.625
  515   HD23  LEU  65          HD23      LEU  65  94.335  -6.168 -18.992
  516    H    ASP  66           HN       ASP  66  97.263  -8.866 -15.309
  517    HA   ASP  66           HA       ASP  66  96.185 -11.352 -14.146
  518    HB2  ASP  66           HB2      ASP  66  98.789 -10.845 -15.565
  519    HB3  ASP  66           HB1      ASP  66  98.009 -12.392 -15.235
  520    H    VAL  67           HN       VAL  67  97.486  -8.647 -12.925
  521    HA   VAL  67           HA       VAL  67  99.484 -10.040 -11.241
  522    HB   VAL  67           HB       VAL  67  99.171  -7.153 -12.044
  523   HG11  VAL  67          HG11      VAL  67 100.572  -8.334  -9.654
  524   HG12  VAL  67          HG12      VAL  67  99.602  -6.865  -9.751
  525   HG13  VAL  67          HG13      VAL  67 101.224  -6.897 -10.440
  526   HG21  VAL  67          HG21      VAL  67 100.518  -8.917 -13.361
  527   HG22  VAL  67          HG22      VAL  67 101.633  -8.909 -11.992
  528   HG23  VAL  67          HG23      VAL  67 101.366  -7.433 -12.921
  529    H    LEU  68           HN       LEU  68  98.343 -10.902  -9.629
  530    HA   LEU  68           HA       LEU  68  96.723  -9.084  -7.944
  531    HB2  LEU  68           HB2      LEU  68  95.229 -10.767  -8.563
  532    HB3  LEU  68           HB1      LEU  68  96.486 -11.998  -8.635
  533    HG   LEU  68           HG       LEU  68  96.654 -12.023  -6.199
  534   HD11  LEU  68          HD11      LEU  68  96.198  -9.958  -5.299
  535   HD12  LEU  68          HD12      LEU  68  94.588 -10.649  -5.119
  536   HD13  LEU  68          HD13      LEU  68  94.947  -9.595  -6.487
  537   HD21  LEU  68          HD21      LEU  68  93.738 -12.120  -7.026
  538   HD22  LEU  68          HD22      LEU  68  94.495 -13.009  -5.704
  539   HD23  LEU  68          HD23      LEU  68  94.903 -13.396  -7.375
  540    H    ILE  69           HN       ILE  69  97.794  -8.475  -6.157
  541    HA   ILE  69           HA       ILE  69  99.849 -10.310  -5.069
  542    HB   ILE  69           HB       ILE  69  99.626  -7.297  -5.008
  543   HG12  ILE  69          HG12      ILE  69 102.162  -8.405  -5.857
  544   HG13  ILE  69          HG11      ILE  69 100.862  -9.154  -6.783
  545   HG21  ILE  69          HG21      ILE  69 100.620  -7.491  -2.961
  546   HG22  ILE  69          HG22      ILE  69 102.064  -7.866  -3.902
  547   HG23  ILE  69          HG23      ILE  69 101.082  -9.170  -3.235
  548   HD11  ILE  69          HD11      ILE  69 101.425  -6.193  -6.488
  549   HD12  ILE  69          HD12      ILE  69  99.965  -6.841  -7.238
  550   HD13  ILE  69          HD13      ILE  69 101.543  -7.161  -7.959
  551    H    ARG  70           HN       ARG  70  99.932 -10.751  -2.900
  552    HA   ARG  70           HA       ARG  70  97.707  -9.745  -1.231
  553    HB2  ARG  70           HB2      ARG  70  98.735 -12.583  -1.058
  554    HB3  ARG  70           HB1      ARG  70  97.264 -11.913  -0.356
  555    HG2  ARG  70           HG2      ARG  70  96.210 -11.725  -2.493
  556    HG3  ARG  70           HG1      ARG  70  97.725 -12.016  -3.345
  557    HD2  ARG  70           HD2      ARG  70  97.259 -14.222  -3.371
  558    HD3  ARG  70           HD1      ARG  70  97.321 -14.241  -1.611
  559    HE   ARG  70           HE       ARG  70  94.815 -13.293  -2.171
  560   HH11  ARG  70          HH21      ARG  70  96.695 -16.037  -3.112
  561   HH12  ARG  70          HH22      ARG  70  95.328 -17.086  -3.295
  562   HH21  ARG  70          HH11      ARG  70  93.015 -14.661  -2.408
  563   HH22  ARG  70          HH12      ARG  70  93.245 -16.307  -2.896
  564    H    MET  71           HN       MET  71  98.287  -9.008   0.710
  565    HA   MET  71           HA       MET  71 100.846  -9.863   1.893
  566    HB2  MET  71           HB2      MET  71 100.138  -6.951   2.011
  567    HB3  MET  71           HB1      MET  71 101.716  -7.721   2.130
  568    HG2  MET  71           HG2      MET  71 101.894  -7.984  -0.208
  569    HG3  MET  71           HG1      MET  71 100.162  -7.793  -0.457
  570    HE1  MET  71           HE1      MET  71 103.141  -6.109   1.252
  571    HE2  MET  71           HE2      MET  71 101.826  -5.376   2.164
  572    HE3  MET  71           HE3      MET  71 102.818  -4.376   1.105
  573    H    GLU  72           HN       GLU  72 100.922  -9.671   4.151
  574    HA   GLU  72           HA       GLU  72  98.287  -9.263   5.400
  575    HB2  GLU  72           HB2      GLU  72  99.342 -11.500   5.758
  576    HB3  GLU  72           HB1      GLU  72 100.704 -10.699   6.543
  577    HG2  GLU  72           HG2      GLU  72  99.401  -9.991   8.368
  578    HG3  GLU  72           HG1      GLU  72  97.888 -10.194   7.489
  579    H    ILE  73           HN       ILE  73  98.074  -7.551   6.848
  580    HA   ILE  73           HA       ILE  73 100.570  -6.273   7.758
  581    HB   ILE  73           HB       ILE  73  99.980  -4.165   6.932
  582   HG12  ILE  73          HG12      ILE  73  97.232  -5.391   6.624
  583   HG13  ILE  73          HG11      ILE  73  97.686  -3.946   7.517
  584   HG21  ILE  73          HG21      ILE  73 100.663  -5.954   5.226
  585   HG22  ILE  73          HG22      ILE  73  99.862  -4.530   4.578
  586   HG23  ILE  73          HG23      ILE  73  98.960  -6.030   4.778
  587   HD11  ILE  73          HD11      ILE  73  96.893  -2.860   5.680
  588   HD12  ILE  73          HD12      ILE  73  97.072  -4.275   4.654
  589   HD13  ILE  73          HD13      ILE  73  98.465  -3.251   4.985
  590    H    SER  74           HN       SER  74 100.329  -4.769   9.470
  591    HA   SER  74           HA       SER  74  97.860  -5.062  11.105
  592    HB2  SER  74           HB2      SER  74  99.687  -4.444  12.969
  593    HB3  SER  74           HB1      SER  74  99.364  -6.110  12.504
  594    HG   SER  74           HG       SER  74 101.635  -4.800  12.335
  595    H    LEU  75           HN       LEU  75  97.139  -3.239  12.206
  596    HA   LEU  75           HA       LEU  75  97.514  -0.790  10.823
  597    HB2  LEU  75           HB2      LEU  75  95.446  -1.512  12.123
  598    HB3  LEU  75           HB1      LEU  75  96.335  -1.089  13.586
  599    HG   LEU  75           HG       LEU  75  96.726   1.196  12.516
  600   HD11  LEU  75          HD11      LEU  75  96.206   0.755  10.216
  601   HD12  LEU  75          HD12      LEU  75  94.928   1.802  10.829
  602   HD13  LEU  75          HD13      LEU  75  94.635   0.076  10.644
  603   HD21  LEU  75          HD21      LEU  75  95.017   0.645  14.306
  604   HD22  LEU  75          HD22      LEU  75  93.828   0.498  13.012
  605   HD23  LEU  75          HD23      LEU  75  94.622   2.043  13.308
  606    H    ALA  76           HN       ALA  76  99.004   0.674  10.987
  607    HA   ALA  76           HA       ALA  76 100.836   0.594  13.274
  608    HB1  ALA  76           HB1      ALA  76 102.358   1.934  11.834
  609    HB2  ALA  76           HB2      ALA  76 101.172   1.810  10.531
  610    HB3  ALA  76           HB3      ALA  76 101.961   0.361  11.150
  611    H    TRP  77           HN       TRP  77  98.907   2.833  11.345
  612    HA   TRP  77           HA       TRP  77  98.341   4.509  13.635
  613    HB2  TRP  77           HB2      TRP  77  99.429   6.551  12.754
  614    HB3  TRP  77           HB1      TRP  77 100.635   5.292  13.053
  615    HD1  TRP  77           HD1      TRP  77 101.829   4.212  10.997
  616    HE1  TRP  77           HE1      TRP  77 101.724   4.590   8.454
  617    HE3  TRP  77           HE3      TRP  77  98.006   7.588  10.745
  618    HZ2  TRP  77           HZ2      TRP  77 100.420   6.293   6.604
  619    HZ3  TRP  77           HZ3      TRP  77  97.363   8.590   8.569
  620    HH2  TRP  77           HH2      TRP  77  98.548   7.935   6.490
  621    H    ALA  78           HN       ALA  78  97.065   6.497  12.910
  622    HA   ALA  78           HA       ALA  78  95.807   6.284  10.258
  623    HB1  ALA  78           HB1      ALA  78  94.291   6.065  12.864
  624    HB2  ALA  78           HB2      ALA  78  94.378   4.858  11.580
  625    HB3  ALA  78           HB3      ALA  78  93.540   6.385  11.301
  626    H    ARG  79           HN       ARG  79  95.734   8.378   9.484
  627    HA   ARG  79           HA       ARG  79  94.915  10.496  11.291
  628    HB2  ARG  79           HB2      ARG  79  97.363  10.346  11.647
  629    HB3  ARG  79           HB1      ARG  79  97.620  10.602   9.924
  630    HG2  ARG  79           HG2      ARG  79  96.573  12.819  10.075
  631    HG3  ARG  79           HG1      ARG  79  96.247  12.563  11.791
  632    HD2  ARG  79           HD2      ARG  79  98.493  12.731  12.380
  633    HD3  ARG  79           HD1      ARG  79  99.055  12.279  10.774
  634    HE   ARG  79           HE       ARG  79  97.633  14.817  10.925
  635   HH11  ARG  79          HH21      ARG  79 100.642  13.111  11.020
  636   HH12  ARG  79          HH22      ARG  79 101.596  14.490  10.583
  637   HH21  ARG  79          HH11      ARG  79  98.879  16.630  10.350
  638   HH22  ARG  79          HH12      ARG  79 100.598  16.481  10.204
  639    H    ASP  80           HN       ASP  80  93.769  12.058  10.341
  640    HA   ASP  80           HA       ASP  80  92.688  13.257   8.725
  641    HB2  ASP  80           HB2      ASP  80  95.025  14.042   8.410
  642    HB3  ASP  80           HB1      ASP  80  95.222  12.829   7.145
  643    H    GLY  81           HN       GLY  81  91.794  10.615   8.616
  644    HA2  GLY  81           HA2      GLY  81  90.397   9.501   7.167
  645    HA3  GLY  81           HA1      GLY  81  90.961  10.535   5.865
  646    H    LEU  82           HN       LEU  82  93.847   9.770   6.479
  647    HA   LEU  82           HA       LEU  82  93.781   7.344   4.871
  648    HB2  LEU  82           HB2      LEU  82  96.294   8.703   5.793
  649    HB3  LEU  82           HB1      LEU  82  95.977   7.826   4.296
  650    HG   LEU  82           HG       LEU  82  94.866  10.539   5.055
  651   HD11  LEU  82          HD11      LEU  82  96.686   9.702   2.777
  652   HD12  LEU  82          HD12      LEU  82  97.256  10.430   4.279
  653   HD13  LEU  82          HD13      LEU  82  96.206  11.347   3.197
  654   HD21  LEU  82          HD21      LEU  82  94.007  10.398   2.629
  655   HD22  LEU  82          HD22      LEU  82  93.141   9.442   3.832
  656   HD23  LEU  82          HD23      LEU  82  94.296   8.662   2.751
  657    H    LEU  83           HN       LEU  83  95.232   5.554   5.377
  658    HA   LEU  83           HA       LEU  83  95.593   5.082   8.302
  659    HB2  LEU  83           HB2      LEU  83  94.540   3.102   6.299
  660    HB3  LEU  83           HB1      LEU  83  94.750   2.864   8.030
  661    HG   LEU  83           HG       LEU  83  92.952   4.994   6.846
  662   HD11  LEU  83          HD11      LEU  83  91.126   3.369   7.612
  663   HD12  LEU  83          HD12      LEU  83  92.392   2.146   7.699
  664   HD13  LEU  83          HD13      LEU  83  92.010   2.913   6.157
  665   HD21  LEU  83          HD21      LEU  83  91.949   4.677   9.236
  666   HD22  LEU  83          HD22      LEU  83  93.450   5.589   9.080
  667   HD23  LEU  83          HD23      LEU  83  93.490   3.910   9.616
  668    H    GLY  84           HN       GLY  84  97.588   4.164   8.775
  669    HA2  GLY  84           HA2      GLY  84  99.247   3.299   6.503
  670    HA3  GLY  84           HA1      GLY  84  99.832   3.765   8.091
  671    H    PHE  85           HN       PHE  85 100.413   1.339   6.663
  672    HA   PHE  85           HA       PHE  85  99.585  -0.549   8.744
  673    HB2  PHE  85           HB2      PHE  85  99.057  -0.860   5.792
  674    HB3  PHE  85           HB1      PHE  85  99.171  -2.245   6.875
  675    HD1  PHE  85           HD2      PHE  85  97.710  -2.261   8.970
  676    HD2  PHE  85           HD1      PHE  85  97.051   0.384   5.660
  677    HE1  PHE  85           HE2      PHE  85  95.389  -1.890   9.742
  678    HE2  PHE  85           HE1      PHE  85  94.721   0.760   6.433
  679    HZ   PHE  85           HZ       PHE  85  93.901  -0.366   8.477
  680    H    GLU  86           HN       GLU  86 101.138  -2.039   9.242
  681    HA   GLU  86           HA       GLU  86 103.666  -1.810   7.743
  682    HB2  GLU  86           HB2      GLU  86 104.716  -2.696   9.760
  683    HB3  GLU  86           HB1      GLU  86 103.697  -1.323  10.189
  684    HG2  GLU  86           HG2      GLU  86 101.843  -3.048  10.634
  685    HG3  GLU  86           HG1      GLU  86 103.120  -4.262  10.575
  686    H    CYS  87           HN       CYS  87 104.371  -3.518   6.577
  687    HA   CYS  87           HA       CYS  87 102.679  -5.828   6.322
  688    HB2  CYS  87           HB2      CYS  87 104.093  -4.641   4.500
  689    HB3  CYS  87           HB1      CYS  87 105.427  -5.607   5.128
  690    HG   CYS  87           HG       CYS  87 102.791  -6.959   4.113
  691    H    GLN  88           HN       GLN  88 102.776  -7.650   7.423
  692    HA   GLN  88           HA       GLN  88 105.168  -8.213   9.052
  693    HB2  GLN  88           HB2      GLN  88 103.144 -10.069   9.685
  694    HB3  GLN  88           HB1      GLN  88 103.638  -8.670  10.636
  695    HG2  GLN  88           HG2      GLN  88 102.055  -7.265   9.293
  696    HG3  GLN  88           HG1      GLN  88 101.492  -8.735   8.498
  697   HE21  GLN  88          HE21      GLN  88 101.210  -6.789  11.353
  698   HE22  GLN  88          HE22      GLN  88 100.153  -7.816  12.198
  699    H    HIS  89           HN       HIS  89 103.201  -9.445   6.427
  700    HA   HIS  89           HA       HIS  89 105.292 -11.263   5.671
  701    HB2  HIS  89           HB2      HIS  89 104.491 -13.249   6.387
  702    HB3  HIS  89           HB1      HIS  89 103.498 -12.305   7.493
  703    HD2  HIS  89           HD2      HIS  89 100.874 -13.066   7.239
  704    HE1  HIS  89           HE1      HIS  89 100.908 -14.092   3.144
  705    HE2  HIS  89           HE2      HIS  89  99.464 -13.955   5.229
  706    H    ILE  90           HN       ILE  90 105.180 -11.810   3.555
  707    HA   ILE  90           HA       ILE  90 102.754 -11.293   1.977
  708    HB   ILE  90           HB       ILE  90 103.825  -9.127   1.925
  709   HG12  ILE  90          HG12      ILE  90 104.592 -10.656  -0.587
  710   HG13  ILE  90          HG11      ILE  90 102.972 -10.062  -0.236
  711   HG21  ILE  90          HG21      ILE  90 106.233  -9.020   1.057
  712   HG22  ILE  90          HG22      ILE  90 106.319 -10.748   1.400
  713   HG23  ILE  90          HG23      ILE  90 106.019  -9.605   2.706
  714   HD11  ILE  90          HD11      ILE  90 105.465  -8.497  -0.847
  715   HD12  ILE  90          HD12      ILE  90 104.179  -7.757   0.102
  716   HD13  ILE  90          HD13      ILE  90 103.851  -8.323  -1.533
  717    H    ASP  91           HN       ASP  91 102.548 -12.471   0.226
  718    HA   ASP  91           HA       ASP  91 103.817 -14.934   0.078
  719    HB2  ASP  91           HB2      ASP  91 101.898 -15.065  -1.116
  720    HB3  ASP  91           HB1      ASP  91 101.987 -13.386  -1.636
  721    H    LEU  92           HN       LEU  92 105.445 -15.802  -1.023
  722    HA   LEU  92           HA       LEU  92 107.747 -14.335  -1.601
  723    HB2  LEU  92           HB2      LEU  92 107.382 -16.914  -1.315
  724    HB3  LEU  92           HB1      LEU  92 107.190 -16.893  -3.067
  725    HG   LEU  92           HG       LEU  92 109.417 -15.427  -2.943
  726   HD11  LEU  92          HD11      LEU  92 109.321 -15.564  -0.389
  727   HD12  LEU  92          HD12      LEU  92 110.859 -16.006  -1.130
  728   HD13  LEU  92          HD13      LEU  92 109.760 -17.263  -0.563
  729   HD21  LEU  92          HD21      LEU  92 109.333 -17.473  -4.194
  730   HD22  LEU  92          HD22      LEU  92 109.188 -18.440  -2.727
  731   HD23  LEU  92          HD23      LEU  92 110.706 -17.622  -3.097
  732    H    ASP  93           HN       ASP  93 105.210 -15.461  -3.821
  733    HA   ASP  93           HA       ASP  93 106.462 -14.433  -6.170
  734    HB2  ASP  93           HB2      ASP  93 104.564 -16.210  -5.949
  735    HB3  ASP  93           HB1      ASP  93 103.489 -14.816  -5.913
  736    H    SER  94           HN       SER  94 104.146 -13.206  -3.832
  737    HA   SER  94           HA       SER  94 103.416 -10.832  -5.199
  738    HB2  SER  94           HB2      SER  94 103.328 -11.762  -2.353
  739    HB3  SER  94           HB1      SER  94 103.001 -10.074  -2.716
  740    HG   SER  94           HG       SER  94 101.719 -11.680  -4.453
  741    H    ILE  95           HN       ILE  95 106.027 -11.672  -2.993
  742    HA   ILE  95           HA       ILE  95 107.060  -9.110  -2.502
  743    HB   ILE  95           HB       ILE  95 108.344 -11.844  -2.599
  744   HG12  ILE  95          HG12      ILE  95 107.855  -9.927  -0.304
  745   HG13  ILE  95          HG11      ILE  95 106.735 -11.207  -0.764
  746   HG21  ILE  95          HG21      ILE  95 110.265 -10.609  -1.388
  747   HG22  ILE  95          HG22      ILE  95 109.590  -9.139  -2.089
  748   HG23  ILE  95          HG23      ILE  95 110.170 -10.431  -3.140
  749   HD11  ILE  95          HD11      ILE  95 109.524 -12.114  -0.448
  750   HD12  ILE  95          HD12      ILE  95 108.030 -12.834   0.152
  751   HD13  ILE  95          HD13      ILE  95 108.787 -11.510   1.036
  752    H    SER  96           HN       SER  96 107.534 -11.365  -5.163
  753    HA   SER  96           HA       SER  96 109.616  -9.837  -6.363
  754    HB2  SER  96           HB2      SER  96 108.558 -12.373  -6.790
  755    HB3  SER  96           HB1      SER  96 108.046 -11.486  -8.225
  756    HG   SER  96           HG       SER  96 110.548 -10.808  -7.733
  757    H    HIS  97           HN       HIS  97 106.113  -9.970  -6.853
  758    HA   HIS  97           HA       HIS  97 106.109  -8.248  -9.095
  759    HB2  HIS  97           HB2      HIS  97 104.035  -8.981  -7.035
  760    HB3  HIS  97           HB1      HIS  97 103.709  -7.748  -8.238
  761    HD2  HIS  97           HD2      HIS  97 103.847 -11.595  -7.974
  762    HE1  HIS  97           HE1      HIS  97 103.207 -10.627 -12.031
  763    HE2  HIS  97           HE2      HIS  97 103.254 -12.524 -10.343
  764    H    LEU  98           HN       LEU  98 105.842  -7.622  -5.613
  765    HA   LEU  98           HA       LEU  98 105.565  -4.786  -5.905
  766    HB2  LEU  98           HB2      LEU  98 105.499  -6.643  -3.768
  767    HB3  LEU  98           HB1      LEU  98 106.827  -5.543  -3.407
  768    HG   LEU  98           HG       LEU  98 104.062  -4.602  -4.209
  769   HD11  LEU  98          HD11      LEU  98 103.979  -4.000  -1.692
  770   HD12  LEU  98          HD12      LEU  98 105.262  -5.196  -1.506
  771   HD13  LEU  98          HD13      LEU  98 103.690  -5.681  -2.143
  772   HD21  LEU  98          HD21      LEU  98 105.765  -2.864  -2.571
  773   HD22  LEU  98          HD22      LEU  98 104.928  -2.511  -4.082
  774   HD23  LEU  98          HD23      LEU  98 106.514  -3.275  -4.114
  775    H    ARG  99           HN       ARG  99 108.337  -6.949  -5.610
  776    HA   ARG  99           HA       ARG  99 110.257  -4.879  -5.258
  777    HB2  ARG  99           HB2      ARG  99 110.312  -7.771  -5.871
  778    HB3  ARG  99           HB1      ARG  99 111.698  -6.854  -6.455
  779    HG2  ARG  99           HG2      ARG  99 112.085  -5.955  -4.209
  780    HG3  ARG  99           HG1      ARG  99 110.657  -6.798  -3.606
  781    HD2  ARG  99           HD2      ARG  99 111.675  -8.960  -4.166
  782    HD3  ARG  99           HD1      ARG  99 113.090  -8.141  -4.818
  783    HE   ARG  99           HE       ARG  99 112.418  -8.477  -1.998
  784   HH11  ARG  99          HH21      ARG  99 114.319  -6.892  -4.421
  785   HH12  ARG  99          HH22      ARG  99 115.581  -6.437  -3.326
  786   HH21  ARG  99          HH11      ARG  99 114.067  -7.880  -0.560
  787   HH22  ARG  99          HH12      ARG  99 115.439  -6.996  -1.141
  788    H    ARG 100           HN       ARG 100 108.932  -6.488  -8.128
  789    HA   ARG 100           HA       ARG 100 110.623  -4.996  -9.944
  790    HB2  ARG 100           HB2      ARG 100 109.668  -6.214 -11.660
  791    HB3  ARG 100           HB1      ARG 100 109.256  -7.295 -10.332
  792    HG2  ARG 100           HG2      ARG 100 107.072  -6.021 -10.119
  793    HG3  ARG 100           HG1      ARG 100 107.480  -5.215 -11.631
  794    HD2  ARG 100           HD2      ARG 100 107.552  -7.336 -12.804
  795    HD3  ARG 100           HD1      ARG 100 107.343  -8.221 -11.298
  796    HE   ARG 100           HE       ARG 100 105.066  -7.487 -11.224
  797   HH11  ARG 100          HH21      ARG 100 106.807  -6.484 -14.055
  798   HH12  ARG 100          HH22      ARG 100 105.379  -6.141 -14.971
  799   HH21  ARG 100          HH11      ARG 100 103.203  -7.027 -12.423
  800   HH22  ARG 100          HH12      ARG 100 103.342  -6.447 -14.049
  801    H    LEU 101           HN       LEU 101 107.394  -4.497  -8.575
  802    HA   LEU 101           HA       LEU 101 106.618  -2.296 -10.171
  803    HB2  LEU 101           HB2      LEU 101 105.010  -3.264  -8.720
  804    HB3  LEU 101           HB1      LEU 101 106.079  -3.143  -7.329
  805    HG   LEU 101           HG       LEU 101 105.913  -0.696  -7.393
  806   HD11  LEU 101          HD11      LEU 101 105.635  -0.209  -9.709
  807   HD12  LEU 101          HD12      LEU 101 104.105   0.245  -8.961
  808   HD13  LEU 101          HD13      LEU 101 104.238  -1.277  -9.841
  809   HD21  LEU 101          HD21      LEU 101 104.134  -2.290  -6.318
  810   HD22  LEU 101          HD22      LEU 101 103.089  -1.702  -7.612
  811   HD23  LEU 101          HD23      LEU 101 103.782  -0.567  -6.453
  812    H    VAL 102           HN       VAL 102 108.619  -2.585  -7.268
  813    HA   VAL 102           HA       VAL 102 109.013   0.195  -6.873
  814    HB   VAL 102           HB       VAL 102 110.507  -2.254  -5.941
  815   HG11  VAL 102          HG11      VAL 102 112.199  -0.578  -5.982
  816   HG12  VAL 102          HG12      VAL 102 111.593  -0.578  -4.325
  817   HG13  VAL 102          HG13      VAL 102 111.077   0.675  -5.453
  818   HG21  VAL 102          HG21      VAL 102 108.198  -1.701  -5.062
  819   HG22  VAL 102          HG22      VAL 102 108.872  -0.201  -4.425
  820   HG23  VAL 102          HG23      VAL 102 109.456  -1.753  -3.826
  821    H    GLU 103           HN       GLU 103 110.764  -2.263  -8.697
  822    HA   GLU 103           HA       GLU 103 113.103  -0.819  -9.239
  823    HB2  GLU 103           HB2      GLU 103 112.552  -3.284  -9.746
  824    HB3  GLU 103           HB1      GLU 103 111.825  -2.679 -11.234
  825    HG2  GLU 103           HG2      GLU 103 114.005  -1.482 -11.699
  826    HG3  GLU 103           HG1      GLU 103 114.698  -2.359 -10.337
  827    H    LEU 104           HN       LEU 104 109.981  -0.852 -10.931
  828    HA   LEU 104           HA       LEU 104 110.802   0.760 -13.111
  829    HB2  LEU 104           HB2      LEU 104 108.031   0.482 -11.923
  830    HB3  LEU 104           HB1      LEU 104 108.419   1.071 -13.540
  831    HG   LEU 104           HG       LEU 104 109.121  -1.694 -12.506
  832   HD11  LEU 104          HD11      LEU 104 107.282  -2.523 -13.808
  833   HD12  LEU 104          HD12      LEU 104 106.989  -0.935 -14.518
  834   HD13  LEU 104          HD13      LEU 104 106.645  -1.214 -12.812
  835   HD21  LEU 104          HD21      LEU 104 110.656  -1.209 -14.220
  836   HD22  LEU 104          HD22      LEU 104 109.491  -0.240 -15.123
  837   HD23  LEU 104          HD23      LEU 104 109.345  -1.996 -15.097
  838    H    ASN 105           HN       ASN 105 109.428   1.552  -9.947
  839    HA   ASN 105           HA       ASN 105 109.095   4.332 -10.464
  840    HB2  ASN 105           HB2      ASN 105 109.052   2.562  -8.077
  841    HB3  ASN 105           HB1      ASN 105 109.372   4.269  -7.780
  842   HD21  ASN 105          HD21      ASN 105 106.976   2.030  -9.206
  843   HD22  ASN 105          HD22      ASN 105 105.678   3.122  -9.129
  844    H    LEU 106           HN       LEU 106 111.657   2.495  -8.804
  845    HA   LEU 106           HA       LEU 106 113.315   4.696  -8.214
  846    HB2  LEU 106           HB2      LEU 106 113.424   1.847  -7.971
  847    HB3  LEU 106           HB1      LEU 106 114.927   2.380  -8.721
  848    HG   LEU 106           HG       LEU 106 115.084   4.129  -6.872
  849   HD11  LEU 106          HD11      LEU 106 113.758   3.792  -4.877
  850   HD12  LEU 106          HD12      LEU 106 113.023   2.339  -5.552
  851   HD13  LEU 106          HD13      LEU 106 112.644   3.917  -6.237
  852   HD21  LEU 106          HD21      LEU 106 116.493   2.180  -6.782
  853   HD22  LEU 106          HD22      LEU 106 115.151   1.165  -6.255
  854   HD23  LEU 106          HD23      LEU 106 115.807   2.390  -5.171
  855    H    GLY 107           HN       GLY 107 113.104   2.602 -11.056
  856    HA2  GLY 107           HA2      GLY 107 113.606   4.118 -13.119
  857    HA3  GLY 107           HA1      GLY 107 115.214   4.155 -12.399
  858    H    ASP 108           HN       ASP 108 116.318   3.027 -13.959
  859    HA   ASP 108           HA       ASP 108 116.227   0.193 -13.870
  860    HB2  ASP 108           HB2      ASP 108 114.229   0.419 -15.235
  861    HB3  ASP 108           HB1      ASP 108 115.078   1.481 -16.356
  862    H    GLU 109           HN       GLU 109 118.419   0.276 -13.628
  863    HA   GLU 109           HA       GLU 109 120.639   0.586 -14.164
  864    HB2  GLU 109           HB2      GLU 109 119.467   0.036 -16.902
  865    HB3  GLU 109           HB1      GLU 109 121.190   0.001 -16.524
  866    HG2  GLU 109           HG2      GLU 109 119.172  -1.660 -15.005
  867    HG3  GLU 109           HG1      GLU 109 119.978  -2.253 -16.458
  868    H    GLU 110           HN       GLU 110 120.824   2.775 -13.590
  869    HA   GLU 110           HA       GLU 110 121.189   4.576 -15.884
  870    HB2  GLU 110           HB2      GLU 110 119.091   4.805 -13.881
  871    HB3  GLU 110           HB1      GLU 110 120.139   6.221 -13.867
  872    HG2  GLU 110           HG2      GLU 110 119.842   6.439 -16.322
  873    HG3  GLU 110           HG1      GLU 110 118.741   5.062 -16.296
  874    H    LEU 111           HN       LEU 111 121.623   3.975 -12.427
  875    HA   LEU 111           HA       LEU 111 123.263   4.616 -10.953
  876    HB2  LEU 111           HB2      LEU 111 124.803   4.268 -13.524
  877    HB3  LEU 111           HB1      LEU 111 125.601   4.651 -12.002
  878    HG   LEU 111           HG       LEU 111 125.529   2.195 -12.498
  879   HD11  LEU 111          HD11      LEU 111 125.251   1.632 -10.278
  880   HD12  LEU 111          HD12      LEU 111 123.767   2.568 -10.109
  881   HD13  LEU 111          HD13      LEU 111 125.329   3.384 -10.111
  882   HD21  LEU 111          HD21      LEU 111 123.486   1.004 -12.576
  883   HD22  LEU 111          HD22      LEU 111 123.183   2.432 -13.564
  884   HD23  LEU 111          HD23      LEU 111 122.571   2.356 -11.911
  885    H    LEU 112           HN       LEU 112 122.108   6.727 -10.835
  886    HA   LEU 112           HA       LEU 112 123.305   8.961 -12.256
  887    HB2  LEU 112           HB2      LEU 112 120.850   8.822 -11.677
  888    HB3  LEU 112           HB1      LEU 112 121.307   9.047  -9.990
  889    HG   LEU 112           HG       LEU 112 122.507  11.161 -10.685
  890   HD11  LEU 112          HD11      LEU 112 122.879  11.099 -12.972
  891   HD12  LEU 112          HD12      LEU 112 121.390  12.041 -12.941
  892   HD13  LEU 112          HD13      LEU 112 121.335  10.319 -13.313
  893   HD21  LEU 112          HD21      LEU 112 120.199  11.100  -9.692
  894   HD22  LEU 112          HD22      LEU 112 119.544  11.104 -11.330
  895   HD23  LEU 112          HD23      LEU 112 120.472  12.486 -10.748
  896    H    GLU 113           HN       GLU 113 125.363   9.352 -11.602
  897    HA   GLU 113           HA       GLU 113 126.407   8.994  -9.029
  898    HB2  GLU 113           HB2      GLU 113 127.273  10.952 -11.172
  899    HB3  GLU 113           HB1      GLU 113 128.235  10.478  -9.770
  900    HG2  GLU 113           HG2      GLU 113 127.915   8.058 -10.576
  901    HG3  GLU 113           HG1      GLU 113 127.355   8.759 -12.093
  902    H    ARG 114           HN       ARG 114 124.627   9.837  -7.722
  903    HA   ARG 114           HA       ARG 114 125.216  12.393  -6.648
  904    HB2  ARG 114           HB2      ARG 114 124.024  13.097  -8.740
  905    HB3  ARG 114           HB1      ARG 114 122.595  12.245  -8.156
  906    HG2  ARG 114           HG2      ARG 114 122.283  13.730  -6.364
  907    HG3  ARG 114           HG1      ARG 114 123.954  14.291  -6.410
  908    HD2  ARG 114           HD2      ARG 114 122.437  16.000  -7.321
  909    HD3  ARG 114           HD1      ARG 114 123.530  15.402  -8.566
  910    HE   ARG 114           HE       ARG 114 120.948  14.060  -8.423
  911   HH11  ARG 114          HH21      ARG 114 122.902  16.563  -9.801
  912   HH12  ARG 114          HH22      ARG 114 121.928  16.731 -11.223
  913   HH21  ARG 114          HH11      ARG 114 119.666  14.276 -10.283
  914   HH22  ARG 114          HH12      ARG 114 120.096  15.434 -11.496
  915    H    GLU 115           HN       GLU 115 122.027  10.899  -7.091
  916    HA   GLU 115           HA       GLU 115 121.709  10.691  -4.202
  917    HB2  GLU 115           HB2      GLU 115 119.448   9.592  -5.145
  918    HB3  GLU 115           HB1      GLU 115 119.675  11.338  -5.060
  919    HG2  GLU 115           HG2      GLU 115 120.297  11.458  -7.374
  920    HG3  GLU 115           HG1      GLU 115 120.410   9.702  -7.496
  921    H    LEU 116           HN       LEU 116 123.417   8.959  -6.201
  922    HA   LEU 116           HA       LEU 116 122.465   6.296  -5.982
  923    HB2  LEU 116           HB2      LEU 116 124.186   7.172  -7.618
  924    HB3  LEU 116           HB1      LEU 116 125.340   7.168  -6.284
  925    HG   LEU 116           HG       LEU 116 124.471   4.671  -5.978
  926   HD11  LEU 116          HD11      LEU 116 122.785   5.057  -7.869
  927   HD12  LEU 116          HD12      LEU 116 123.787   3.613  -8.004
  928   HD13  LEU 116          HD13      LEU 116 124.169   5.043  -8.961
  929   HD21  LEU 116          HD21      LEU 116 126.403   5.604  -8.123
  930   HD22  LEU 116          HD22      LEU 116 126.305   3.945  -7.530
  931   HD23  LEU 116          HD23      LEU 116 126.791   5.243  -6.440
  932    H    ALA 117           HN       ALA 117 124.620   8.265  -3.965
  933    HA   ALA 117           HA       ALA 117 125.395   6.104  -2.280
  934    HB1  ALA 117           HB1      ALA 117 126.170   7.998  -0.752
  935    HB2  ALA 117           HB2      ALA 117 125.596   9.108  -1.997
  936    HB3  ALA 117           HB3      ALA 117 126.889   7.966  -2.362
  937    H    LEU 118           HN       LEU 118 122.622   8.162  -2.379
  938    HA   LEU 118           HA       LEU 118 121.866   8.175   0.296
  939    HB2  LEU 118           HB2      LEU 118 120.245   8.111  -2.242
  940    HB3  LEU 118           HB1      LEU 118 119.470   8.164  -0.662
  941    HG   LEU 118           HG       LEU 118 121.566  10.151  -1.578
  942   HD11  LEU 118          HD11      LEU 118 119.699  11.708  -1.925
  943   HD12  LEU 118          HD12      LEU 118 118.548  10.447  -1.483
  944   HD13  LEU 118          HD13      LEU 118 119.507  10.289  -2.954
  945   HD21  LEU 118          HD21      LEU 118 119.963   9.726   0.908
  946   HD22  LEU 118          HD22      LEU 118 120.159  11.392   0.369
  947   HD23  LEU 118          HD23      LEU 118 121.578  10.408   0.713
  948    H    LEU 119           HN       LEU 119 121.474   5.568  -2.109
  949    HA   LEU 119           HA       LEU 119 119.753   3.935  -0.676
  950    HB2  LEU 119           HB2      LEU 119 122.013   3.292  -2.567
  951    HB3  LEU 119           HB1      LEU 119 121.023   2.023  -1.852
  952    HG   LEU 119           HG       LEU 119 120.181   2.712  -4.083
  953   HD11  LEU 119          HD11      LEU 119 118.699   2.143  -1.908
  954   HD12  LEU 119          HD12      LEU 119 117.977   2.523  -3.471
  955   HD13  LEU 119          HD13      LEU 119 118.097   3.770  -2.231
  956   HD21  LEU 119          HD21      LEU 119 119.492   5.365  -2.810
  957   HD22  LEU 119          HD22      LEU 119 119.390   4.915  -4.511
  958   HD23  LEU 119          HD23      LEU 119 120.965   5.128  -3.748
  959    H    VAL 120           HN       VAL 120 122.948   4.857   0.095
  960    HA   VAL 120           HA       VAL 120 123.985   2.704   1.522
  961    HB   VAL 120           HB       VAL 120 124.190   5.675   1.986
  962   HG11  VAL 120          HG11      VAL 120 125.432   3.339   3.423
  963   HG12  VAL 120          HG12      VAL 120 124.792   4.842   4.091
  964   HG13  VAL 120          HG13      VAL 120 126.337   4.843   3.243
  965   HG21  VAL 120          HG21      VAL 120 126.164   5.536   0.719
  966   HG22  VAL 120          HG22      VAL 120 125.100   4.411  -0.126
  967   HG23  VAL 120          HG23      VAL 120 126.325   3.799   0.984
  968    H    SER 121           HN       SER 121 121.042   4.117   2.023
  969    HA   SER 121           HA       SER 121 120.970   4.215   4.904
  970    HB2  SER 121           HB2      SER 121 119.390   5.581   3.700
  971    HB3  SER 121           HB1      SER 121 118.789   4.190   2.805
  972    HG   SER 121           HG       SER 121 118.747   4.175   5.616
  973    H    ALA 122           HN       ALA 122 120.584   1.827   2.447
  974    HA   ALA 122           HA       ALA 122 120.509  -0.306   4.370
  975    HB1  ALA 122           HB1      ALA 122 118.371  -1.217   3.886
  976    HB2  ALA 122           HB2      ALA 122 118.121  -0.116   2.531
  977    HB3  ALA 122           HB3      ALA 122 118.082   0.498   4.185
  978    H    HIS 123           HN       HIS 123 120.718  -2.396   3.356
  979    HA   HIS 123           HA       HIS 123 120.823  -2.901   0.609
  980    HB2  HIS 123           HB2      HIS 123 123.270  -2.874   0.206
  981    HB3  HIS 123           HB1      HIS 123 122.630  -1.259   0.492
  982    HD2  HIS 123           HD2      HIS 123 125.037  -0.327   1.695
  983    HE1  HIS 123           HE1      HIS 123 124.927  -2.971   4.984
  984    HE2  HIS 123           HE2      HIS 123 126.080  -0.927   4.013
  985    H    ASP 124           HN       ASP 124 122.460  -4.811   0.171
  986    HA   ASP 124           HA       ASP 124 122.425  -6.604   2.532
  987    HB2  ASP 124           HB2      ASP 124 121.847  -7.276  -0.363
  988    HB3  ASP 124           HB1      ASP 124 122.021  -8.464   0.927
  989    H    ASP 125           HN       ASP 125 124.264  -5.064   0.177
  990    HA   ASP 125           HA       ASP 125 126.661  -6.478   0.978
  991    HB2  ASP 125           HB2      ASP 125 125.435  -7.682  -1.066
  992    HB3  ASP 125           HB1      ASP 125 126.263  -6.424  -1.980
  993   H5'1  C2E 501          H5'1      C2E 501 105.201   3.257  10.461
  994   H5'2  C2E 501          H5'2      C2E 501 104.520   1.852  11.297
  995    H4'  C2E 501           H4'      C2E 501 106.823   0.728  10.626
  996    H3'  C2E 501           H3'      C2E 501 106.702   3.131   8.826
  997    H2'  C2E 501           H2'      C2E 501 106.872   1.929   6.840
  998   HO2'  C2E 501          HO2'      C2E 501 108.253   0.185   8.437
  999    H1'  C2E 501           H1'      C2E 501 105.248  -0.141   7.396
 1000    H8   C2E 501           H8       C2E 501 103.444   2.411   9.336
 1001    HN1  C2E 501           HN1      C2E 501 102.997   3.558   3.057
 1002   HN21  C2E 501          HN21      C2E 501 104.478   2.331   1.954
 1003   HN22  C2E 501          HN22      C2E 501 105.567   1.227   2.763
 1004   H511  C2E 501          H511      C2E 501 107.976   4.552  10.141
 1005   H512  C2E 501          H512      C2E 501 109.647   4.577  10.741
 1006    H4A  C2E 501           H4A      C2E 501 108.763   5.369  12.961
 1007    H3A  C2E 501           H3A      C2E 501 106.091   5.367  11.522
 1008    H2A  C2E 501           H2A      C2E 501 105.532   7.376  12.503
 1009   HO2A  C2E 501          HO2A      C2E 501 106.414   6.676  14.626
 1010    H1A  C2E 501           H1A      C2E 501 107.925   8.649  12.244
 1011    H81  C2E 501           H81      C2E 501 107.805   6.597   9.147
 1012   HN11  C2E 501          HN11      C2E 501 103.898  11.644   8.792
 1013   HN24  C2E 501          HN24      C2E 501 104.463  11.947  12.218
 1014   HN23  C2E 501          HN23      C2E 501 103.659  12.562  10.791
 1015   H5'1  C2E 502          H5'1      C2E 502 101.343  10.298   3.995
 1016   H5'2  C2E 502          H5'2      C2E 502  99.679  10.851   3.709
 1017    H4'  C2E 502           H4'      C2E 502  99.532  11.810   5.897
 1018    H3'  C2E 502           H3'      C2E 502 102.508  11.357   6.053
 1019    H2'  C2E 502           H2'      C2E 502 102.236  11.119   8.426
 1020   HO2'  C2E 502          HO2'      C2E 502 100.384  11.724   9.479
 1021    H1'  C2E 502           H1'      C2E 502 100.073   9.514   8.313
 1022    H8   C2E 502           H8       C2E 502 102.241   8.533   5.338
 1023    HN1  C2E 502           HN1      C2E 502 104.051   5.874  10.858
 1024   HN21  C2E 502          HN21      C2E 502 102.948   6.751  12.548
 1025   HN22  C2E 502          HN22      C2E 502 101.760   8.021  12.340
 1026   H511  C2E 502          H511      C2E 502 103.869  16.258   5.459
 1027   H512  C2E 502          H512      C2E 502 102.445  15.384   4.862
 1028    H4A  C2E 502           H4A      C2E 502 103.998  15.769   3.028
 1029    H3A  C2E 502           H3A      C2E 502 103.868  12.866   3.962
 1030    H2A  C2E 502           H2A      C2E 502 105.375  12.300   2.253
 1031   HO2A  C2E 502          HO2A      C2E 502 104.443  13.465   0.541
 1032    H1A  C2E 502           H1A      C2E 502 107.040  14.469   2.524
 1033    H81  C2E 502           H81      C2E 502 106.262  13.704   6.051
 1034   HN11  C2E 502          HN11      C2E 502 110.136   9.346   3.411
 1035   HN24  C2E 502          HN24      C2E 502 110.127   9.562   1.204
 1036   HN23  C2E 502          HN23      C2E 502 109.176  10.778   0.382
  Start of MODEL   15
    1    H    MET   1           H        MET   1 108.001  17.517  17.869
    2    HA   MET   1           HA       MET   1 109.650  16.453  15.898
    3    HB2  MET   1           HB2      MET   1 109.927  15.191  18.632
    4    HB3  MET   1           HB1      MET   1 110.187  14.276  17.147
    5    HG2  MET   1           HG2      MET   1 111.597  16.879  17.255
    6    HG3  MET   1           HG1      MET   1 112.148  15.690  18.434
    7    HE1  MET   1           HE1      MET   1 112.308  13.114  17.709
    8    HE2  MET   1           HE2      MET   1 113.828  13.968  17.958
    9    HE3  MET   1           HE3      MET   1 113.658  12.867  16.592
   10    H    SER   2           HN       SER   2 107.788  16.212  14.796
   11    HA   SER   2           HA       SER   2 106.203  14.410  14.214
   12    HB2  SER   2           HB2      SER   2 106.175  13.384  16.454
   13    HB3  SER   2           HB1      SER   2 105.303  14.783  17.083
   14    HG   SER   2           HG       SER   2 104.228  13.638  14.818
   15    H    ASP   3           HN       ASP   3 105.925  17.391  15.979
   16    HA   ASP   3           HA       ASP   3 103.376  18.004  14.642
   17    HB2  ASP   3           HB2      ASP   3 103.419  20.041  16.161
   18    HB3  ASP   3           HB1      ASP   3 103.279  18.485  16.977
   19    H    GLN   4           HN       GLN   4 106.650  18.414  14.161
   20    HA   GLN   4           HA       GLN   4 106.211  20.900  12.616
   21    HB2  GLN   4           HB2      GLN   4 108.953  19.908  13.349
   22    HB3  GLN   4           HB1      GLN   4 108.418  21.553  13.005
   23    HG2  GLN   4           HG2      GLN   4 108.671  21.542  15.347
   24    HG3  GLN   4           HG1      GLN   4 106.941  21.298  15.119
   25   HE21  GLN   4          HE21      GLN   4 108.359  18.449  14.123
   26   HE22  GLN   4          HE22      GLN   4 108.291  17.586  15.584
   27    H    HIS   5           HN       HIS   5 106.404  17.665  12.219
   28    HA   HIS   5           HA       HIS   5 106.284  16.583  10.135
   29    HB2  HIS   5           HB2      HIS   5 108.091  18.752   9.048
   30    HB3  HIS   5           HB1      HIS   5 107.289  17.484   8.131
   31    HD2  HIS   5           HD2      HIS   5 104.825  18.829  10.707
   32    HE1  HIS   5           HE1      HIS   5 104.111  21.031   7.178
   33    HE2  HIS   5           HE2      HIS   5 103.210  20.473   9.485
   34    H    ASP   6           HN       ASP   6 109.479  17.777   9.440
   35    HA   ASP   6           HA       ASP   6 111.537  16.752   9.524
   36    HB2  ASP   6           HB2      ASP   6 110.507  15.248  11.928
   37    HB3  ASP   6           HB1      ASP   6 112.166  15.718  11.565
   38    H    GLU   7           HN       GLU   7 112.601  14.789   8.960
   39    HA   GLU   7           HA       GLU   7 110.780  12.826   7.788
   40    HB2  GLU   7           HB2      GLU   7 112.348  13.565   6.220
   41    HB3  GLU   7           HB1      GLU   7 113.673  13.502   7.381
   42    HG2  GLU   7           HG2      GLU   7 113.948  11.217   7.170
   43    HG3  GLU   7           HG1      GLU   7 112.256  10.942   6.777
   44    H    ARG   8           HN       ARG   8 110.473  10.857   8.572
   45    HA   ARG   8           HA       ARG   8 112.285   9.834  10.675
   46    HB2  ARG   8           HB2      ARG   8 109.286   9.936  10.579
   47    HB3  ARG   8           HB1      ARG   8 110.107   8.690  11.505
   48    HG2  ARG   8           HG2      ARG   8 109.861  10.358  13.110
   49    HG3  ARG   8           HG1      ARG   8 111.476  10.702  12.502
   50    HD2  ARG   8           HD2      ARG   8 109.996  12.723  12.713
   51    HD3  ARG   8           HD1      ARG   8 110.650  12.479  11.105
   52    HE   ARG   8           HE       ARG   8 108.395  11.409  10.601
   53   HH11  ARG   8          HH21      ARG   8 108.846  13.795  13.079
   54   HH12  ARG   8          HH22      ARG   8 107.253  14.448  12.919
   55   HH21  ARG   8          HH11      ARG   8 106.317  12.278  10.394
   56   HH22  ARG   8          HH12      ARG   8 105.820  13.587  11.413
   57    H    ARG   9           HN       ARG   9 110.745   9.228   7.657
   58    HA   ARG   9           HA       ARG   9 111.196   6.308   7.946
   59    HB2  ARG   9           HB2      ARG   9 109.828   6.326   5.671
   60    HB3  ARG   9           HB1      ARG   9 109.004   6.367   7.224
   61    HG2  ARG   9           HG2      ARG   9 109.077   8.906   7.025
   62    HG3  ARG   9           HG1      ARG   9 109.557   8.668   5.351
   63    HD2  ARG   9           HD2      ARG   9 107.506   7.662   4.790
   64    HD3  ARG   9           HD1      ARG   9 107.098   7.330   6.469
   65    HE   ARG   9           HE       ARG   9 106.957   9.910   6.653
   66   HH11  ARG   9          HH21      ARG   9 106.247   8.066   3.790
   67   HH12  ARG   9          HH22      ARG   9 105.142   9.239   3.157
   68   HH21  ARG   9          HH11      ARG   9 105.512  11.427   5.816
   69   HH22  ARG   9          HH12      ARG   9 104.725  11.135   4.301
   70    H    ARG  10           HN       ARG  10 113.423   6.671   7.700
   71    HA   ARG  10           HA       ARG  10 115.359   7.323   6.497
   72    HB2  ARG  10           HB2      ARG  10 114.865   5.247   4.519
   73    HB3  ARG  10           HB1      ARG  10 116.039   5.295   5.825
   74    HG2  ARG  10           HG2      ARG  10 114.761   3.511   6.536
   75    HG3  ARG  10           HG1      ARG  10 113.868   4.810   7.315
   76    HD2  ARG  10           HD2      ARG  10 112.440   4.902   5.188
   77    HD3  ARG  10           HD1      ARG  10 113.209   3.387   4.731
   78    HE   ARG  10           HE       ARG  10 111.212   3.753   6.797
   79   HH11  ARG  10          HH21      ARG  10 113.821   1.840   5.567
   80   HH12  ARG  10          HH22      ARG  10 113.302   0.383   6.346
   81   HH21  ARG  10          HH11      ARG  10 110.529   1.846   7.825
   82   HH22  ARG  10          HH12      ARG  10 111.441   0.387   7.626
   83    H    PHE  11           HN       PHE  11 113.221   6.273   3.824
   84    HA   PHE  11           HA       PHE  11 113.532   8.904   2.565
   85    HB2  PHE  11           HB2      PHE  11 114.984   6.509   1.767
   86    HB3  PHE  11           HB1      PHE  11 113.975   7.111   0.454
   87    HD1  PHE  11           HD1      PHE  11 116.692   8.010   2.829
   88    HD2  PHE  11           HD2      PHE  11 114.458   9.185  -0.647
   89    HE1  PHE  11           HE1      PHE  11 118.329   9.825   2.388
   90    HE2  PHE  11           HE2      PHE  11 116.093  11.000  -1.084
   91    HZ   PHE  11           HZ       PHE  11 118.027  11.317   0.433
   92    H    HIS  12           HN       HIS  12 112.198   9.012   0.510
   93    HA   HIS  12           HA       HIS  12 109.534   8.496   1.011
   94    HB2  HIS  12           HB2      HIS  12 109.958   8.353  -1.837
   95    HB3  HIS  12           HB1      HIS  12 109.287   9.677  -0.888
   96    HD2  HIS  12           HD2      HIS  12 112.214   9.209  -3.146
   97    HE1  HIS  12           HE1      HIS  12 113.543  12.038  -0.310
   98    HE2  HIS  12           HE2      HIS  12 114.040  10.983  -2.565
   99    H    ARG  13           HN       ARG  13 108.061   7.079  -0.343
  100    HA   ARG  13           HA       ARG  13 109.224   4.360  -0.589
  101    HB2  ARG  13           HB2      ARG  13 106.348   4.990   0.102
  102    HB3  ARG  13           HB1      ARG  13 107.171   3.437   0.205
  103    HG2  ARG  13           HG2      ARG  13 108.088   3.918   2.235
  104    HG3  ARG  13           HG1      ARG  13 108.473   5.574   1.776
  105    HD2  ARG  13           HD2      ARG  13 105.734   4.551   2.572
  106    HD3  ARG  13           HD1      ARG  13 106.789   5.548   3.568
  107    HE   ARG  13           HE       ARG  13 106.525   7.061   1.352
  108   HH11  ARG  13          HH21      ARG  13 104.263   5.342   3.313
  109   HH12  ARG  13          HH22      ARG  13 102.956   6.433   3.002
  110   HH21  ARG  13          HH11      ARG  13 104.817   8.502   0.941
  111   HH22  ARG  13          HH12      ARG  13 103.268   8.222   1.664
  112    H    ILE  14           HN       ILE  14 107.978   2.932  -2.086
  113    HA   ILE  14           HA       ILE  14 107.740   4.127  -4.644
  114    HB   ILE  14           HB       ILE  14 106.475   1.496  -3.899
  115   HG12  ILE  14          HG12      ILE  14 108.628   1.410  -2.822
  116   HG13  ILE  14          HG11      ILE  14 108.776   0.518  -4.335
  117   HG21  ILE  14          HG21      ILE  14 106.435   2.637  -6.253
  118   HG22  ILE  14          HG22      ILE  14 106.856   0.928  -6.143
  119   HG23  ILE  14          HG23      ILE  14 108.124   2.139  -6.337
  120   HD11  ILE  14          HD11      ILE  14 109.747   3.319  -3.733
  121   HD12  ILE  14          HD12      ILE  14 109.613   2.698  -5.378
  122   HD13  ILE  14          HD13      ILE  14 110.704   1.923  -4.229
  123    H    ALA  15           HN       ALA  15 106.259   5.825  -4.531
  124    HA   ALA  15           HA       ALA  15 103.510   5.198  -3.726
  125    HB1  ALA  15           HB1      ALA  15 104.210   7.243  -2.811
  126    HB2  ALA  15           HB2      ALA  15 103.221   7.707  -4.196
  127    HB3  ALA  15           HB3      ALA  15 104.981   7.752  -4.313
  128    H    PHE  16           HN       PHE  16 102.071   4.588  -5.096
  129    HA   PHE  16           HA       PHE  16 101.863   5.817  -7.716
  130    HB2  PHE  16           HB2      PHE  16 101.680   3.667  -8.902
  131    HB3  PHE  16           HB1      PHE  16 103.283   3.879  -8.207
  132    HD1  PHE  16           HD1      PHE  16  99.956   2.286  -7.550
  133    HD2  PHE  16           HD2      PHE  16 104.170   2.273  -6.729
  134    HE1  PHE  16           HE1      PHE  16  99.720   0.127  -6.358
  135    HE2  PHE  16           HE2      PHE  16 103.937   0.119  -5.546
  136    HZ   PHE  16           HZ       PHE  16 101.711  -0.957  -5.356
  137    H    ASP  17           HN       ASP  17  99.700   5.397  -8.666
  138    HA   ASP  17           HA       ASP  17  97.759   5.004  -6.507
  139    HB2  ASP  17           HB2      ASP  17  97.156   5.879  -9.330
  140    HB3  ASP  17           HB1      ASP  17  96.204   6.155  -7.872
  141    H    ALA  18           HN       ALA  18  96.080   3.506  -6.625
  142    HA   ALA  18           HA       ALA  18  95.450   1.890  -8.807
  143    HB1  ALA  18           HB1      ALA  18  96.475  -0.284  -7.868
  144    HB2  ALA  18           HB2      ALA  18  97.565   0.772  -6.969
  145    HB3  ALA  18           HB3      ALA  18  97.557   0.810  -8.731
  146    H    ASP  19           HN       ASP  19  94.361  -0.251  -7.957
  147    HA   ASP  19           HA       ASP  19  92.598   0.631  -5.766
  148    HB2  ASP  19           HB2      ASP  19  91.327  -0.021  -7.641
  149    HB3  ASP  19           HB1      ASP  19  92.342  -1.422  -7.959
  150    H    SER  20           HN       SER  20  92.498  -0.343  -3.837
  151    HA   SER  20           HA       SER  20  93.834  -2.947  -3.502
  152    HB2  SER  20           HB2      SER  20  94.615  -2.071  -1.233
  153    HB3  SER  20           HB1      SER  20  95.467  -1.445  -2.642
  154    HG   SER  20           HG       SER  20  94.400   0.450  -2.449
  155    H    GLU  21           HN       GLU  21  93.023  -4.223  -1.861
  156    HA   GLU  21           HA       GLU  21  90.483  -3.356  -0.602
  157    HB2  GLU  21           HB2      GLU  21  90.889  -6.136  -1.728
  158    HB3  GLU  21           HB1      GLU  21  89.392  -5.396  -1.166
  159    HG2  GLU  21           HG2      GLU  21  90.942  -4.289  -3.515
  160    HG3  GLU  21           HG1      GLU  21  89.712  -5.534  -3.705
  161    H    ILE  22           HN       ILE  22  90.262  -3.996   1.490
  162    HA   ILE  22           HA       ILE  22  92.440  -5.715   2.544
  163    HB   ILE  22           HB       ILE  22  91.100  -3.308   3.788
  164   HG12  ILE  22          HG12      ILE  22  93.943  -3.920   2.914
  165   HG13  ILE  22          HG11      ILE  22  92.838  -2.774   2.158
  166   HG21  ILE  22          HG21      ILE  22  91.489  -5.090   5.477
  167   HG22  ILE  22          HG22      ILE  22  92.564  -3.718   5.729
  168   HG23  ILE  22          HG23      ILE  22  93.176  -5.184   4.971
  169   HD11  ILE  22          HD11      ILE  22  93.981  -2.588   4.959
  170   HD12  ILE  22          HD12      ILE  22  92.776  -1.485   4.294
  171   HD13  ILE  22          HD13      ILE  22  94.390  -1.562   3.588
  172    H    LEU  23           HN       LEU  23  91.956  -7.370   3.788
  173    HA   LEU  23           HA       LEU  23  89.118  -7.807   4.532
  174    HB2  LEU  23           HB2      LEU  23  90.921 -10.120   4.005
  175    HB3  LEU  23           HB1      LEU  23  89.185  -9.953   3.736
  176    HG   LEU  23           HG       LEU  23  89.965  -8.141   1.966
  177   HD11  LEU  23          HD11      LEU  23  92.426  -8.755   2.831
  178   HD12  LEU  23          HD12      LEU  23  92.115  -8.302   1.158
  179   HD13  LEU  23          HD13      LEU  23  92.272 -10.003   1.598
  180   HD21  LEU  23          HD21      LEU  23  88.782 -10.397   1.600
  181   HD22  LEU  23          HD22      LEU  23  90.385 -11.064   1.295
  182   HD23  LEU  23          HD23      LEU  23  89.747  -9.795   0.252
  183    H    GLN  24           HN       GLN  24  88.812  -7.979   6.583
  184    HA   GLN  24           HA       GLN  24  90.959  -9.118   8.299
  185    HB2  GLN  24           HB2      GLN  24  90.797  -6.647   8.571
  186    HB3  GLN  24           HB1      GLN  24  89.113  -6.833   9.048
  187    HG2  GLN  24           HG2      GLN  24  90.936  -8.594  10.548
  188    HG3  GLN  24           HG1      GLN  24  91.282  -6.883  10.776
  189   HE21  GLN  24          HE21      GLN  24  90.389  -6.606  12.880
  190   HE22  GLN  24          HE22      GLN  24  88.748  -6.861  13.231
  191    H    GLY  25           HN       GLY  25  90.070 -11.144   8.622
  192    HA2  GLY  25           HA2      GLY  25  88.732 -12.625   9.803
  193    HA3  GLY  25           HA1      GLY  25  87.684 -11.283  10.261
  194    H    GLU  26           HN       GLU  26  85.702 -11.593   9.506
  195    HA   GLU  26           HA       GLU  26  85.292 -12.943   6.911
  196    HB2  GLU  26           HB2      GLU  26  83.061 -13.365   7.654
  197    HB3  GLU  26           HB1      GLU  26  84.123 -13.745   9.009
  198    HG2  GLU  26           HG2      GLU  26  83.726 -11.308   9.764
  199    HG3  GLU  26           HG1      GLU  26  82.377 -11.316   8.628
  200    H    ARG  27           HN       ARG  27  85.942  -9.959   7.766
  201    HA   ARG  27           HA       ARG  27  83.755  -8.676   6.241
  202    HB2  ARG  27           HB2      ARG  27  85.601  -7.673   8.380
  203    HB3  ARG  27           HB1      ARG  27  84.614  -6.608   7.379
  204    HG2  ARG  27           HG2      ARG  27  82.598  -7.452   8.219
  205    HG3  ARG  27           HG1      ARG  27  83.344  -8.953   8.770
  206    HD2  ARG  27           HD2      ARG  27  84.193  -7.993  10.685
  207    HD3  ARG  27           HD1      ARG  27  84.320  -6.397   9.952
  208    HE   ARG  27           HE       ARG  27  82.170  -5.953  10.697
  209   HH11  ARG  27          HH21      ARG  27  82.787  -9.359  10.677
  210   HH12  ARG  27          HH22      ARG  27  81.292  -9.773  11.449
  211   HH21  ARG  27          HH11      ARG  27  80.211  -6.491  11.711
  212   HH22  ARG  27          HH12      ARG  27  79.835  -8.150  12.033
  213    H    ARG  28           HN       ARG  28  84.200  -7.614   4.400
  214    HA   ARG  28           HA       ARG  28  87.023  -7.013   3.718
  215    HB2  ARG  28           HB2      ARG  28  86.300  -8.982   2.441
  216    HB3  ARG  28           HB1      ARG  28  84.887  -8.100   1.861
  217    HG2  ARG  28           HG2      ARG  28  86.312  -6.483   0.715
  218    HG3  ARG  28           HG1      ARG  28  87.758  -7.244   1.381
  219    HD2  ARG  28           HD2      ARG  28  87.297  -9.295   0.156
  220    HD3  ARG  28           HD1      ARG  28  85.764  -8.649  -0.418
  221    HE   ARG  28           HE       ARG  28  88.355  -8.121  -1.532
  222   HH11  ARG  28          HH21      ARG  28  85.235  -6.770  -0.880
  223   HH12  ARG  28          HH22      ARG  28  85.280  -5.673  -2.219
  224   HH21  ARG  28          HH11      ARG  28  88.418  -6.694  -3.289
  225   HH22  ARG  28          HH12      ARG  28  87.083  -5.631  -3.585
  226    H    TRP  29           HN       TRP  29  87.378  -5.201   2.490
  227    HA   TRP  29           HA       TRP  29  85.123  -3.447   1.855
  228    HB2  TRP  29           HB2      TRP  29  87.452  -2.646   3.602
  229    HB3  TRP  29           HB1      TRP  29  86.182  -1.565   3.033
  230    HD1  TRP  29           HD1      TRP  29  83.606  -2.361   3.845
  231    HE1  TRP  29           HE1      TRP  29  82.908  -3.230   6.179
  232    HE3  TRP  29           HE3      TRP  29  88.147  -3.847   5.599
  233    HZ2  TRP  29           HZ2      TRP  29  84.144  -4.405   8.489
  234    HZ3  TRP  29           HZ3      TRP  29  88.377  -4.832   7.855
  235    HH2  TRP  29           HH2      TRP  29  86.378  -5.120   9.305
  236    H    GLU  30           HN       GLU  30  85.697  -1.722   0.445
  237    HA   GLU  30           HA       GLU  30  88.051  -2.358  -1.179
  238    HB2  GLU  30           HB2      GLU  30  85.948  -0.376  -1.997
  239    HB3  GLU  30           HB1      GLU  30  86.946  -1.422  -3.004
  240    HG2  GLU  30           HG2      GLU  30  84.805  -2.428  -3.065
  241    HG3  GLU  30           HG1      GLU  30  85.703  -3.385  -1.888
  242    H    VAL  31           HN       VAL  31  89.705  -0.820  -1.469
  243    HA   VAL  31           HA       VAL  31  89.305   1.899  -0.441
  244    HB   VAL  31           HB       VAL  31  91.497   1.663   0.820
  245   HG11  VAL  31          HG11      VAL  31  89.179  -0.025   1.803
  246   HG12  VAL  31          HG12      VAL  31  89.234   1.736   1.883
  247   HG13  VAL  31          HG13      VAL  31  90.396   0.773   2.799
  248   HG21  VAL  31          HG21      VAL  31  92.106  -0.621   1.511
  249   HG22  VAL  31          HG22      VAL  31  92.189  -0.470  -0.244
  250   HG23  VAL  31          HG23      VAL  31  90.815  -1.280   0.508
  251    H    LEU  32           HN       LEU  32  90.926   3.364  -1.089
  252    HA   LEU  32           HA       LEU  32  92.241   2.597  -3.612
  253    HB2  LEU  32           HB2      LEU  32  90.863   4.577  -3.790
  254    HB3  LEU  32           HB1      LEU  32  91.570   5.269  -2.333
  255    HG   LEU  32           HG       LEU  32  93.830   5.123  -3.642
  256   HD11  LEU  32          HD11      LEU  32  92.935   3.753  -5.498
  257   HD12  LEU  32          HD12      LEU  32  93.560   5.295  -6.079
  258   HD13  LEU  32          HD13      LEU  32  91.821   5.055  -5.911
  259   HD21  LEU  32          HD21      LEU  32  92.623   7.220  -3.042
  260   HD22  LEU  32          HD22      LEU  32  91.684   7.077  -4.529
  261   HD23  LEU  32          HD23      LEU  32  93.427   7.334  -4.608
  262    H    LEU  33           HN       LEU  33  94.426   2.367  -3.671
  263    HA   LEU  33           HA       LEU  33  95.890   2.852  -1.177
  264    HB2  LEU  33           HB2      LEU  33  96.251   0.680  -2.169
  265    HB3  LEU  33           HB1      LEU  33  96.621   1.393  -3.734
  266    HG   LEU  33           HG       LEU  33  98.411   2.611  -1.896
  267   HD11  LEU  33          HD11      LEU  33  99.569   0.592  -0.984
  268   HD12  LEU  33          HD12      LEU  33  98.197  -0.386  -1.502
  269   HD13  LEU  33          HD13      LEU  33  97.979   0.860  -0.272
  270   HD21  LEU  33          HD21      LEU  33  98.911   0.314  -3.813
  271   HD22  LEU  33          HD22      LEU  33 100.107   1.473  -3.233
  272   HD23  LEU  33          HD23      LEU  33  98.802   2.007  -4.293
  273    H    HIS  34           HN       HIS  34  97.056   4.572  -0.877
  274    HA   HIS  34           HA       HIS  34  97.566   6.384  -3.111
  275    HB2  HIS  34           HB2      HIS  34  97.703   6.610  -0.102
  276    HB3  HIS  34           HB1      HIS  34  98.344   7.884  -1.151
  277    HD2  HIS  34           HD2      HIS  34  94.869   6.360  -0.116
  278    HE1  HIS  34           HE1      HIS  34  94.138   9.734  -2.542
  279    HE2  HIS  34           HE2      HIS  34  93.056   7.985  -1.059
  280    H    ASP  35           HN       ASP  35  99.393   4.278  -0.983
  281    HA   ASP  35           HA       ASP  35 101.520   4.335  -2.815
  282    HB2  ASP  35           HB2      ASP  35 103.282   5.497  -1.602
  283    HB3  ASP  35           HB1      ASP  35 101.892   6.582  -1.708
  284    H    VAL  36           HN       VAL  36 103.399   3.025  -2.152
  285    HA   VAL  36           HA       VAL  36 102.909   1.290   0.156
  286    HB   VAL  36           HB       VAL  36 101.785   0.386  -2.009
  287   HG11  VAL  36          HG11      VAL  36 103.210  -0.682  -3.597
  288   HG12  VAL  36          HG12      VAL  36 104.641  -0.411  -2.606
  289   HG13  VAL  36          HG13      VAL  36 103.842   0.951  -3.393
  290   HG21  VAL  36          HG21      VAL  36 102.464  -0.892   0.147
  291   HG22  VAL  36          HG22      VAL  36 103.829  -1.479  -0.796
  292   HG23  VAL  36          HG23      VAL  36 102.182  -1.841  -1.309
  293    H    SER  37           HN       SER  37 104.696  -0.323   0.398
  294    HA   SER  37           HA       SER  37 107.277   0.602  -0.634
  295    HB2  SER  37           HB2      SER  37 106.822   1.690   1.617
  296    HB3  SER  37           HB1      SER  37 106.798   0.071   2.308
  297    HG   SER  37           HG       SER  37 108.940   0.405   0.701
  298    H    LEU  38           HN       LEU  38 108.993  -1.082  -0.004
  299    HA   LEU  38           HA       LEU  38 108.016  -3.622  -0.791
  300    HB2  LEU  38           HB2      LEU  38 110.471  -4.270   0.099
  301    HB3  LEU  38           HB1      LEU  38 110.215  -3.448  -1.439
  302    HG   LEU  38           HG       LEU  38 110.604  -1.274  -0.376
  303   HD11  LEU  38          HD11      LEU  38 110.912  -2.951   2.129
  304   HD12  LEU  38          HD12      LEU  38 109.723  -1.682   1.843
  305   HD13  LEU  38          HD13      LEU  38 111.429  -1.272   2.013
  306   HD21  LEU  38          HD21      LEU  38 112.717  -3.336   0.321
  307   HD22  LEU  38          HD22      LEU  38 112.990  -1.597   0.219
  308   HD23  LEU  38          HD23      LEU  38 112.552  -2.508  -1.226
  309    H    HIS  39           HN       HIS  39 107.684  -2.122   2.125
  310    HA   HIS  39           HA       HIS  39 106.993  -4.613   3.426
  311    HB2  HIS  39           HB2      HIS  39 109.596  -3.686   3.794
  312    HB3  HIS  39           HB1      HIS  39 108.749  -3.133   5.234
  313    HD2  HIS  39           HD2      HIS  39 106.878  -5.627   5.976
  314    HE1  HIS  39           HE1      HIS  39 110.279  -8.075   5.469
  315    HE2  HIS  39           HE2      HIS  39 107.944  -7.961   6.461
  316    H    GLY  40           HN       GLY  40 105.543  -2.246   2.625
  317    HA2  GLY  40           HA2      GLY  40 104.040  -1.790   4.994
  318    HA3  GLY  40           HA1      GLY  40 105.060  -0.396   4.655
  319    H    ILE  41           HN       ILE  41 102.178  -0.389   4.617
  320    HA   ILE  41           HA       ILE  41 101.774   0.536   1.857
  321    HB   ILE  41           HB       ILE  41 100.626  -1.305   1.281
  322   HG12  ILE  41          HG12      ILE  41  98.683  -0.576   3.493
  323   HG13  ILE  41          HG11      ILE  41  98.743   0.238   1.929
  324   HG21  ILE  41          HG21      ILE  41 100.056  -3.080   2.910
  325   HG22  ILE  41          HG22      ILE  41 100.577  -2.021   4.222
  326   HG23  ILE  41          HG23      ILE  41 101.743  -2.585   3.024
  327   HD11  ILE  41          HD11      ILE  41  97.041  -1.642   2.125
  328   HD12  ILE  41          HD12      ILE  41  98.409  -2.753   2.188
  329   HD13  ILE  41          HD13      ILE  41  98.152  -1.749   0.761
  330    H    LEU  42           HN       LEU  42 100.212   2.048   1.572
  331    HA   LEU  42           HA       LEU  42  98.952   3.166   4.011
  332    HB2  LEU  42           HB2      LEU  42 100.905   4.412   2.538
  333    HB3  LEU  42           HB1      LEU  42  99.449   5.006   1.744
  334    HG   LEU  42           HG       LEU  42  99.767   5.071   4.746
  335   HD11  LEU  42          HD11      LEU  42 101.603   6.379   3.969
  336   HD12  LEU  42          HD12      LEU  42 100.322   7.529   4.346
  337   HD13  LEU  42          HD13      LEU  42 100.641   7.084   2.670
  338   HD21  LEU  42          HD21      LEU  42  98.032   6.562   2.759
  339   HD22  LEU  42          HD22      LEU  42  98.080   6.888   4.492
  340   HD23  LEU  42          HD23      LEU  42  97.493   5.333   3.905
  341    H    VAL  43           HN       VAL  43  96.761   3.514   3.848
  342    HA   VAL  43           HA       VAL  43  95.545   3.443   1.160
  343    HB   VAL  43           HB       VAL  43  93.838   1.863   1.896
  344   HG11  VAL  43          HG11      VAL  43  96.612   0.808   2.517
  345   HG12  VAL  43          HG12      VAL  43  95.983   1.047   0.887
  346   HG13  VAL  43          HG13      VAL  43  95.227  -0.130   1.960
  347   HG21  VAL  43          HG21      VAL  43  94.182   0.685   4.090
  348   HG22  VAL  43          HG22      VAL  43  93.771   2.390   4.270
  349   HG23  VAL  43          HG23      VAL  43  95.441   1.857   4.472
  350    H    GLY  44           HN       GLY  44  93.097   3.802   1.387
  351    HA2  GLY  44           HA2      GLY  44  92.701   6.213   3.059
  352    HA3  GLY  44           HA1      GLY  44  91.727   5.759   1.660
  353    H    GLN  45           HN       GLN  45  90.983   6.305   4.631
  354    HA   GLN  45           HA       GLN  45  90.106   3.726   5.560
  355    HB2  GLN  45           HB2      GLN  45  90.877   5.575   7.055
  356    HB3  GLN  45           HB1      GLN  45  89.418   6.464   6.627
  357    HG2  GLN  45           HG2      GLN  45  89.016   3.653   7.532
  358    HG3  GLN  45           HG1      GLN  45  89.550   4.794   8.761
  359   HE21  GLN  45          HE21      GLN  45  87.325   4.450   9.715
  360   HE22  GLN  45          HE22      GLN  45  86.022   5.327   9.074
  361    HA   PRO  46           HA       PRO  46  86.181   4.573   3.496
  362    HB2  PRO  46           HB2      PRO  46  85.225   2.035   3.314
  363    HB3  PRO  46           HB1      PRO  46  86.570   2.591   2.293
  364    HG2  PRO  46           HG2      PRO  46  86.633   0.906   4.748
  365    HG3  PRO  46           HG1      PRO  46  87.629   0.810   3.288
  366    HD2  PRO  46           HD2      PRO  46  88.396   2.046   5.707
  367    HD3  PRO  46           HD1      PRO  46  89.188   2.267   4.134
  368    H    GLN  47           HN       GLN  47  83.859   4.349   4.100
  369    HA   GLN  47           HA       GLN  47  83.433   4.802   6.858
  370    HB2  GLN  47           HB2      GLN  47  81.521   4.286   4.582
  371    HB3  GLN  47           HB1      GLN  47  80.999   4.717   6.210
  372    HG2  GLN  47           HG2      GLN  47  82.059   6.840   6.106
  373    HG3  GLN  47           HG1      GLN  47  83.014   6.381   4.698
  374   HE21  GLN  47          HE21      GLN  47  79.859   5.172   4.360
  375   HE22  GLN  47          HE22      GLN  47  79.227   6.415   3.394
  376    H    ASP  48           HN       ASP  48  82.809   1.944   4.840
  377    HA   ASP  48           HA       ASP  48  81.432   0.492   6.880
  378    HB2  ASP  48           HB2      ASP  48  82.673  -0.255   4.245
  379    HB3  ASP  48           HB1      ASP  48  82.009  -1.486   5.319
  380    H    TRP  49           HN       TRP  49  84.463   1.496   7.071
  381    HA   TRP  49           HA       TRP  49  86.061  -0.767   7.538
  382    HB2  TRP  49           HB2      TRP  49  86.858   1.597   7.341
  383    HB3  TRP  49           HB1      TRP  49  86.250   1.885   8.969
  384    HD1  TRP  49           HD1      TRP  49  87.555   0.884  10.955
  385    HE1  TRP  49           HE1      TRP  49  89.932  -0.189  11.178
  386    HE3  TRP  49           HE3      TRP  49  88.459  -0.051   6.077
  387    HZ2  TRP  49           HZ2      TRP  49  91.969  -1.326   9.351
  388    HZ3  TRP  49           HZ3      TRP  49  90.554  -1.123   5.327
  389    HH2  TRP  49           HH2      TRP  49  92.282  -1.764   6.972
  390    H    ASN  50           HN       ASN  50  84.179  -2.010   8.662
  391    HA   ASN  50           HA       ASN  50  84.055  -1.373  11.525
  392    HB2  ASN  50           HB2      ASN  50  81.930  -1.954  10.421
  393    HB3  ASN  50           HB1      ASN  50  82.601  -3.512   9.941
  394   HD21  ASN  50          HD21      ASN  50  83.753  -4.588  12.115
  395   HD22  ASN  50          HD22      ASN  50  82.695  -4.653  13.440
  396    H    GLY  51           HN       GLY  51  86.333  -1.861  11.839
  397    HA2  GLY  51           HA2      GLY  51  86.740  -4.742  12.317
  398    HA3  GLY  51           HA1      GLY  51  87.948  -3.852  11.393
  399    H    ASP  52           HN       ASP  52  88.500  -5.184  13.813
  400    HA   ASP  52           HA       ASP  52  88.715  -3.083  15.844
  401    HB2  ASP  52           HB2      ASP  52  87.920  -5.323  16.513
  402    HB3  ASP  52           HB1      ASP  52  89.461  -6.007  15.998
  403    HA   PRO  53           HA       PRO  53  92.812  -2.268  14.032
  404    HB2  PRO  53           HB2      PRO  53  93.048  -0.778  16.614
  405    HB3  PRO  53           HB1      PRO  53  93.451  -0.247  14.969
  406    HG2  PRO  53           HG2      PRO  53  91.231   0.575  16.204
  407    HG3  PRO  53           HG1      PRO  53  91.276   0.274  14.459
  408    HD2  PRO  53           HD2      PRO  53  89.993  -1.341  16.607
  409    HD3  PRO  53           HD1      PRO  53  89.559  -1.191  14.891
  410    H    GLN  54           HN       GLN  54  92.018  -3.609  17.124
  411    HA   GLN  54           HA       GLN  54  94.703  -4.242  17.874
  412    HB2  GLN  54           HB2      GLN  54  92.024  -5.223  18.867
  413    HB3  GLN  54           HB1      GLN  54  93.561  -5.740  19.562
  414    HG2  GLN  54           HG2      GLN  54  94.105  -3.533  20.263
  415    HG3  GLN  54           HG1      GLN  54  92.832  -2.825  19.269
  416   HE21  GLN  54          HE21      GLN  54  90.541  -4.047  19.885
  417   HE22  GLN  54          HE22      GLN  54  90.226  -4.049  21.553
  418    H    ARG  55           HN       ARG  55  92.311  -5.748  15.864
  419    HA   ARG  55           HA       ARG  55  93.794  -8.285  15.875
  420    HB2  ARG  55           HB2      ARG  55  91.070  -7.442  14.904
  421    HB3  ARG  55           HB1      ARG  55  91.814  -8.900  14.252
  422    HG2  ARG  55           HG2      ARG  55  90.553  -9.678  16.096
  423    HG3  ARG  55           HG1      ARG  55  92.197  -9.581  16.720
  424    HD2  ARG  55           HD2      ARG  55  91.333  -8.313  18.387
  425    HD3  ARG  55           HD1      ARG  55  91.182  -7.029  17.192
  426    HE   ARG  55           HE       ARG  55  88.886  -7.387  17.177
  427   HH11  ARG  55          HH21      ARG  55  90.560 -10.016  18.677
  428   HH12  ARG  55          HH22      ARG  55  89.121 -10.785  19.254
  429   HH21  ARG  55          HH11      ARG  55  86.992  -8.385  17.935
  430   HH22  ARG  55          HH12      ARG  55  87.099  -9.862  18.835
  431    HA   PRO  56           HA       PRO  56  96.039  -7.419  12.258
  432    HB2  PRO  56           HB2      PRO  56  96.004  -9.890  10.996
  433    HB3  PRO  56           HB1      PRO  56  97.065  -9.464  12.352
  434    HG2  PRO  56           HG2      PRO  56  94.501 -10.979  12.357
  435    HG3  PRO  56           HG1      PRO  56  95.976 -11.249  13.304
  436    HD2  PRO  56           HD2      PRO  56  93.779 -10.068  14.374
  437    HD3  PRO  56           HD1      PRO  56  95.426  -9.627  14.878
  438    H    PHE  57           HN       PHE  57  95.995  -7.275   9.948
  439    HA   PHE  57           HA       PHE  57  93.310  -7.492   8.721
  440    HB2  PHE  57           HB2      PHE  57  95.270  -5.191   8.475
  441    HB3  PHE  57           HB1      PHE  57  93.783  -5.358   7.548
  442    HD1  PHE  57           HD1      PHE  57  95.090  -5.128  11.047
  443    HD2  PHE  57           HD2      PHE  57  91.729  -4.600   8.428
  444    HE1  PHE  57           HE1      PHE  57  93.817  -4.052  12.887
  445    HE2  PHE  57           HE2      PHE  57  90.457  -3.538  10.266
  446    HZ   PHE  57           HZ       PHE  57  91.498  -3.263  12.494
  447    H    GLU  58           HN       GLU  58  93.414  -7.795   6.366
  448    HA   GLU  58           HA       GLU  58  96.102  -8.567   5.411
  449    HB2  GLU  58           HB2      GLU  58  93.503  -9.873   4.551
  450    HB3  GLU  58           HB1      GLU  58  95.136 -10.378   4.119
  451    HG2  GLU  58           HG2      GLU  58  95.543 -10.636   6.644
  452    HG3  GLU  58           HG1      GLU  58  93.794 -10.516   6.822
  453    H    ALA  59           HN       ALA  59  96.706  -7.707   3.414
  454    HA   ALA  59           HA       ALA  59  94.700  -5.968   2.080
  455    HB1  ALA  59           HB1      ALA  59  96.974  -4.883   1.299
  456    HB2  ALA  59           HB2      ALA  59  97.576  -5.637   2.775
  457    HB3  ALA  59           HB3      ALA  59  96.252  -4.474   2.852
  458    H    ARG  60           HN       ARG  60  94.412  -6.130  -0.041
  459    HA   ARG  60           HA       ARG  60  96.204  -7.908  -1.594
  460    HB2  ARG  60           HB2      ARG  60  93.193  -7.635  -1.706
  461    HB3  ARG  60           HB1      ARG  60  94.141  -8.418  -2.969
  462    HG2  ARG  60           HG2      ARG  60  95.086  -9.587  -0.603
  463    HG3  ARG  60           HG1      ARG  60  93.352  -9.445  -0.344
  464    HD2  ARG  60           HD2      ARG  60  94.588 -10.659  -2.822
  465    HD3  ARG  60           HD1      ARG  60  94.038 -11.596  -1.438
  466    HE   ARG  60           HE       ARG  60  92.357 -10.251  -3.402
  467   HH11  ARG  60          HH21      ARG  60  92.657 -11.756  -0.302
  468   HH12  ARG  60          HH22      ARG  60  90.970 -12.115  -0.157
  469   HH21  ARG  60          HH11      ARG  60  90.140 -10.718  -3.222
  470   HH22  ARG  60          HH12      ARG  60  89.544 -11.526  -1.811
  471    H    LEU  61           HN       LEU  61  97.127  -6.862  -3.303
  472    HA   LEU  61           HA       LEU  61  95.971  -4.257  -4.087
  473    HB2  LEU  61           HB2      LEU  61  98.766  -5.177  -4.710
  474    HB3  LEU  61           HB1      LEU  61  98.135  -3.533  -4.641
  475    HG   LEU  61           HG       LEU  61  98.353  -5.381  -2.245
  476   HD11  LEU  61          HD11      LEU  61 100.130  -3.137  -3.236
  477   HD12  LEU  61          HD12      LEU  61 100.584  -4.822  -2.976
  478   HD13  LEU  61          HD13      LEU  61 100.206  -3.788  -1.599
  479   HD21  LEU  61          HD21      LEU  61  98.032  -3.160  -1.048
  480   HD22  LEU  61          HD22      LEU  61  96.616  -3.745  -1.921
  481   HD23  LEU  61          HD23      LEU  61  97.613  -2.465  -2.614
  482    H    TYR  62           HN       TYR  62  95.847  -3.685  -6.266
  483    HA   TYR  62           HA       TYR  62  96.155  -5.889  -8.206
  484    HB2  TYR  62           HB2      TYR  62  93.814  -3.965  -8.146
  485    HB3  TYR  62           HB1      TYR  62  94.041  -5.325  -9.245
  486    HD1  TYR  62           HD1      TYR  62  93.476  -4.389  -5.691
  487    HD2  TYR  62           HD2      TYR  62  93.494  -7.554  -8.596
  488    HE1  TYR  62           HE1      TYR  62  92.388  -5.908  -4.050
  489    HE2  TYR  62           HE2      TYR  62  92.402  -9.064  -6.960
  490    HH   TYR  62           HH       TYR  62  91.383  -7.886  -3.767
  491    H    LEU  63           HN       LEU  63  97.742  -5.214  -9.484
  492    HA   LEU  63           HA       LEU  63  97.835  -2.377 -10.310
  493    HB2  LEU  63           HB2      LEU  63  99.865  -3.714  -9.287
  494    HB3  LEU  63           HB1      LEU  63 100.018  -4.353 -10.920
  495    HG   LEU  63           HG       LEU  63 100.078  -1.439 -10.093
  496   HD11  LEU  63          HD11      LEU  63 102.148  -3.058 -11.591
  497   HD12  LEU  63          HD12      LEU  63 102.143  -2.928  -9.831
  498   HD13  LEU  63          HD13      LEU  63 102.352  -1.484 -10.822
  499   HD21  LEU  63          HD21      LEU  63  99.935  -2.749 -12.818
  500   HD22  LEU  63          HD22      LEU  63 100.564  -1.117 -12.591
  501   HD23  LEU  63          HD23      LEU  63  98.892  -1.482 -12.168
  502    H    GLY  64           HN       GLY  64  99.116  -5.193 -12.026
  503    HA2  GLY  64           HA2      GLY  64  97.900  -4.326 -14.499
  504    HA3  GLY  64           HA1      GLY  64  98.881  -5.775 -14.266
  505    H    LEU  65           HN       LEU  65  96.803  -6.332 -15.792
  506    HA   LEU  65           HA       LEU  65  94.414  -6.854 -14.307
  507    HB2  LEU  65           HB2      LEU  65  95.364  -7.646 -17.059
  508    HB3  LEU  65           HB1      LEU  65  93.854  -8.272 -16.396
  509    HG   LEU  65           HG       LEU  65  92.992  -6.015 -16.099
  510   HD11  LEU  65          HD11      LEU  65  94.450  -4.125 -17.123
  511   HD12  LEU  65          HD12      LEU  65  95.794  -5.250 -16.921
  512   HD13  LEU  65          HD13      LEU  65  94.874  -4.714 -15.515
  513   HD21  LEU  65          HD21      LEU  65  92.929  -5.297 -18.476
  514   HD22  LEU  65          HD22      LEU  65  92.694  -7.038 -18.315
  515   HD23  LEU  65          HD23      LEU  65  94.256  -6.402 -18.832
  516    H    ASP  66           HN       ASP  66  97.313  -8.694 -15.133
  517    HA   ASP  66           HA       ASP  66  96.255 -11.170 -13.939
  518    HB2  ASP  66           HB2      ASP  66  97.377 -11.097 -16.201
  519    HB3  ASP  66           HB1      ASP  66  98.864 -10.682 -15.352
  520    H    VAL  67           HN       VAL  67  97.555  -8.449 -12.735
  521    HA   VAL  67           HA       VAL  67  99.573  -9.823 -11.067
  522    HB   VAL  67           HB       VAL  67  99.188  -6.949 -11.854
  523   HG11  VAL  67          HG11      VAL  67 101.180  -6.629 -10.148
  524   HG12  VAL  67          HG12      VAL  67 100.466  -8.030  -9.354
  525   HG13  VAL  67          HG13      VAL  67  99.516  -6.561  -9.570
  526   HG21  VAL  67          HG21      VAL  67 100.676  -8.685 -13.064
  527   HG22  VAL  67          HG22      VAL  67 101.724  -8.581 -11.647
  528   HG23  VAL  67          HG23      VAL  67 101.422  -7.147 -12.629
  529    H    LEU  68           HN       LEU  68  98.359 -10.808  -9.582
  530    HA   LEU  68           HA       LEU  68  96.689  -9.121  -7.817
  531    HB2  LEU  68           HB2      LEU  68  95.300 -10.856  -8.566
  532    HB3  LEU  68           HB1      LEU  68  96.616 -12.027  -8.604
  533    HG   LEU  68           HG       LEU  68  96.691 -12.061  -6.158
  534   HD11  LEU  68          HD11      LEU  68  94.594 -10.862  -5.074
  535   HD12  LEU  68          HD12      LEU  68  94.702  -9.834  -6.501
  536   HD13  LEU  68          HD13      LEU  68  96.067  -9.948  -5.391
  537   HD21  LEU  68          HD21      LEU  68  95.211 -13.680  -7.108
  538   HD22  LEU  68          HD22      LEU  68  93.978 -12.463  -7.439
  539   HD23  LEU  68          HD23      LEU  68  94.319 -12.944  -5.776
  540    H    ILE  69           HN       ILE  69  97.743  -8.534  -6.003
  541    HA   ILE  69           HA       ILE  69  99.830 -10.363  -4.959
  542    HB   ILE  69           HB       ILE  69  99.631  -7.350  -4.919
  543   HG12  ILE  69          HG12      ILE  69 102.089  -8.808  -5.761
  544   HG13  ILE  69          HG11      ILE  69 100.687  -9.023  -6.806
  545   HG21  ILE  69          HG21      ILE  69 101.031  -9.189  -3.080
  546   HG22  ILE  69          HG22      ILE  69 100.628  -7.489  -2.874
  547   HG23  ILE  69          HG23      ILE  69 102.068  -7.949  -3.787
  548   HD11  ILE  69          HD11      ILE  69 100.453  -6.472  -6.785
  549   HD12  ILE  69          HD12      ILE  69 101.836  -7.122  -7.664
  550   HD13  ILE  69          HD13      ILE  69 102.059  -6.435  -6.055
  551    H    ARG  70           HN       ARG  70  99.930 -10.820  -2.801
  552    HA   ARG  70           HA       ARG  70  97.738  -9.797  -1.100
  553    HB2  ARG  70           HB2      ARG  70  98.040 -12.268  -0.076
  554    HB3  ARG  70           HB1      ARG  70  96.871 -11.894  -1.340
  555    HG2  ARG  70           HG2      ARG  70  98.340 -12.686  -3.058
  556    HG3  ARG  70           HG1      ARG  70  99.699 -12.790  -1.936
  557    HD2  ARG  70           HD2      ARG  70  98.002 -14.882  -2.591
  558    HD3  ARG  70           HD1      ARG  70  99.054 -14.829  -1.182
  559    HE   ARG  70           HE       ARG  70  96.997 -13.677  -0.094
  560   HH11  ARG  70          HH21      ARG  70  96.923 -16.171  -2.505
  561   HH12  ARG  70          HH22      ARG  70  95.384 -16.787  -2.005
  562   HH21  ARG  70          HH11      ARG  70  94.990 -14.491   0.559
  563   HH22  ARG  70          HH12      ARG  70  94.293 -15.840  -0.274
  564    H    MET  71           HN       MET  71  98.330  -9.069   0.810
  565    HA   MET  71           HA       MET  71 100.873  -9.949   2.009
  566    HB2  MET  71           HB2      MET  71 100.360  -7.074   2.346
  567    HB3  MET  71           HB1      MET  71 101.865  -7.909   1.990
  568    HG2  MET  71           HG2      MET  71 100.606  -8.205  -0.399
  569    HG3  MET  71           HG1      MET  71  99.884  -6.691   0.132
  570    HE1  MET  71           HE1      MET  71 101.588  -4.215   0.206
  571    HE2  MET  71           HE2      MET  71 102.995  -4.671   1.163
  572    HE3  MET  71           HE3      MET  71 101.395  -5.231   1.640
  573    H    GLU  72           HN       GLU  72 100.902  -9.793   4.261
  574    HA   GLU  72           HA       GLU  72  98.260  -9.388   5.498
  575    HB2  GLU  72           HB2      GLU  72 100.181 -11.420   5.827
  576    HB3  GLU  72           HB1      GLU  72 100.309 -10.445   7.288
  577    HG2  GLU  72           HG2      GLU  72  98.633 -12.063   7.769
  578    HG3  GLU  72           HG1      GLU  72  97.751 -10.578   7.417
  579    H    ILE  73           HN       ILE  73  97.993  -7.617   6.909
  580    HA   ILE  73           HA       ILE  73 100.461  -6.220   7.718
  581    HB   ILE  73           HB       ILE  73  99.635  -4.134   6.889
  582   HG12  ILE  73          HG12      ILE  73  97.147  -5.748   6.239
  583   HG13  ILE  73          HG11      ILE  73  97.261  -4.373   7.331
  584   HG21  ILE  73          HG21      ILE  73 100.723  -5.824   5.313
  585   HG22  ILE  73          HG22      ILE  73  99.764  -4.569   4.539
  586   HG23  ILE  73          HG23      ILE  73  99.100  -6.189   4.734
  587   HD11  ILE  73          HD11      ILE  73  96.272  -3.915   5.015
  588   HD12  ILE  73          HD12      ILE  73  97.903  -4.125   4.388
  589   HD13  ILE  73          HD13      ILE  73  97.561  -2.842   5.535
  590    H    SER  74           HN       SER  74 100.225  -4.689   9.382
  591    HA   SER  74           HA       SER  74  97.781  -4.961  11.037
  592    HB2  SER  74           HB2      SER  74  99.606  -4.386  12.911
  593    HB3  SER  74           HB1      SER  74  99.271  -6.041  12.416
  594    HG   SER  74           HG       SER  74 100.992  -5.196  10.688
  595    H    LEU  75           HN       LEU  75  97.251  -3.084  12.329
  596    HA   LEU  75           HA       LEU  75  97.466  -0.619  10.949
  597    HB2  LEU  75           HB2      LEU  75  95.779  -1.567  12.797
  598    HB3  LEU  75           HB1      LEU  75  96.843  -0.652  13.860
  599    HG   LEU  75           HG       LEU  75  95.073   0.832  13.178
  600   HD11  LEU  75          HD11      LEU  75  96.324   2.632  12.318
  601   HD12  LEU  75          HD12      LEU  75  97.346   1.579  11.342
  602   HD13  LEU  75          HD13      LEU  75  97.534   1.615  13.095
  603   HD21  LEU  75          HD21      LEU  75  94.770  -0.682  10.975
  604   HD22  LEU  75          HD22      LEU  75  95.717   0.624  10.264
  605   HD23  LEU  75          HD23      LEU  75  94.182   0.977  11.055
  606    H    ALA  76           HN       ALA  76  99.163   0.707  10.859
  607    HA   ALA  76           HA       ALA  76 101.131   0.609  13.029
  608    HB1  ALA  76           HB1      ALA  76 101.360   1.791  10.251
  609    HB2  ALA  76           HB2      ALA  76 102.101   0.295  10.815
  610    HB3  ALA  76           HB3      ALA  76 102.633   1.840  11.474
  611    H    TRP  77           HN       TRP  77  99.036   2.787  11.245
  612    HA   TRP  77           HA       TRP  77  98.616   4.488  13.501
  613    HB2  TRP  77           HB2      TRP  77  99.686   6.532  12.631
  614    HB3  TRP  77           HB1      TRP  77 100.900   5.267  12.868
  615    HD1  TRP  77           HD1      TRP  77 102.028   4.223  10.759
  616    HE1  TRP  77           HE1      TRP  77 101.896   4.705   8.232
  617    HE3  TRP  77           HE3      TRP  77  98.216   7.617  10.694
  618    HZ2  TRP  77           HZ2      TRP  77 100.553   6.476   6.466
  619    HZ3  TRP  77           HZ3      TRP  77  97.525   8.691   8.568
  620    HH2  TRP  77           HH2      TRP  77  98.674   8.112   6.444
  621    H    ALA  78           HN       ALA  78  97.339   6.493  12.806
  622    HA   ALA  78           HA       ALA  78  96.027   6.302  10.187
  623    HB1  ALA  78           HB1      ALA  78  94.631   4.831  11.482
  624    HB2  ALA  78           HB2      ALA  78  93.775   6.359  11.280
  625    HB3  ALA  78           HB3      ALA  78  94.564   5.987  12.812
  626    H    ARG  79           HN       ARG  79  95.916   8.400   9.455
  627    HA   ARG  79           HA       ARG  79  95.097  10.480  11.304
  628    HB2  ARG  79           HB2      ARG  79  97.658  10.199  11.429
  629    HB3  ARG  79           HB1      ARG  79  97.685  10.887   9.808
  630    HG2  ARG  79           HG2      ARG  79  96.615  12.917  10.586
  631    HG3  ARG  79           HG1      ARG  79  96.378  12.226  12.192
  632    HD2  ARG  79           HD2      ARG  79  98.990  11.920  12.133
  633    HD3  ARG  79           HD1      ARG  79  98.916  13.161  10.886
  634    HE   ARG  79           HE       ARG  79  98.327  14.716  12.524
  635   HH11  ARG  79          HH21      ARG  79  98.167  11.471  13.710
  636   HH12  ARG  79          HH22      ARG  79  97.965  11.937  15.365
  637   HH21  ARG  79          HH11      ARG  79  98.063  15.338  14.697
  638   HH22  ARG  79          HH12      ARG  79  97.903  14.125  15.924
  639    H    ASP  80           HN       ASP  80  93.917  12.043  10.383
  640    HA   ASP  80           HA       ASP  80  92.814  13.245   8.785
  641    HB2  ASP  80           HB2      ASP  80  95.249  13.926   8.457
  642    HB3  ASP  80           HB1      ASP  80  95.242  12.861   7.054
  643    H    GLY  81           HN       GLY  81  91.936  10.594   8.666
  644    HA2  GLY  81           HA2      GLY  81  90.546   9.483   7.211
  645    HA3  GLY  81           HA1      GLY  81  91.101  10.528   5.915
  646    H    LEU  82           HN       LEU  82  93.995   9.781   6.469
  647    HA   LEU  82           HA       LEU  82  93.914   7.350   4.867
  648    HB2  LEU  82           HB2      LEU  82  96.443   8.715   5.737
  649    HB3  LEU  82           HB1      LEU  82  96.091   7.858   4.235
  650    HG   LEU  82           HG       LEU  82  94.994  10.559   5.063
  651   HD11  LEU  82          HD11      LEU  82  96.634   9.887   2.618
  652   HD12  LEU  82          HD12      LEU  82  97.404  10.297   4.152
  653   HD13  LEU  82          HD13      LEU  82  96.353  11.466   3.352
  654   HD21  LEU  82          HD21      LEU  82  93.238   9.475   3.871
  655   HD22  LEU  82          HD22      LEU  82  94.366   8.718   2.745
  656   HD23  LEU  82          HD23      LEU  82  94.068  10.455   2.661
  657    H    LEU  83           HN       LEU  83  95.307   5.532   5.367
  658    HA   LEU  83           HA       LEU  83  95.707   5.092   8.291
  659    HB2  LEU  83           HB2      LEU  83  94.700   3.090   6.291
  660    HB3  LEU  83           HB1      LEU  83  94.876   2.877   8.031
  661    HG   LEU  83           HG       LEU  83  93.084   4.969   6.772
  662   HD11  LEU  83          HD11      LEU  83  92.153   2.872   6.132
  663   HD12  LEU  83          HD12      LEU  83  91.267   3.346   7.580
  664   HD13  LEU  83          HD13      LEU  83  92.546   2.138   7.686
  665   HD21  LEU  83          HD21      LEU  83  93.540   3.935   9.580
  666   HD22  LEU  83          HD22      LEU  83  92.053   4.769   9.134
  667   HD23  LEU  83          HD23      LEU  83  93.601   5.603   9.011
  668    H    GLY  84           HN       GLY  84  97.715   4.197   8.788
  669    HA2  GLY  84           HA2      GLY  84  99.411   3.360   6.540
  670    HA3  GLY  84           HA1      GLY  84  99.955   3.779   8.157
  671    H    PHE  85           HN       PHE  85 100.551   1.380   6.650
  672    HA   PHE  85           HA       PHE  85  99.679  -0.561   8.671
  673    HB2  PHE  85           HB2      PHE  85  99.122  -0.691   5.725
  674    HB3  PHE  85           HB1      PHE  85  99.349  -2.170   6.647
  675    HD1  PHE  85           HD2      PHE  85  97.887  -2.613   8.656
  676    HD2  PHE  85           HD1      PHE  85  97.098   0.560   5.880
  677    HE1  PHE  85           HE2      PHE  85  95.565  -2.458   9.505
  678    HE2  PHE  85           HE1      PHE  85  94.767   0.711   6.724
  679    HZ   PHE  85           HZ       PHE  85  94.007  -0.793   8.537
  680    H    GLU  86           HN       GLU  86 101.274  -1.974   9.215
  681    HA   GLU  86           HA       GLU  86 103.771  -1.807   7.661
  682    HB2  GLU  86           HB2      GLU  86 104.856  -2.674   9.697
  683    HB3  GLU  86           HB1      GLU  86 103.934  -1.213  10.054
  684    HG2  GLU  86           HG2      GLU  86 101.998  -2.796  10.668
  685    HG3  GLU  86           HG1      GLU  86 103.209  -4.078  10.673
  686    H    CYS  87           HN       CYS  87 104.379  -3.553   6.496
  687    HA   CYS  87           HA       CYS  87 102.694  -5.864   6.404
  688    HB2  CYS  87           HB2      CYS  87 104.935  -4.770   4.871
  689    HB3  CYS  87           HB1      CYS  87 104.967  -6.529   4.978
  690    HG   CYS  87           HG       CYS  87 102.337  -5.119   4.066
  691    H    GLN  88           HN       GLN  88 102.799  -7.654   7.546
  692    HA   GLN  88           HA       GLN  88 105.209  -8.172   9.163
  693    HB2  GLN  88           HB2      GLN  88 103.329  -9.957  10.059
  694    HB3  GLN  88           HB1      GLN  88 103.599  -8.359  10.752
  695    HG2  GLN  88           HG2      GLN  88 101.906  -7.445   9.128
  696    HG3  GLN  88           HG1      GLN  88 101.555  -9.103   8.646
  697   HE21  GLN  88          HE21      GLN  88 101.193  -6.738  11.232
  698   HE22  GLN  88          HE22      GLN  88 100.141  -7.673  12.183
  699    H    HIS  89           HN       HIS  89 103.169  -9.485   6.634
  700    HA   HIS  89           HA       HIS  89 105.225 -11.396   5.946
  701    HB2  HIS  89           HB2      HIS  89 104.339 -13.076   7.201
  702    HB3  HIS  89           HB1      HIS  89 102.814 -12.224   7.427
  703    HD2  HIS  89           HD2      HIS  89 100.970 -14.039   6.421
  704    HE1  HIS  89           HE1      HIS  89 102.897 -14.841   2.748
  705    HE2  HIS  89           HE2      HIS  89 100.802 -15.267   4.122
  706    H    ILE  90           HN       ILE  90 105.154 -11.899   3.813
  707    HA   ILE  90           HA       ILE  90 102.754 -11.356   2.206
  708    HB   ILE  90           HB       ILE  90 103.864  -9.205   2.200
  709   HG12  ILE  90          HG12      ILE  90 104.566 -10.738  -0.327
  710   HG13  ILE  90          HG11      ILE  90 102.981 -10.065   0.038
  711   HG21  ILE  90          HG21      ILE  90 106.047  -9.681   2.962
  712   HG22  ILE  90          HG22      ILE  90 106.281  -9.167   1.294
  713   HG23  ILE  90          HG23      ILE  90 106.322 -10.881   1.702
  714   HD11  ILE  90          HD11      ILE  90 105.519  -8.659  -0.676
  715   HD12  ILE  90          HD12      ILE  90 104.400  -7.842   0.413
  716   HD13  ILE  90          HD13      ILE  90 103.869  -8.325  -1.198
  717    H    ASP  91           HN       ASP  91 102.563 -12.537   0.450
  718    HA   ASP  91           HA       ASP  91 103.809 -15.008   0.323
  719    HB2  ASP  91           HB2      ASP  91 101.811 -13.624  -1.126
  720    HB3  ASP  91           HB1      ASP  91 102.952 -14.245  -2.314
  721    H    LEU  92           HN       LEU  92 105.432 -15.903  -0.782
  722    HA   LEU  92           HA       LEU  92 107.762 -14.463  -1.332
  723    HB2  LEU  92           HB2      LEU  92 107.408 -17.020  -1.032
  724    HB3  LEU  92           HB1      LEU  92 107.120 -17.027  -2.771
  725    HG   LEU  92           HG       LEU  92 109.365 -15.643  -2.857
  726   HD11  LEU  92          HD11      LEU  92 109.848 -17.272  -0.354
  727   HD12  LEU  92          HD12      LEU  92 109.397 -15.569  -0.284
  728   HD13  LEU  92          HD13      LEU  92 110.895 -16.053  -1.077
  729   HD21  LEU  92          HD21      LEU  92 109.123 -18.619  -2.352
  730   HD22  LEU  92          HD22      LEU  92 110.626 -17.861  -2.876
  731   HD23  LEU  92          HD23      LEU  92 109.199 -17.794  -3.908
  732    H    ASP  93           HN       ASP  93 105.208 -15.546  -3.539
  733    HA   ASP  93           HA       ASP  93 106.425 -14.557  -5.908
  734    HB2  ASP  93           HB2      ASP  93 104.135 -14.791  -6.880
  735    HB3  ASP  93           HB1      ASP  93 104.694 -16.245  -6.056
  736    H    SER  94           HN       SER  94 104.048 -13.226  -3.643
  737    HA   SER  94           HA       SER  94 103.505 -10.834  -5.046
  738    HB2  SER  94           HB2      SER  94 103.022 -10.028  -2.584
  739    HB3  SER  94           HB1      SER  94 101.986 -11.239  -3.338
  740    HG   SER  94           HG       SER  94 104.279 -11.889  -1.808
  741    H    ILE  95           HN       ILE  95 106.023 -11.760  -2.768
  742    HA   ILE  95           HA       ILE  95 107.115  -9.229  -2.241
  743    HB   ILE  95           HB       ILE  95 108.297 -12.005  -2.285
  744   HG12  ILE  95          HG12      ILE  95 107.923 -10.012  -0.036
  745   HG13  ILE  95          HG11      ILE  95 106.711 -11.212  -0.476
  746   HG21  ILE  95          HG21      ILE  95 110.270 -10.820  -1.090
  747   HG22  ILE  95          HG22      ILE  95 109.675  -9.351  -1.861
  748   HG23  ILE  95          HG23      ILE  95 110.200 -10.715  -2.849
  749   HD11  ILE  95          HD11      ILE  95 107.931 -12.958   0.371
  750   HD12  ILE  95          HD12      ILE  95 108.607 -11.683   1.381
  751   HD13  ILE  95          HD13      ILE  95 109.478 -12.224  -0.054
  752    H    SER  96           HN       SER  96 107.606 -11.481  -4.910
  753    HA   SER  96           HA       SER  96 109.761 -10.001  -6.016
  754    HB2  SER  96           HB2      SER  96 108.642 -12.494  -6.515
  755    HB3  SER  96           HB1      SER  96 108.197 -11.574  -7.953
  756    HG   SER  96           HG       SER  96 110.187 -12.235  -8.447
  757    H    HIS  97           HN       HIS  97 106.266  -9.973  -6.599
  758    HA   HIS  97           HA       HIS  97 106.396  -8.261  -8.843
  759    HB2  HIS  97           HB2      HIS  97 104.249  -8.824  -6.797
  760    HB3  HIS  97           HB1      HIS  97 104.035  -7.579  -8.013
  761    HD2  HIS  97           HD2      HIS  97 104.048 -11.459  -7.770
  762    HE1  HIS  97           HE1      HIS  97 103.307 -10.415 -11.790
  763    HE2  HIS  97           HE2      HIS  97 103.370 -12.338 -10.133
  764    H    LEU  98           HN       LEU  98 106.471  -7.671  -5.389
  765    HA   LEU  98           HA       LEU  98 106.273  -4.804  -5.572
  766    HB2  LEU  98           HB2      LEU  98 106.899  -6.809  -3.469
  767    HB3  LEU  98           HB1      LEU  98 107.653  -5.229  -3.258
  768    HG   LEU  98           HG       LEU  98 104.688  -5.686  -3.717
  769   HD11  LEU  98          HD11      LEU  98 106.139  -4.870  -1.184
  770   HD12  LEU  98          HD12      LEU  98 105.553  -6.500  -1.506
  771   HD13  LEU  98          HD13      LEU  98 104.411  -5.166  -1.362
  772   HD21  LEU  98          HD21      LEU  98 104.970  -3.182  -2.645
  773   HD22  LEU  98          HD22      LEU  98 104.869  -3.500  -4.375
  774   HD23  LEU  98          HD23      LEU  98 106.443  -3.293  -3.609
  775    H    ARG  99           HN       ARG  99 108.918  -7.115  -5.725
  776    HA   ARG  99           HA       ARG  99 110.994  -5.156  -5.661
  777    HB2  ARG  99           HB2      ARG  99 110.797  -8.027  -6.493
  778    HB3  ARG  99           HB1      ARG  99 112.216  -7.100  -6.980
  779    HG2  ARG  99           HG2      ARG  99 112.925  -6.766  -4.783
  780    HG3  ARG  99           HG1      ARG  99 111.304  -6.971  -4.120
  781    HD2  ARG  99           HD2      ARG  99 111.395  -9.309  -4.285
  782    HD3  ARG  99           HD1      ARG  99 112.689  -9.273  -5.478
  783    HE   ARG  99           HE       ARG  99 112.983  -9.013  -2.580
  784   HH11  ARG  99          HH21      ARG  99 114.365  -8.768  -5.745
  785   HH12  ARG  99          HH22      ARG  99 116.001  -8.868  -5.187
  786   HH21  ARG  99          HH11      ARG  99 115.126  -9.143  -1.843
  787   HH22  ARG  99          HH12      ARG  99 116.432  -9.080  -2.979
  788    H    ARG 100           HN       ARG 100 109.131  -6.707  -8.223
  789    HA   ARG 100           HA       ARG 100 110.384  -5.665 -10.517
  790    HB2  ARG 100           HB2      ARG 100 107.527  -6.417  -9.917
  791    HB3  ARG 100           HB1      ARG 100 108.049  -5.862 -11.507
  792    HG2  ARG 100           HG2      ARG 100 109.916  -7.715 -11.206
  793    HG3  ARG 100           HG1      ARG 100 108.766  -8.391 -10.053
  794    HD2  ARG 100           HD2      ARG 100 107.011  -8.134 -11.918
  795    HD3  ARG 100           HD1      ARG 100 108.375  -7.889 -13.003
  796    HE   ARG 100           HE       ARG 100 108.931 -10.150 -12.763
  797   HH11  ARG 100          HH21      ARG 100 106.474  -9.166 -10.531
  798   HH12  ARG 100          HH22      ARG 100 106.076 -10.780 -10.046
  799   HH21  ARG 100          HH11      ARG 100 108.412 -12.269 -12.132
  800   HH22  ARG 100          HH12      ARG 100 107.173 -12.536 -10.951
  801    H    LEU 101           HN       LEU 101 107.978  -4.318  -8.339
  802    HA   LEU 101           HA       LEU 101 107.429  -1.979  -9.875
  803    HB2  LEU 101           HB2      LEU 101 106.745  -3.015  -7.185
  804    HB3  LEU 101           HB1      LEU 101 106.744  -1.260  -7.337
  805    HG   LEU 101           HG       LEU 101 105.103  -1.303  -9.060
  806   HD11  LEU 101          HD11      LEU 101 105.996  -4.133  -9.362
  807   HD12  LEU 101          HD12      LEU 101 105.563  -2.953 -10.597
  808   HD13  LEU 101          HD13      LEU 101 104.299  -3.795  -9.704
  809   HD21  LEU 101          HD21      LEU 101 104.166  -3.583  -7.325
  810   HD22  LEU 101          HD22      LEU 101 103.252  -2.198  -7.921
  811   HD23  LEU 101          HD23      LEU 101 104.432  -1.985  -6.629
  812    H    VAL 102           HN       VAL 102 109.572  -2.631  -7.104
  813    HA   VAL 102           HA       VAL 102 110.479   0.018  -6.791
  814    HB   VAL 102           HB       VAL 102 110.904  -2.377  -5.481
  815   HG11  VAL 102          HG11      VAL 102 113.580  -1.485  -6.597
  816   HG12  VAL 102          HG12      VAL 102 112.726  -2.946  -7.097
  817   HG13  VAL 102          HG13      VAL 102 113.300  -2.785  -5.441
  818   HG21  VAL 102          HG21      VAL 102 112.164   0.353  -5.251
  819   HG22  VAL 102          HG22      VAL 102 112.571  -0.931  -4.112
  820   HG23  VAL 102          HG23      VAL 102 110.905  -0.373  -4.250
  821    H    GLU 103           HN       GLU 103 111.699  -2.667  -8.749
  822    HA   GLU 103           HA       GLU 103 113.988  -1.336  -9.751
  823    HB2  GLU 103           HB2      GLU 103 112.786  -3.888 -10.007
  824    HB3  GLU 103           HB1      GLU 103 112.969  -3.258 -11.643
  825    HG2  GLU 103           HG2      GLU 103 115.167  -3.400  -9.556
  826    HG3  GLU 103           HG1      GLU 103 114.986  -4.493 -10.927
  827    H    LEU 104           HN       LEU 104 110.697  -1.715 -11.060
  828    HA   LEU 104           HA       LEU 104 111.279  -0.286 -13.471
  829    HB2  LEU 104           HB2      LEU 104 108.652  -1.018 -12.162
  830    HB3  LEU 104           HB1      LEU 104 108.794  -0.299 -13.764
  831    HG   LEU 104           HG       LEU 104 110.322  -2.807 -13.076
  832   HD11  LEU 104          HD11      LEU 104 108.463  -4.150 -13.903
  833   HD12  LEU 104          HD12      LEU 104 107.503  -2.699 -14.189
  834   HD13  LEU 104          HD13      LEU 104 107.906  -3.178 -12.541
  835   HD21  LEU 104          HD21      LEU 104 110.966  -1.772 -15.152
  836   HD22  LEU 104          HD22      LEU 104 109.286  -1.510 -15.614
  837   HD23  LEU 104          HD23      LEU 104 109.945  -3.145 -15.573
  838    H    ASN 105           HN       ASN 105 110.384   0.667 -10.263
  839    HA   ASN 105           HA       ASN 105 109.087   3.096 -10.762
  840    HB2  ASN 105           HB2      ASN 105 109.809   1.772  -8.511
  841    HB3  ASN 105           HB1      ASN 105 111.010   3.058  -8.500
  842   HD21  ASN 105          HD21      ASN 105 107.533   3.003  -9.483
  843   HD22  ASN 105          HD22      ASN 105 107.086   4.298  -8.481
  844    H    LEU 106           HN       LEU 106 112.521   2.292 -10.731
  845    HA   LEU 106           HA       LEU 106 113.418   5.008 -10.980
  846    HB2  LEU 106           HB2      LEU 106 114.723   2.309 -11.252
  847    HB3  LEU 106           HB1      LEU 106 115.589   3.781 -11.696
  848    HG   LEU 106           HG       LEU 106 115.351   4.685  -9.475
  849   HD11  LEU 106          HD11      LEU 106 114.190   3.229  -7.713
  850   HD12  LEU 106          HD12      LEU 106 113.501   2.328  -9.063
  851   HD13  LEU 106          HD13      LEU 106 113.135   4.043  -8.868
  852   HD21  LEU 106          HD21      LEU 106 116.541   2.985  -8.149
  853   HD22  LEU 106          HD22      LEU 106 117.154   3.012  -9.802
  854   HD23  LEU 106          HD23      LEU 106 116.049   1.735  -9.292
  855    H    GLY 107           HN       GLY 107 112.357   2.538 -13.177
  856    HA2  GLY 107           HA2      GLY 107 111.630   3.036 -15.390
  857    HA3  GLY 107           HA1      GLY 107 112.733   4.407 -15.421
  858    H    ASP 108           HN       ASP 108 115.013   3.996 -15.664
  859    HA   ASP 108           HA       ASP 108 115.733   1.303 -16.603
  860    HB2  ASP 108           HB2      ASP 108 115.156   3.383 -18.366
  861    HB3  ASP 108           HB1      ASP 108 116.914   3.394 -18.272
  862    H    GLU 109           HN       GLU 109 117.407   4.444 -16.767
  863    HA   GLU 109           HA       GLU 109 118.959   4.273 -14.477
  864    HB2  GLU 109           HB2      GLU 109 119.736   2.304 -16.435
  865    HB3  GLU 109           HB1      GLU 109 121.036   3.478 -16.249
  866    HG2  GLU 109           HG2      GLU 109 119.663   2.119 -13.913
  867    HG3  GLU 109           HG1      GLU 109 121.156   1.534 -14.644
  868    H    GLU 110           HN       GLU 110 117.809   5.962 -16.780
  869    HA   GLU 110           HA       GLU 110 120.192   7.657 -17.251
  870    HB2  GLU 110           HB2      GLU 110 117.613   7.381 -18.806
  871    HB3  GLU 110           HB1      GLU 110 118.829   8.620 -19.126
  872    HG2  GLU 110           HG2      GLU 110 120.489   6.972 -19.664
  873    HG3  GLU 110           HG1      GLU 110 119.463   5.663 -19.079
  874    H    LEU 111           HN       LEU 111 117.586   7.403 -15.271
  875    HA   LEU 111           HA       LEU 111 117.626  10.276 -14.707
  876    HB2  LEU 111           HB2      LEU 111 115.590   9.338 -16.228
  877    HB3  LEU 111           HB1      LEU 111 114.929   9.024 -14.625
  878    HG   LEU 111           HG       LEU 111 114.259  11.251 -15.364
  879   HD11  LEU 111          HD11      LEU 111 114.784  12.383 -13.388
  880   HD12  LEU 111          HD12      LEU 111 116.435  11.765 -13.352
  881   HD13  LEU 111          HD13      LEU 111 115.089  10.706 -12.935
  882   HD21  LEU 111          HD21      LEU 111 115.633  12.631 -16.517
  883   HD22  LEU 111          HD22      LEU 111 116.797  11.312 -16.567
  884   HD23  LEU 111          HD23      LEU 111 116.891  12.521 -15.288
  885    H    LEU 112           HN       LEU 112 118.387  10.261 -12.701
  886    HA   LEU 112           HA       LEU 112 117.849   8.128 -10.846
  887    HB2  LEU 112           HB2      LEU 112 119.301  10.764 -10.652
  888    HB3  LEU 112           HB1      LEU 112 119.054   9.736  -9.242
  889    HG   LEU 112           HG       LEU 112 121.260   9.392 -10.459
  890   HD11  LEU 112          HD11      LEU 112 121.291   7.116  -9.965
  891   HD12  LEU 112          HD12      LEU 112 119.667   6.846 -10.591
  892   HD13  LEU 112          HD13      LEU 112 119.892   7.646  -9.035
  893   HD21  LEU 112          HD21      LEU 112 120.140   9.614 -12.749
  894   HD22  LEU 112          HD22      LEU 112 119.549   7.969 -12.509
  895   HD23  LEU 112          HD23      LEU 112 121.282   8.282 -12.574
  896    H    GLU 113           HN       GLU 113 116.702   8.286  -8.878
  897    HA   GLU 113           HA       GLU 113 114.391  10.071  -9.032
  898    HB2  GLU 113           HB2      GLU 113 114.222   7.582  -8.542
  899    HB3  GLU 113           HB1      GLU 113 114.933   7.936  -6.967
  900    HG2  GLU 113           HG2      GLU 113 113.087   9.658  -6.653
  901    HG3  GLU 113           HG1      GLU 113 112.323   8.976  -8.087
  902    H    ARG 114           HN       ARG 114 116.364   8.974  -6.276
  903    HA   ARG 114           HA       ARG 114 115.828  10.845  -4.417
  904    HB2  ARG 114           HB2      ARG 114 118.545   9.740  -5.146
  905    HB3  ARG 114           HB1      ARG 114 118.230  10.665  -3.679
  906    HG2  ARG 114           HG2      ARG 114 116.431   8.999  -3.102
  907    HG3  ARG 114           HG1      ARG 114 116.967   8.031  -4.476
  908    HD2  ARG 114           HD2      ARG 114 119.327   8.218  -3.394
  909    HD3  ARG 114           HD1      ARG 114 118.451   8.678  -1.937
  910    HE   ARG 114           HE       ARG 114 117.191   6.395  -2.718
  911   HH11  ARG 114          HH21      ARG 114 120.493   7.309  -2.231
  912   HH12  ARG 114          HH22      ARG 114 121.006   5.724  -1.756
  913   HH21  ARG 114          HH11      ARG 114 117.856   4.314  -2.101
  914   HH22  ARG 114          HH12      ARG 114 119.514   4.027  -1.684
  915    H    GLU 115           HN       GLU 115 116.302  12.944  -3.937
  916    HA   GLU 115           HA       GLU 115 117.728  14.505  -6.014
  917    HB2  GLU 115           HB2      GLU 115 115.169  14.853  -5.638
  918    HB3  GLU 115           HB1      GLU 115 115.671  15.700  -4.176
  919    HG2  GLU 115           HG2      GLU 115 117.092  17.197  -5.504
  920    HG3  GLU 115           HG1      GLU 115 116.647  16.334  -6.975
  921    H    LEU 116           HN       LEU 116 119.049  16.227  -5.287
  922    HA   LEU 116           HA       LEU 116 120.451  15.645  -2.901
  923    HB2  LEU 116           HB2      LEU 116 121.103  16.982  -5.162
  924    HB3  LEU 116           HB1      LEU 116 120.772  18.350  -4.106
  925    HG   LEU 116           HG       LEU 116 123.127  17.804  -3.943
  926   HD11  LEU 116          HD11      LEU 116 121.708  18.344  -1.850
  927   HD12  LEU 116          HD12      LEU 116 123.322  17.679  -1.600
  928   HD13  LEU 116          HD13      LEU 116 121.908  16.639  -1.445
  929   HD21  LEU 116          HD21      LEU 116 122.467  15.249  -4.526
  930   HD22  LEU 116          HD22      LEU 116 122.645  15.100  -2.778
  931   HD23  LEU 116          HD23      LEU 116 123.991  15.684  -3.754
  932    H    ALA 117           HN       ALA 117 117.918  17.945  -3.668
  933    HA   ALA 117           HA       ALA 117 118.260  19.442  -1.300
  934    HB1  ALA 117           HB1      ALA 117 117.039  20.431  -3.182
  935    HB2  ALA 117           HB2      ALA 117 115.991  20.407  -1.765
  936    HB3  ALA 117           HB3      ALA 117 115.778  19.207  -3.040
  937    H    LEU 118           HN       LEU 118 116.787  16.485  -2.023
  938    HA   LEU 118           HA       LEU 118 114.934  16.219   0.142
  939    HB2  LEU 118           HB2      LEU 118 116.311  14.254  -1.670
  940    HB3  LEU 118           HB1      LEU 118 115.384  13.686  -0.288
  941    HG   LEU 118           HG       LEU 118 114.276  15.599  -2.358
  942   HD11  LEU 118          HD11      LEU 118 114.274  13.810  -3.751
  943   HD12  LEU 118          HD12      LEU 118 112.979  13.187  -2.732
  944   HD13  LEU 118          HD13      LEU 118 114.644  12.679  -2.451
  945   HD21  LEU 118          HD21      LEU 118 112.156  14.289  -1.254
  946   HD22  LEU 118          HD22      LEU 118 112.783  15.816  -0.636
  947   HD23  LEU 118          HD23      LEU 118 113.263  14.297   0.118
  948    H    LEU 119           HN       LEU 119 118.331  15.795  -0.224
  949    HA   LEU 119           HA       LEU 119 118.937  14.237   2.025
  950    HB2  LEU 119           HB2      LEU 119 120.428  15.700   0.133
  951    HB3  LEU 119           HB1      LEU 119 120.935  16.319   1.702
  952    HG   LEU 119           HG       LEU 119 120.727  13.348   1.186
  953   HD11  LEU 119          HD11      LEU 119 123.141  13.373   0.672
  954   HD12  LEU 119          HD12      LEU 119 123.124  15.136   0.703
  955   HD13  LEU 119          HD13      LEU 119 122.214  14.268  -0.534
  956   HD21  LEU 119          HD21      LEU 119 122.205  13.196   3.079
  957   HD22  LEU 119          HD22      LEU 119 120.933  14.333   3.525
  958   HD23  LEU 119          HD23      LEU 119 122.521  14.931   3.047
  959    H    VAL 120           HN       VAL 120 117.459  17.230   1.883
  960    HA   VAL 120           HA       VAL 120 118.254  18.630   4.237
  961    HB   VAL 120           HB       VAL 120 115.700  18.388   2.659
  962   HG11  VAL 120          HG11      VAL 120 116.320  19.931   5.177
  963   HG12  VAL 120          HG12      VAL 120 114.883  18.982   4.790
  964   HG13  VAL 120          HG13      VAL 120 115.147  20.541   4.009
  965   HG21  VAL 120          HG21      VAL 120 116.355  20.426   1.691
  966   HG22  VAL 120          HG22      VAL 120 117.888  19.565   1.835
  967   HG23  VAL 120          HG23      VAL 120 117.461  20.808   3.010
  968    H    SER 121           HN       SER 121 117.098  15.490   3.967
  969    HA   SER 121           HA       SER 121 115.435  15.604   6.365
  970    HB2  SER 121           HB2      SER 121 115.518  12.979   5.744
  971    HB3  SER 121           HB1      SER 121 114.394  14.115   4.999
  972    HG   SER 121           HG       SER 121 116.958  13.379   4.017
  973    H    ALA 122           HN       ALA 122 118.745  14.942   5.564
  974    HA   ALA 122           HA       ALA 122 119.170  13.313   7.966
  975    HB1  ALA 122           HB1      ALA 122 120.180  12.721   5.744
  976    HB2  ALA 122           HB2      ALA 122 121.338  12.901   7.062
  977    HB3  ALA 122           HB3      ALA 122 121.150  14.188   5.871
  978    H    HIS 123           HN       HIS 123 119.320  16.532   6.869
  979    HA   HIS 123           HA       HIS 123 120.142  17.659   9.327
  980    HB2  HIS 123           HB2      HIS 123 122.385  17.836   9.221
  981    HB3  HIS 123           HB1      HIS 123 122.305  16.538   8.039
  982    HD2  HIS 123           HD2      HIS 123 121.199  18.496   5.506
  983    HE1  HIS 123           HE1      HIS 123 124.857  20.503   6.134
  984    HE2  HIS 123           HE2      HIS 123 122.962  20.131   4.486
  985    H    ASP 124           HN       ASP 124 121.028  20.036   8.774
  986    HA   ASP 124           HA       ASP 124 120.287  21.240   6.332
  987    HB2  ASP 124           HB2      ASP 124 117.995  20.611   7.287
  988    HB3  ASP 124           HB1      ASP 124 118.313  21.794   8.554
  989    H    ASP 125           HN       ASP 125 120.329  21.716   9.830
  990    HA   ASP 125           HA       ASP 125 121.165  23.442  11.124
  991    HB2  ASP 125           HB2      ASP 125 123.297  22.746   9.137
  992    HB3  ASP 125           HB1      ASP 125 123.561  24.100  10.236
  993   H5'1  C2E 501          H5'1      C2E 501 105.862   0.684  11.701
  994   H5'2  C2E 501          H5'2      C2E 501 107.515   1.322  11.771
  995    H4'  C2E 501           H4'      C2E 501 107.544  -0.169   9.949
  996    H3'  C2E 501           H3'      C2E 501 107.123   2.657   8.951
  997    H2'  C2E 501           H2'      C2E 501 107.068   1.851   6.729
  998   HO2'  C2E 501          HO2'      C2E 501 107.931  -0.045   6.137
  999    H1'  C2E 501           H1'      C2E 501 105.423  -0.258   7.207
 1000    H8   C2E 501           H8       C2E 501 103.974   2.108   9.618
 1001    HN1  C2E 501           HN1      C2E 501 103.009   4.090   3.609
 1002   HN21  C2E 501          HN21      C2E 501 104.281   2.927   2.212
 1003   HN22  C2E 501          HN22      C2E 501 105.365   1.667   2.759
 1004   H511  C2E 501          H511      C2E 501 108.292   4.795   9.787
 1005   H512  C2E 501          H512      C2E 501 109.922   4.702  10.487
 1006    H4A  C2E 501           H4A      C2E 501 108.817   4.951  12.773
 1007    H3A  C2E 501           H3A      C2E 501 106.376   5.458  11.057
 1008    H2A  C2E 501           H2A      C2E 501 105.727   7.172  12.540
 1009   HO2A  C2E 501          HO2A      C2E 501 107.906   6.907  14.263
 1010    H1A  C2E 501           H1A      C2E 501 108.145   8.390  12.699
 1011    H81  C2E 501           H81      C2E 501 108.404   7.047   9.264
 1012   HN11  C2E 501          HN11      C2E 501 104.244  11.910   9.496
 1013   HN24  C2E 501          HN24      C2E 501 104.323  11.414  12.952
 1014   HN23  C2E 501          HN23      C2E 501 103.664  12.314  11.603
 1015   H5'1  C2E 502          H5'1      C2E 502 103.119  12.028   5.772
 1016   H5'2  C2E 502          H5'2      C2E 502 102.086  10.942   4.824
 1017    H4'  C2E 502           H4'      C2E 502 100.241  12.316   6.300
 1018    H3'  C2E 502           H3'      C2E 502 102.713  12.581   7.847
 1019    H2'  C2E 502           H2'      C2E 502 102.290  11.064   9.516
 1020   HO2'  C2E 502          HO2'      C2E 502  99.505  11.620   9.213
 1021    H1'  C2E 502           H1'      C2E 502 100.262   9.459   8.528
 1022    H8   C2E 502           H8       C2E 502 102.878   9.095   5.958
 1023    HN1  C2E 502           HN1      C2E 502 104.247   5.965  11.359
 1024   HN21  C2E 502          HN21      C2E 502 102.876   6.584  12.974
 1025   HN22  C2E 502          HN22      C2E 502 101.625   7.785  12.736
 1026   H511  C2E 502          H511      C2E 502 104.117  15.900   8.368
 1027   H512  C2E 502          H512      C2E 502 103.157  17.208   7.649
 1028    H4A  C2E 502           H4A      C2E 502 104.120  16.964   5.596
 1029    H3A  C2E 502           H3A      C2E 502 104.056  14.006   6.141
 1030    H2A  C2E 502           H2A      C2E 502 105.874  13.654   4.659
 1031   HO2A  C2E 502          HO2A      C2E 502 106.065  14.847   2.921
 1032    H1A  C2E 502           H1A      C2E 502 107.376  15.828   5.386
 1033    H81  C2E 502           H81      C2E 502 106.071  14.692   8.662
 1034   HN11  C2E 502          HN11      C2E 502 110.176  10.490   6.204
 1035   HN24  C2E 502          HN24      C2E 502 110.673  11.023   4.114
 1036   HN23  C2E 502          HN23      C2E 502 109.989  12.426   3.322
  Start of MODEL   16
    1    H    MET   1           H        MET   1 108.989  15.417  17.667
    2    HA   MET   1           HA       MET   1 106.730  15.246  16.334
    3    HB2  MET   1           HB2      MET   1 107.254  16.741  18.250
    4    HB3  MET   1           HB1      MET   1 108.059  17.848  17.139
    5    HG2  MET   1           HG2      MET   1 105.467  17.267  16.062
    6    HG3  MET   1           HG1      MET   1 105.263  17.694  17.760
    7    HE1  MET   1           HE1      MET   1 106.522  19.398  18.862
    8    HE2  MET   1           HE2      MET   1 105.127  20.398  18.464
    9    HE3  MET   1           HE3      MET   1 106.753  21.042  18.249
   10    H    SER   2           HN       SER   2 109.538  17.045  15.164
   11    HA   SER   2           HA       SER   2 109.874  18.235  13.200
   12    HB2  SER   2           HB2      SER   2 108.769  15.549  12.436
   13    HB3  SER   2           HB1      SER   2 109.208  16.719  11.194
   14    HG   SER   2           HG       SER   2 110.894  15.199  11.966
   15    H    ASP   3           HN       ASP   3 108.639  20.046  13.129
   16    HA   ASP   3           HA       ASP   3 105.858  19.793  12.197
   17    HB2  ASP   3           HB2      ASP   3 106.310  22.501  12.730
   18    HB3  ASP   3           HB1      ASP   3 105.502  21.354  13.796
   19    H    GLN   4           HN       GLN   4 108.541  19.705  10.682
   20    HA   GLN   4           HA       GLN   4 107.758  21.678   8.624
   21    HB2  GLN   4           HB2      GLN   4 110.537  20.554   9.116
   22    HB3  GLN   4           HB1      GLN   4 110.100  21.674   7.828
   23    HG2  GLN   4           HG2      GLN   4 111.004  23.033   9.560
   24    HG3  GLN   4           HG1      GLN   4 109.257  23.239   9.665
   25   HE21  GLN   4          HE21      GLN   4 110.858  20.274  10.778
   26   HE22  GLN   4          HE22      GLN   4 110.563  20.533  12.427
   27    H    HIS   5           HN       HIS   5 107.182  18.700   9.295
   28    HA   HIS   5           HA       HIS   5 106.445  16.952   8.001
   29    HB2  HIS   5           HB2      HIS   5 105.758  17.504   5.932
   30    HB3  HIS   5           HB1      HIS   5 106.471  19.083   6.208
   31    HD2  HIS   5           HD2      HIS   5 109.687  18.022   5.811
   32    HE1  HIS   5           HE1      HIS   5 108.325  17.017   1.951
   33    HE2  HIS   5           HE2      HIS   5 110.384  17.440   3.369
   34    H    ASP   6           HN       ASP   6 109.392  17.673   8.805
   35    HA   ASP   6           HA       ASP   6 111.412  16.643   7.420
   36    HB2  ASP   6           HB2      ASP   6 110.840  15.516  10.154
   37    HB3  ASP   6           HB1      ASP   6 112.406  15.842   9.415
   38    H    GLU   7           HN       GLU   7 112.310  14.657   6.844
   39    HA   GLU   7           HA       GLU   7 110.350  12.609   6.253
   40    HB2  GLU   7           HB2      GLU   7 111.763  12.962   4.445
   41    HB3  GLU   7           HB1      GLU   7 113.200  13.084   5.461
   42    HG2  GLU   7           HG2      GLU   7 111.651  10.508   5.378
   43    HG3  GLU   7           HG1      GLU   7 112.772  10.891   4.073
   44    H    ARG   8           HN       ARG   8 110.115  10.717   7.216
   45    HA   ARG   8           HA       ARG   8 112.001   9.948   9.363
   46    HB2  ARG   8           HB2      ARG   8 109.002  10.026   9.305
   47    HB3  ARG   8           HB1      ARG   8 109.840   8.882  10.339
   48    HG2  ARG   8           HG2      ARG   8 109.585  10.716  11.764
   49    HG3  ARG   8           HG1      ARG   8 111.210  10.962  11.136
   50    HD2  ARG   8           HD2      ARG   8 109.711  13.011  11.142
   51    HD3  ARG   8           HD1      ARG   8 110.467  12.635   9.605
   52    HE   ARG   8           HE       ARG   8 108.209  11.478   9.116
   53   HH11  ARG   8          HH21      ARG   8 108.640  14.273  11.132
   54   HH12  ARG   8          HH22      ARG   8 107.071  14.920  10.790
   55   HH21  ARG   8          HH11      ARG   8 106.166  12.342   8.665
   56   HH22  ARG   8          HH12      ARG   8 105.674  13.831   9.400
   57    H    ARG   9           HN       ARG   9 110.547   9.054   6.432
   58    HA   ARG   9           HA       ARG   9 110.630   6.168   7.010
   59    HB2  ARG   9           HB2      ARG   9 109.789   7.509   4.434
   60    HB3  ARG   9           HB1      ARG   9 109.494   5.842   4.921
   61    HG2  ARG   9           HG2      ARG   9 107.945   6.471   6.595
   62    HG3  ARG   9           HG1      ARG   9 108.490   8.139   6.584
   63    HD2  ARG   9           HD2      ARG   9 107.632   7.611   3.946
   64    HD3  ARG   9           HD1      ARG   9 106.412   6.907   4.997
   65    HE   ARG   9           HE       ARG   9 106.698   9.337   6.107
   66   HH11  ARG   9          HH21      ARG   9 106.470   8.331   2.805
   67   HH12  ARG   9          HH22      ARG   9 105.666   9.771   2.281
   68   HH21  ARG   9          HH11      ARG   9 105.646  11.223   5.426
   69   HH22  ARG   9          HH12      ARG   9 105.204  11.410   3.762
   70    H    ARG  10           HN       ARG  10 113.038   7.778   6.900
   71    HA   ARG  10           HA       ARG  10 115.181   7.645   6.080
   72    HB2  ARG  10           HB2      ARG  10 114.401   5.112   4.650
   73    HB3  ARG  10           HB1      ARG  10 115.947   5.540   5.375
   74    HG2  ARG  10           HG2      ARG  10 115.319   4.520   7.284
   75    HG3  ARG  10           HG1      ARG  10 114.002   5.675   7.458
   76    HD2  ARG  10           HD2      ARG  10 112.648   4.210   5.888
   77    HD3  ARG  10           HD1      ARG  10 113.932   3.012   6.021
   78    HE   ARG  10           HE       ARG  10 111.902   3.512   7.958
   79   HH11  ARG  10          HH21      ARG  10 115.264   2.775   7.555
   80   HH12  ARG  10          HH22      ARG  10 115.422   2.000   9.097
   81   HH21  ARG  10          HH11      ARG  10 112.112   2.504   9.985
   82   HH22  ARG  10          HH12      ARG  10 113.637   1.843  10.470
   83    H    PHE  11           HN       PHE  11 113.128   6.304   3.470
   84    HA   PHE  11           HA       PHE  11 114.006   8.494   1.715
   85    HB2  PHE  11           HB2      PHE  11 114.950   5.792   1.530
   86    HB3  PHE  11           HB1      PHE  11 113.919   6.111   0.137
   87    HD1  PHE  11           HD1      PHE  11 116.684   7.680   2.131
   88    HD2  PHE  11           HD2      PHE  11 114.815   7.242  -1.713
   89    HE1  PHE  11           HE1      PHE  11 118.505   9.008   1.092
   90    HE2  PHE  11           HE2      PHE  11 116.636   8.568  -2.750
   91    HZ   PHE  11           HZ       PHE  11 118.479   9.450  -1.347
   92    H    HIS  12           HN       HIS  12 112.706   8.430  -0.384
   93    HA   HIS  12           HA       HIS  12 109.958   8.544   0.228
   94    HB2  HIS  12           HB2      HIS  12 111.462   8.503  -2.390
   95    HB3  HIS  12           HB1      HIS  12 109.707   8.660  -2.311
   96    HD2  HIS  12           HD2      HIS  12 112.907  10.764  -1.371
   97    HE1  HIS  12           HE1      HIS  12 109.514  13.242  -0.951
   98    HE2  HIS  12           HE2      HIS  12 112.053  13.190  -0.919
   99    H    ARG  13           HN       ARG  13 108.242   7.200  -0.252
  100    HA   ARG  13           HA       ARG  13 108.925   4.367  -0.607
  101    HB2  ARG  13           HB2      ARG  13 106.088   4.915  -0.283
  102    HB3  ARG  13           HB1      ARG  13 107.159   3.967   0.747
  103    HG2  ARG  13           HG2      ARG  13 107.978   6.080   1.784
  104    HG3  ARG  13           HG1      ARG  13 106.832   6.984   0.795
  105    HD2  ARG  13           HD2      ARG  13 105.224   5.047   1.933
  106    HD3  ARG  13           HD1      ARG  13 106.357   5.406   3.231
  107    HE   ARG  13           HE       ARG  13 105.228   7.400   3.504
  108   HH11  ARG  13          HH21      ARG  13 104.921   6.290   0.239
  109   HH12  ARG  13          HH22      ARG  13 103.871   7.579  -0.246
  110   HH21  ARG  13          HH11      ARG  13 103.854   9.096   2.873
  111   HH22  ARG  13          HH12      ARG  13 103.268   9.169   1.245
  112    H    ILE  14           HN       ILE  14 107.976   3.068  -2.220
  113    HA   ILE  14           HA       ILE  14 107.675   4.241  -4.765
  114    HB   ILE  14           HB       ILE  14 106.909   1.548  -3.659
  115   HG12  ILE  14          HG12      ILE  14 108.780   0.814  -5.112
  116   HG13  ILE  14          HG11      ILE  14 109.033   2.485  -5.614
  117   HG21  ILE  14          HG21      ILE  14 106.775   1.055  -6.266
  118   HG22  ILE  14          HG22      ILE  14 106.335   2.762  -6.342
  119   HG23  ILE  14          HG23      ILE  14 105.360   1.640  -5.391
  120   HD11  ILE  14          HD11      ILE  14 109.049   1.761  -2.690
  121   HD12  ILE  14          HD12      ILE  14 109.797   3.142  -3.495
  122   HD13  ILE  14          HD13      ILE  14 110.494   1.535  -3.674
  123    H    ALA  15           HN       ALA  15 106.190   5.920  -4.593
  124    HA   ALA  15           HA       ALA  15 103.446   5.259  -3.808
  125    HB1  ALA  15           HB1      ALA  15 104.840   7.859  -4.423
  126    HB2  ALA  15           HB2      ALA  15 104.205   7.305  -2.874
  127    HB3  ALA  15           HB3      ALA  15 103.097   7.745  -4.175
  128    H    PHE  16           HN       PHE  16 102.033   4.645  -5.196
  129    HA   PHE  16           HA       PHE  16 101.810   5.905  -7.794
  130    HB2  PHE  16           HB2      PHE  16 101.889   3.921  -9.100
  131    HB3  PHE  16           HB1      PHE  16 103.329   3.883  -8.090
  132    HD1  PHE  16           HD2      PHE  16 102.661   2.840  -5.573
  133    HD2  PHE  16           HD1      PHE  16 100.896   1.847  -9.362
  134    HE1  PHE  16           HE2      PHE  16 101.981   0.632  -4.680
  135    HE2  PHE  16           HE1      PHE  16 100.226  -0.364  -8.469
  136    HZ   PHE  16           HZ       PHE  16 100.773  -0.976  -6.131
  137    H    ASP  17           HN       ASP  17  99.657   5.444  -8.755
  138    HA   ASP  17           HA       ASP  17  97.730   4.996  -6.596
  139    HB2  ASP  17           HB2      ASP  17  97.498   6.173  -9.367
  140    HB3  ASP  17           HB1      ASP  17  96.096   5.848  -8.348
  141    H    ALA  18           HN       ALA  18  96.078   3.476  -6.713
  142    HA   ALA  18           HA       ALA  18  95.469   1.860  -8.897
  143    HB1  ALA  18           HB1      ALA  18  96.542  -0.290  -7.685
  144    HB2  ALA  18           HB2      ALA  18  97.742   0.913  -7.213
  145    HB3  ALA  18           HB3      ALA  18  97.414   0.621  -8.920
  146    H    ASP  19           HN       ASP  19  94.399  -0.288  -8.036
  147    HA   ASP  19           HA       ASP  19  92.616   0.590  -5.853
  148    HB2  ASP  19           HB2      ASP  19  91.573  -0.114  -7.965
  149    HB3  ASP  19           HB1      ASP  19  92.331  -1.698  -7.817
  150    H    SER  20           HN       SER  20  92.507  -0.393  -3.918
  151    HA   SER  20           HA       SER  20  93.867  -2.987  -3.581
  152    HB2  SER  20           HB2      SER  20  94.661  -2.126  -1.330
  153    HB3  SER  20           HB1      SER  20  95.470  -1.425  -2.730
  154    HG   SER  20           HG       SER  20  94.557   0.000  -0.951
  155    H    GLU  21           HN       GLU  21  93.083  -4.234  -1.832
  156    HA   GLU  21           HA       GLU  21  90.513  -3.343  -0.654
  157    HB2  GLU  21           HB2      GLU  21  91.037  -6.029  -1.968
  158    HB3  GLU  21           HB1      GLU  21  89.603  -5.627  -1.025
  159    HG2  GLU  21           HG2      GLU  21  89.618  -3.543  -2.772
  160    HG3  GLU  21           HG1      GLU  21  90.360  -4.790  -3.773
  161    H    ILE  22           HN       ILE  22  90.192  -3.977   1.420
  162    HA   ILE  22           HA       ILE  22  92.343  -5.629   2.613
  163    HB   ILE  22           HB       ILE  22  90.826  -3.289   3.786
  164   HG12  ILE  22          HG12      ILE  22  92.894  -3.082   2.086
  165   HG13  ILE  22          HG11      ILE  22  92.707  -1.991   3.456
  166   HG21  ILE  22          HG21      ILE  22  92.759  -5.280   4.970
  167   HG22  ILE  22          HG22      ILE  22  91.179  -4.785   5.577
  168   HG23  ILE  22          HG23      ILE  22  92.548  -3.678   5.677
  169   HD11  ILE  22          HD11      ILE  22  94.259  -4.571   3.672
  170   HD12  ILE  22          HD12      ILE  22  94.289  -3.185   4.763
  171   HD13  ILE  22          HD13      ILE  22  95.016  -3.062   3.159
  172    H    LEU  23           HN       LEU  23  91.834  -7.263   3.813
  173    HA   LEU  23           HA       LEU  23  88.979  -7.754   4.477
  174    HB2  LEU  23           HB2      LEU  23  90.840 -10.008   3.851
  175    HB3  LEU  23           HB1      LEU  23  89.091  -9.900   3.664
  176    HG   LEU  23           HG       LEU  23  89.797  -7.984   1.924
  177   HD11  LEU  23          HD11      LEU  23  92.017  -9.981   1.528
  178   HD12  LEU  23          HD12      LEU  23  92.257  -8.551   2.528
  179   HD13  LEU  23          HD13      LEU  23  91.841  -8.374   0.824
  180   HD21  LEU  23          HD21      LEU  23  88.408  -9.956   1.412
  181   HD22  LEU  23          HD22      LEU  23  89.854 -10.961   1.339
  182   HD23  LEU  23          HD23      LEU  23  89.601  -9.692   0.141
  183    H    GLN  24           HN       GLN  24  88.678  -7.973   6.534
  184    HA   GLN  24           HA       GLN  24  90.839  -9.142   8.213
  185    HB2  GLN  24           HB2      GLN  24  90.682  -6.693   8.585
  186    HB3  GLN  24           HB1      GLN  24  88.984  -6.877   9.014
  187    HG2  GLN  24           HG2      GLN  24  90.810  -8.685  10.485
  188    HG3  GLN  24           HG1      GLN  24  91.064  -6.975  10.816
  189   HE21  GLN  24          HE21      GLN  24  90.010  -6.628  12.805
  190   HE22  GLN  24          HE22      GLN  24  88.403  -7.082  13.121
  191    H    GLY  25           HN       GLY  25  89.971 -11.178   8.503
  192    HA2  GLY  25           HA2      GLY  25  88.636 -12.699   9.633
  193    HA3  GLY  25           HA1      GLY  25  87.584 -11.375  10.131
  194    H    GLU  26           HN       GLU  26  85.595 -11.628   9.351
  195    HA   GLU  26           HA       GLU  26  85.194 -12.944   6.740
  196    HB2  GLU  26           HB2      GLU  26  82.986 -13.429   7.484
  197    HB3  GLU  26           HB1      GLU  26  84.036 -13.755   8.863
  198    HG2  GLU  26           HG2      GLU  26  83.563 -11.327   9.577
  199    HG3  GLU  26           HG1      GLU  26  82.245 -11.369   8.406
  200    H    ARG  27           HN       ARG  27  85.820  -9.968   7.635
  201    HA   ARG  27           HA       ARG  27  83.622  -8.677   6.127
  202    HB2  ARG  27           HB2      ARG  27  85.493  -7.587   8.203
  203    HB3  ARG  27           HB1      ARG  27  84.290  -6.653   7.311
  204    HG2  ARG  27           HG2      ARG  27  82.493  -7.685   8.351
  205    HG3  ARG  27           HG1      ARG  27  83.401  -9.161   8.687
  206    HD2  ARG  27           HD2      ARG  27  84.720  -7.975  10.377
  207    HD3  ARG  27           HD1      ARG  27  83.838  -6.491  10.033
  208    HE   ARG  27           HE       ARG  27  82.174  -8.747  10.800
  209   HH11  ARG  27          HH21      ARG  27  83.999  -5.982  11.803
  210   HH12  ARG  27          HH22      ARG  27  83.125  -5.772  13.283
  211   HH21  ARG  27          HH11      ARG  27  81.026  -8.478  12.736
  212   HH22  ARG  27          HH12      ARG  27  81.441  -7.185  13.812
  213    H    ARG  28           HN       ARG  28  84.074  -7.513   4.326
  214    HA   ARG  28           HA       ARG  28  86.903  -6.893   3.673
  215    HB2  ARG  28           HB2      ARG  28  86.100  -8.841   2.343
  216    HB3  ARG  28           HB1      ARG  28  84.777  -7.849   1.731
  217    HG2  ARG  28           HG2      ARG  28  86.495  -6.228   0.844
  218    HG3  ARG  28           HG1      ARG  28  87.743  -7.377   1.313
  219    HD2  ARG  28           HD2      ARG  28  86.271  -9.069  -0.086
  220    HD3  ARG  28           HD1      ARG  28  85.675  -7.595  -0.844
  221    HE   ARG  28           HE       ARG  28  88.390  -7.309  -0.949
  222   HH11  ARG  28          HH21      ARG  28  86.141  -9.787  -1.826
  223   HH12  ARG  28          HH22      ARG  28  87.090 -10.376  -3.150
  224   HH21  ARG  28          HH11      ARG  28  89.643  -8.071  -2.685
  225   HH22  ARG  28          HH12      ARG  28  89.076  -9.401  -3.638
  226    H    TRP  29           HN       TRP  29  87.259  -5.029   2.505
  227    HA   TRP  29           HA       TRP  29  85.012  -3.241   1.936
  228    HB2  TRP  29           HB2      TRP  29  87.315  -2.544   3.745
  229    HB3  TRP  29           HB1      TRP  29  86.005  -1.465   3.266
  230    HD1  TRP  29           HD1      TRP  29  83.460  -2.545   3.944
  231    HE1  TRP  29           HE1      TRP  29  82.796  -3.535   6.245
  232    HE3  TRP  29           HE3      TRP  29  88.071  -3.722   5.718
  233    HZ2  TRP  29           HZ2      TRP  29  84.100  -4.684   8.541
  234    HZ3  TRP  29           HZ3      TRP  29  88.358  -4.758   7.947
  235    HH2  TRP  29           HH2      TRP  29  86.377  -5.250   9.359
  236    H    GLU  30           HN       GLU  30  85.485  -2.291  -0.077
  237    HA   GLU  30           HA       GLU  30  88.063  -2.617  -1.199
  238    HB2  GLU  30           HB2      GLU  30  87.050  -1.018  -2.974
  239    HB3  GLU  30           HB1      GLU  30  86.317  -2.607  -2.755
  240    HG2  GLU  30           HG2      GLU  30  84.498  -1.729  -1.523
  241    HG3  GLU  30           HG1      GLU  30  85.328  -0.202  -1.223
  242    H    VAL  31           HN       VAL  31  89.672  -1.026  -1.510
  243    HA   VAL  31           HA       VAL  31  89.225   1.710  -0.531
  244    HB   VAL  31           HB       VAL  31  91.382   1.497   0.816
  245   HG11  VAL  31          HG11      VAL  31  90.193   0.621   2.775
  246   HG12  VAL  31          HG12      VAL  31  88.970  -0.097   1.728
  247   HG13  VAL  31          HG13      VAL  31  89.125   1.658   1.829
  248   HG21  VAL  31          HG21      VAL  31  92.003  -0.713  -0.222
  249   HG22  VAL  31          HG22      VAL  31  90.665  -1.444   0.664
  250   HG23  VAL  31          HG23      VAL  31  92.017  -0.727   1.541
  251    H    LEU  32           HN       LEU  32  90.931   3.158  -1.073
  252    HA   LEU  32           HA       LEU  32  92.339   2.342  -3.528
  253    HB2  LEU  32           HB2      LEU  32  92.613   4.756  -3.940
  254    HB3  LEU  32           HB1      LEU  32  90.916   4.342  -3.732
  255    HG   LEU  32           HG       LEU  32  92.671   5.430  -1.508
  256   HD11  LEU  32          HD11      LEU  32  92.460   7.112  -3.252
  257   HD12  LEU  32          HD12      LEU  32  91.427   7.556  -1.893
  258   HD13  LEU  32          HD13      LEU  32  90.720   6.843  -3.343
  259   HD21  LEU  32          HD21      LEU  32  89.879   4.463  -1.710
  260   HD22  LEU  32          HD22      LEU  32  90.055   6.028  -0.915
  261   HD23  LEU  32          HD23      LEU  32  90.917   4.624  -0.293
  262    H    LEU  33           HN       LEU  33  94.504   2.136  -3.536
  263    HA   LEU  33           HA       LEU  33  95.903   2.680  -1.016
  264    HB2  LEU  33           HB2      LEU  33  96.322   0.480  -1.806
  265    HB3  LEU  33           HB1      LEU  33  96.574   1.029  -3.460
  266    HG   LEU  33           HG       LEU  33  98.419   2.290  -1.527
  267   HD11  LEU  33          HD11      LEU  33  98.155   0.020  -0.509
  268   HD12  LEU  33          HD12      LEU  33  99.777   0.318  -1.128
  269   HD13  LEU  33          HD13      LEU  33  98.655  -0.685  -2.047
  270   HD21  LEU  33          HD21      LEU  33  98.630   2.427  -3.995
  271   HD22  LEU  33          HD22      LEU  33  98.823   0.676  -4.068
  272   HD23  LEU  33          HD23      LEU  33 100.047   1.665  -3.270
  273    H    HIS  34           HN       HIS  34  97.112   4.378  -0.771
  274    HA   HIS  34           HA       HIS  34  97.625   6.107  -3.062
  275    HB2  HIS  34           HB2      HIS  34  97.834   6.417  -0.065
  276    HB3  HIS  34           HB1      HIS  34  98.435   7.661  -1.170
  277    HD2  HIS  34           HD2      HIS  34  94.980   6.043  -0.128
  278    HE1  HIS  34           HE1      HIS  34  94.193   9.545  -2.348
  279    HE2  HIS  34           HE2      HIS  34  93.141   7.696  -0.965
  280    H    ASP  35           HN       ASP  35  99.458   3.950  -1.014
  281    HA   ASP  35           HA       ASP  35 101.588   4.014  -2.835
  282    HB2  ASP  35           HB2      ASP  35 103.352   5.161  -1.571
  283    HB3  ASP  35           HB1      ASP  35 101.988   6.256  -1.809
  284    H    VAL  36           HN       VAL  36 103.500   2.762  -2.123
  285    HA   VAL  36           HA       VAL  36 103.051   1.037   0.204
  286    HB   VAL  36           HB       VAL  36 101.920   0.058  -1.884
  287   HG11  VAL  36          HG11      VAL  36 104.768  -0.631  -2.631
  288   HG12  VAL  36          HG12      VAL  36 103.907   0.730  -3.352
  289   HG13  VAL  36          HG13      VAL  36 103.301  -0.912  -3.567
  290   HG21  VAL  36          HG21      VAL  36 102.683  -1.213   0.203
  291   HG22  VAL  36          HG22      VAL  36 104.115  -1.669  -0.719
  292   HG23  VAL  36          HG23      VAL  36 102.518  -2.168  -1.266
  293    H    SER  37           HN       SER  37 104.900  -0.523   0.466
  294    HA   SER  37           HA       SER  37 107.435   0.355  -0.682
  295    HB2  SER  37           HB2      SER  37 108.487   0.374   1.567
  296    HB3  SER  37           HB1      SER  37 107.280   1.646   1.402
  297    HG   SER  37           HG       SER  37 106.937   0.574   3.335
  298    H    LEU  38           HN       LEU  38 109.156  -1.358  -0.016
  299    HA   LEU  38           HA       LEU  38 108.097  -3.880  -0.674
  300    HB2  LEU  38           HB2      LEU  38 110.386  -4.748   0.049
  301    HB3  LEU  38           HB1      LEU  38 110.392  -3.512  -1.208
  302    HG   LEU  38           HG       LEU  38 110.436  -2.316   1.460
  303   HD11  LEU  38          HD11      LEU  38 111.633  -4.306   2.145
  304   HD12  LEU  38          HD12      LEU  38 112.805  -3.003   1.947
  305   HD13  LEU  38          HD13      LEU  38 112.648  -4.245   0.705
  306   HD21  LEU  38          HD21      LEU  38 112.452  -2.236  -0.805
  307   HD22  LEU  38          HD22      LEU  38 112.275  -1.055   0.492
  308   HD23  LEU  38          HD23      LEU  38 111.012  -1.221  -0.728
  309    H    HIS  39           HN       HIS  39 107.685  -2.261   2.151
  310    HA   HIS  39           HA       HIS  39 106.773  -4.622   3.511
  311    HB2  HIS  39           HB2      HIS  39 108.255  -4.221   5.530
  312    HB3  HIS  39           HB1      HIS  39 109.060  -4.913   4.121
  313    HD2  HIS  39           HD2      HIS  39 108.428  -1.145   3.700
  314    HE1  HIS  39           HE1      HIS  39 112.433  -1.545   4.972
  315    HE2  HIS  39           HE2      HIS  39 110.711   0.073   4.042
  316    H    GLY  40           HN       GLY  40 105.395  -2.348   2.728
  317    HA2  GLY  40           HA2      GLY  40 104.085  -1.578   5.106
  318    HA3  GLY  40           HA1      GLY  40 105.185  -0.290   4.632
  319    H    ILE  41           HN       ILE  41 102.222  -0.274   4.686
  320    HA   ILE  41           HA       ILE  41 101.801   0.665   1.934
  321    HB   ILE  41           HB       ILE  41 100.738  -1.246   1.394
  322   HG12  ILE  41          HG12      ILE  41  98.672  -0.263   3.395
  323   HG13  ILE  41          HG11      ILE  41  98.853   0.351   1.752
  324   HG21  ILE  41          HG21      ILE  41 101.674  -2.452   3.295
  325   HG22  ILE  41          HG22      ILE  41  99.986  -2.911   3.076
  326   HG23  ILE  41          HG23      ILE  41 100.435  -1.788   4.359
  327   HD11  ILE  41          HD11      ILE  41  97.273  -1.243   1.309
  328   HD12  ILE  41          HD12      ILE  41  97.722  -2.226   2.703
  329   HD13  ILE  41          HD13      ILE  41  98.684  -2.298   1.224
  330    H    LEU  42           HN       LEU  42 100.244   2.173   1.662
  331    HA   LEU  42           HA       LEU  42  98.985   3.291   4.106
  332    HB2  LEU  42           HB2      LEU  42 100.937   4.524   2.622
  333    HB3  LEU  42           HB1      LEU  42  99.482   5.120   1.831
  334    HG   LEU  42           HG       LEU  42  99.922   5.235   4.823
  335   HD11  LEU  42          HD11      LEU  42 101.267   6.747   2.889
  336   HD12  LEU  42          HD12      LEU  42 101.075   7.169   4.587
  337   HD13  LEU  42          HD13      LEU  42  99.934   7.785   3.395
  338   HD21  LEU  42          HD21      LEU  42  98.039   6.795   4.758
  339   HD22  LEU  42          HD22      LEU  42  97.570   5.253   4.045
  340   HD23  LEU  42          HD23      LEU  42  97.940   6.628   3.006
  341    H    VAL  43           HN       VAL  43  96.795   3.359   3.975
  342    HA   VAL  43           HA       VAL  43  95.569   3.410   1.281
  343    HB   VAL  43           HB       VAL  43  93.810   1.871   2.136
  344   HG11  VAL  43          HG11      VAL  43  95.521   0.904   0.771
  345   HG12  VAL  43          HG12      VAL  43  95.335  -0.170   2.158
  346   HG13  VAL  43          HG13      VAL  43  96.690   0.955   2.089
  347   HG21  VAL  43          HG21      VAL  43  93.933   2.116   4.494
  348   HG22  VAL  43          HG22      VAL  43  95.675   1.840   4.516
  349   HG23  VAL  43          HG23      VAL  43  94.575   0.502   4.186
  350    H    GLY  44           HN       GLY  44  93.126   3.754   1.518
  351    HA2  GLY  44           HA2      GLY  44  92.723   6.155   3.211
  352    HA3  GLY  44           HA1      GLY  44  91.770   5.730   1.789
  353    H    GLN  45           HN       GLN  45  90.927   6.270   4.706
  354    HA   GLN  45           HA       GLN  45  90.042   3.697   5.642
  355    HB2  GLN  45           HB2      GLN  45  90.788   5.464   7.173
  356    HB3  GLN  45           HB1      GLN  45  89.459   6.488   6.639
  357    HG2  GLN  45           HG2      GLN  45  88.030   4.306   7.308
  358    HG3  GLN  45           HG1      GLN  45  89.397   4.068   8.388
  359   HE21  GLN  45          HE21      GLN  45  86.395   5.257   8.527
  360   HE22  GLN  45          HE22      GLN  45  86.613   6.560   9.593
  361    HA   PRO  46           HA       PRO  46  86.136   4.570   3.488
  362    HB2  PRO  46           HB2      PRO  46  85.172   2.039   3.282
  363    HB3  PRO  46           HB1      PRO  46  86.536   2.586   2.282
  364    HG2  PRO  46           HG2      PRO  46  86.558   0.935   4.767
  365    HG3  PRO  46           HG1      PRO  46  87.537   0.774   3.300
  366    HD2  PRO  46           HD2      PRO  46  88.400   2.022   5.657
  367    HD3  PRO  46           HD1      PRO  46  89.122   2.268   4.055
  368    H    GLN  47           HN       GLN  47  83.815   4.356   4.062
  369    HA   GLN  47           HA       GLN  47  83.350   4.796   6.815
  370    HB2  GLN  47           HB2      GLN  47  82.015   5.642   4.801
  371    HB3  GLN  47           HB1      GLN  47  81.208   4.074   4.832
  372    HG2  GLN  47           HG2      GLN  47  80.777   4.528   7.323
  373    HG3  GLN  47           HG1      GLN  47  81.244   6.194   6.983
  374   HE21  GLN  47          HE21      GLN  47  79.990   5.489   4.120
  375   HE22  GLN  47          HE22      GLN  47  78.343   5.813   4.383
  376    H    ASP  48           HN       ASP  48  82.756   1.970   4.759
  377    HA   ASP  48           HA       ASP  48  81.364   0.485   6.766
  378    HB2  ASP  48           HB2      ASP  48  81.110   0.106   4.327
  379    HB3  ASP  48           HB1      ASP  48  82.756  -0.516   4.282
  380    H    TRP  49           HN       TRP  49  84.396   1.482   6.944
  381    HA   TRP  49           HA       TRP  49  86.003  -0.787   7.363
  382    HB2  TRP  49           HB2      TRP  49  86.802   1.573   7.186
  383    HB3  TRP  49           HB1      TRP  49  86.195   1.852   8.815
  384    HD1  TRP  49           HD1      TRP  49  87.501   0.833  10.795
  385    HE1  TRP  49           HE1      TRP  49  89.894  -0.209  11.007
  386    HE3  TRP  49           HE3      TRP  49  88.410  -0.049   5.911
  387    HZ2  TRP  49           HZ2      TRP  49  91.943  -1.304   9.166
  388    HZ3  TRP  49           HZ3      TRP  49  90.517  -1.087   5.148
  389    HH2  TRP  49           HH2      TRP  49  92.255  -1.721   6.784
  390    H    ASN  50           HN       ASN  50  84.140  -2.047   8.488
  391    HA   ASN  50           HA       ASN  50  84.029  -1.443  11.360
  392    HB2  ASN  50           HB2      ASN  50  81.876  -1.985  10.477
  393    HB3  ASN  50           HB1      ASN  50  82.505  -3.386   9.614
  394   HD21  ASN  50          HD21      ASN  50  83.931  -3.109  12.715
  395   HD22  ASN  50          HD22      ASN  50  82.950  -4.239  13.517
  396    H    GLY  51           HN       GLY  51  86.322  -1.937  11.634
  397    HA2  GLY  51           HA2      GLY  51  86.734  -4.839  12.000
  398    HA3  GLY  51           HA1      GLY  51  87.944  -3.891  11.143
  399    H    ASP  52           HN       ASP  52  88.501  -5.352  13.441
  400    HA   ASP  52           HA       ASP  52  88.693  -3.420  15.630
  401    HB2  ASP  52           HB2      ASP  52  88.322  -6.205  15.512
  402    HB3  ASP  52           HB1      ASP  52  89.953  -5.987  16.141
  403    HA   PRO  53           HA       PRO  53  92.795  -2.499  14.062
  404    HB2  PRO  53           HB2      PRO  53  93.614  -0.894  16.159
  405    HB3  PRO  53           HB1      PRO  53  92.605  -0.335  14.811
  406    HG2  PRO  53           HG2      PRO  53  91.802  -1.165  17.556
  407    HG3  PRO  53           HG1      PRO  53  91.188   0.160  16.551
  408    HD2  PRO  53           HD2      PRO  53  89.835  -2.174  16.844
  409    HD3  PRO  53           HD1      PRO  53  89.777  -1.231  15.336
  410    H    GLN  54           HN       GLN  54  92.064  -3.944  17.117
  411    HA   GLN  54           HA       GLN  54  94.787  -4.500  17.821
  412    HB2  GLN  54           HB2      GLN  54  92.263  -5.812  18.852
  413    HB3  GLN  54           HB1      GLN  54  93.855  -5.859  19.609
  414    HG2  GLN  54           HG2      GLN  54  92.338  -3.296  19.061
  415    HG3  GLN  54           HG1      GLN  54  92.282  -4.152  20.602
  416   HE21  GLN  54          HE21      GLN  54  94.204  -2.018  18.615
  417   HE22  GLN  54          HE22      GLN  54  95.506  -1.868  19.694
  418    H    ARG  55           HN       ARG  55  92.397  -6.027  15.821
  419    HA   ARG  55           HA       ARG  55  93.929  -8.527  15.764
  420    HB2  ARG  55           HB2      ARG  55  91.235  -7.757  14.631
  421    HB3  ARG  55           HB1      ARG  55  92.017  -9.301  14.287
  422    HG2  ARG  55           HG2      ARG  55  92.088  -9.834  16.675
  423    HG3  ARG  55           HG1      ARG  55  91.385  -8.264  17.066
  424    HD2  ARG  55           HD2      ARG  55  89.416  -8.942  15.576
  425    HD3  ARG  55           HD1      ARG  55  90.085 -10.572  15.608
  426    HE   ARG  55           HE       ARG  55  89.728  -9.389  18.230
  427   HH11  ARG  55          HH21      ARG  55  88.321 -11.204  15.638
  428   HH12  ARG  55          HH22      ARG  55  87.139 -11.978  16.639
  429   HH21  ARG  55          HH11      ARG  55  88.181 -10.402  19.547
  430   HH22  ARG  55          HH12      ARG  55  87.061 -11.525  18.851
  431    HA   PRO  56           HA       PRO  56  96.146  -7.505  12.112
  432    HB2  PRO  56           HB2      PRO  56  95.646 -10.261  11.124
  433    HB3  PRO  56           HB1      PRO  56  97.184  -9.441  11.449
  434    HG2  PRO  56           HG2      PRO  56  96.230 -11.358  13.054
  435    HG3  PRO  56           HG1      PRO  56  97.158  -9.981  13.673
  436    HD2  PRO  56           HD2      PRO  56  94.208 -10.480  13.814
  437    HD3  PRO  56           HD1      PRO  56  95.284  -9.686  14.986
  438    H    PHE  57           HN       PHE  57  96.014  -7.317   9.810
  439    HA   PHE  57           HA       PHE  57  93.294  -7.585   8.666
  440    HB2  PHE  57           HB2      PHE  57  95.205  -5.243   8.376
  441    HB3  PHE  57           HB1      PHE  57  93.702  -5.440   7.479
  442    HD1  PHE  57           HD2      PHE  57  95.030  -5.297  10.982
  443    HD2  PHE  57           HD1      PHE  57  91.696  -4.613   8.368
  444    HE1  PHE  57           HE2      PHE  57  93.776  -4.245  12.848
  445    HE2  PHE  57           HE1      PHE  57  90.445  -3.566  10.227
  446    HZ   PHE  57           HZ       PHE  57  91.481  -3.381  12.466
  447    H    GLU  58           HN       GLU  58  93.347  -7.875   6.298
  448    HA   GLU  58           HA       GLU  58  96.025  -8.611   5.301
  449    HB2  GLU  58           HB2      GLU  58  93.441  -9.954   4.457
  450    HB3  GLU  58           HB1      GLU  58  95.083 -10.445   4.040
  451    HG2  GLU  58           HG2      GLU  58  95.560 -10.913   6.405
  452    HG3  GLU  58           HG1      GLU  58  93.935 -10.391   6.845
  453    H    ALA  59           HN       ALA  59  96.580  -7.797   3.264
  454    HA   ALA  59           HA       ALA  59  94.534  -6.097   1.937
  455    HB1  ALA  59           HB1      ALA  59  96.263  -4.569   1.426
  456    HB2  ALA  59           HB2      ALA  59  97.513  -5.686   1.972
  457    HB3  ALA  59           HB3      ALA  59  96.419  -4.951   3.136
  458    H    ARG  60           HN       ARG  60  94.293  -6.250  -0.205
  459    HA   ARG  60           HA       ARG  60  96.159  -7.997  -1.704
  460    HB2  ARG  60           HB2      ARG  60  93.146  -7.790  -1.877
  461    HB3  ARG  60           HB1      ARG  60  94.120  -8.453  -3.186
  462    HG2  ARG  60           HG2      ARG  60  95.142  -9.881  -1.123
  463    HG3  ARG  60           HG1      ARG  60  93.522  -9.599  -0.494
  464    HD2  ARG  60           HD2      ARG  60  92.998 -10.329  -3.104
  465    HD3  ARG  60           HD1      ARG  60  94.395 -11.328  -2.717
  466    HE   ARG  60           HE       ARG  60  91.790 -11.821  -1.852
  467   HH11  ARG  60          HH21      ARG  60  94.963 -11.464  -0.509
  468   HH12  ARG  60          HH22      ARG  60  94.673 -12.545   0.810
  469   HH21  ARG  60          HH11      ARG  60  91.409 -13.244  -0.133
  470   HH22  ARG  60          HH12      ARG  60  92.662 -13.557   1.023
  471    H    LEU  61           HN       LEU  61  97.131  -6.928  -3.365
  472    HA   LEU  61           HA       LEU  61  95.976  -4.327  -4.165
  473    HB2  LEU  61           HB2      LEU  61  98.778  -5.428  -4.160
  474    HB3  LEU  61           HB1      LEU  61  98.350  -4.055  -5.174
  475    HG   LEU  61           HG       LEU  61  97.436  -2.925  -3.099
  476   HD11  LEU  61          HD11      LEU  61  98.567  -3.912  -0.960
  477   HD12  LEU  61          HD12      LEU  61  98.621  -5.415  -1.879
  478   HD13  LEU  61          HD13      LEU  61  97.072  -4.643  -1.540
  479   HD21  LEU  61          HD21      LEU  61 100.339  -3.649  -3.462
  480   HD22  LEU  61          HD22      LEU  61  99.848  -2.610  -2.126
  481   HD23  LEU  61          HD23      LEU  61  99.530  -2.117  -3.789
  482    H    TYR  62           HN       TYR  62  95.848  -3.774  -6.369
  483    HA   TYR  62           HA       TYR  62  96.138  -6.011  -8.273
  484    HB2  TYR  62           HB2      TYR  62  93.766  -4.133  -8.236
  485    HB3  TYR  62           HB1      TYR  62  93.990  -5.558  -9.250
  486    HD1  TYR  62           HD1      TYR  62  93.401  -4.377  -5.785
  487    HD2  TYR  62           HD2      TYR  62  93.606  -7.779  -8.402
  488    HE1  TYR  62           HE1      TYR  62  92.389  -5.802  -4.017
  489    HE2  TYR  62           HE2      TYR  62  92.594  -9.197  -6.638
  490    HH   TYR  62           HH       TYR  62  92.253  -8.128  -3.392
  491    H    LEU  63           HN       LEU  63  97.665  -5.354  -9.619
  492    HA   LEU  63           HA       LEU  63  97.725  -2.533 -10.497
  493    HB2  LEU  63           HB2      LEU  63  99.781  -3.792  -9.466
  494    HB3  LEU  63           HB1      LEU  63  99.911  -4.523 -11.062
  495    HG   LEU  63           HG       LEU  63  99.885  -1.548 -10.470
  496   HD11  LEU  63          HD11      LEU  63 102.205  -1.564 -10.971
  497   HD12  LEU  63          HD12      LEU  63 102.130  -3.189 -11.653
  498   HD13  LEU  63          HD13      LEU  63 101.971  -2.955  -9.912
  499   HD21  LEU  63          HD21      LEU  63 100.611  -1.545 -12.972
  500   HD22  LEU  63          HD22      LEU  63  98.902  -1.763 -12.603
  501   HD23  LEU  63          HD23      LEU  63  99.898  -3.157 -13.023
  502    H    GLY  64           HN       GLY  64  98.969  -5.416 -12.133
  503    HA2  GLY  64           HA2      GLY  64  97.751  -4.591 -14.629
  504    HA3  GLY  64           HA1      GLY  64  98.763  -6.016 -14.375
  505    H    LEU  65           HN       LEU  65  96.699  -6.631 -15.897
  506    HA   LEU  65           HA       LEU  65  94.315  -7.175 -14.421
  507    HB2  LEU  65           HB2      LEU  65  95.290  -8.107 -17.129
  508    HB3  LEU  65           HB1      LEU  65  93.730  -8.584 -16.464
  509    HG   LEU  65           HG       LEU  65  94.180  -5.690 -16.264
  510   HD11  LEU  65          HD11      LEU  65  95.446  -6.188 -18.376
  511   HD12  LEU  65          HD12      LEU  65  94.025  -5.174 -18.630
  512   HD13  LEU  65          HD13      LEU  65  93.969  -6.888 -19.042
  513   HD21  LEU  65          HD21      LEU  65  92.045  -7.310 -17.689
  514   HD22  LEU  65          HD22      LEU  65  91.923  -5.628 -17.173
  515   HD23  LEU  65          HD23      LEU  65  92.008  -6.916 -15.970
  516    H    ASP  66           HN       ASP  66  97.220  -9.006 -15.254
  517    HA   ASP  66           HA       ASP  66  96.208 -11.476 -14.006
  518    HB2  ASP  66           HB2      ASP  66  97.320 -11.491 -16.239
  519    HB3  ASP  66           HB1      ASP  66  98.788 -10.911 -15.455
  520    H    VAL  67           HN       VAL  67  97.448  -8.707 -12.848
  521    HA   VAL  67           HA       VAL  67  99.470 -10.005 -11.129
  522    HB   VAL  67           HB       VAL  67  99.064  -7.169 -12.030
  523   HG11  VAL  67          HG11      VAL  67  99.395  -6.687  -9.767
  524   HG12  VAL  67          HG12      VAL  67 101.058  -6.776 -10.341
  525   HG13  VAL  67          HG13      VAL  67 100.346  -8.146  -9.492
  526   HG21  VAL  67          HG21      VAL  67 101.321  -7.382 -12.769
  527   HG22  VAL  67          HG22      VAL  67 100.553  -8.911 -13.196
  528   HG23  VAL  67          HG23      VAL  67 101.591  -8.813 -11.772
  529    H    LEU  68           HN       LEU  68  98.272 -10.917  -9.546
  530    HA   LEU  68           HA       LEU  68  96.678  -9.092  -7.848
  531    HB2  LEU  68           HB2      LEU  68  95.076 -10.660  -8.368
  532    HB3  LEU  68           HB1      LEU  68  96.262 -11.909  -8.720
  533    HG   LEU  68           HG       LEU  68  96.652 -12.237  -6.304
  534   HD11  LEU  68          HD11      LEU  68  95.778  -9.711  -5.910
  535   HD12  LEU  68          HD12      LEU  68  95.725 -10.934  -4.647
  536   HD13  LEU  68          HD13      LEU  68  94.278 -10.575  -5.586
  537   HD21  LEU  68          HD21      LEU  68  93.692 -12.267  -6.943
  538   HD22  LEU  68          HD22      LEU  68  94.547 -13.318  -5.811
  539   HD23  LEU  68          HD23      LEU  68  94.839 -13.465  -7.544
  540    H    ILE  69           HN       ILE  69  97.740  -8.558  -6.045
  541    HA   ILE  69           HA       ILE  69  99.791 -10.428  -5.011
  542    HB   ILE  69           HB       ILE  69  99.557  -7.425  -4.920
  543   HG12  ILE  69          HG12      ILE  69 102.116  -8.546  -5.699
  544   HG13  ILE  69          HG11      ILE  69 100.833  -9.257  -6.675
  545   HG21  ILE  69          HG21      ILE  69 101.898  -7.815  -3.709
  546   HG22  ILE  69          HG22      ILE  69 101.114  -9.312  -3.205
  547   HG23  ILE  69          HG23      ILE  69 100.392  -7.761  -2.791
  548   HD11  ILE  69          HD11      ILE  69  99.985  -6.933  -7.129
  549   HD12  ILE  69          HD12      ILE  69 101.590  -7.250  -7.787
  550   HD13  ILE  69          HD13      ILE  69 101.414  -6.308  -6.306
  551    H    ARG  70           HN       ARG  70  99.929 -10.878  -2.838
  552    HA   ARG  70           HA       ARG  70  97.729  -9.902  -1.131
  553    HB2  ARG  70           HB2      ARG  70  97.614 -12.180  -0.111
  554    HB3  ARG  70           HB1      ARG  70  97.154 -12.176  -1.815
  555    HG2  ARG  70           HG2      ARG  70  99.556 -12.781  -2.358
  556    HG3  ARG  70           HG1      ARG  70  99.806 -13.033  -0.631
  557    HD2  ARG  70           HD2      ARG  70  98.125 -14.767  -0.573
  558    HD3  ARG  70           HD1      ARG  70  97.647 -14.426  -2.234
  559    HE   ARG  70           HE       ARG  70 100.402 -15.081  -2.168
  560   HH11  ARG  70          HH21      ARG  70  97.252 -16.449  -1.750
  561   HH12  ARG  70          HH22      ARG  70  97.722 -18.036  -2.262
  562   HH21  ARG  70          HH11      ARG  70 101.026 -17.161  -2.841
  563   HH22  ARG  70          HH12      ARG  70  99.858 -18.438  -2.880
  564    H    MET  71           HN       MET  71  98.270  -9.201   0.794
  565    HA   MET  71           HA       MET  71 100.832  -9.971   2.011
  566    HB2  MET  71           HB2      MET  71 100.623  -7.205   2.477
  567    HB3  MET  71           HB1      MET  71 101.818  -8.024   1.481
  568    HG2  MET  71           HG2      MET  71 100.701  -7.545  -0.498
  569    HG3  MET  71           HG1      MET  71  99.129  -7.432   0.293
  570    HE1  MET  71           HE1      MET  71 102.215  -5.615   2.020
  571    HE2  MET  71           HE2      MET  71 102.510  -4.356   0.823
  572    HE3  MET  71           HE3      MET  71 102.669  -6.052   0.367
  573    H    GLU  72           HN       GLU  72 100.889  -9.670   4.259
  574    HA   GLU  72           HA       GLU  72  98.248  -9.231   5.492
  575    HB2  GLU  72           HB2      GLU  72  99.223 -11.453   5.942
  576    HB3  GLU  72           HB1      GLU  72 100.680 -10.686   6.577
  577    HG2  GLU  72           HG2      GLU  72  99.531  -9.787   8.445
  578    HG3  GLU  72           HG1      GLU  72  97.953 -10.086   7.721
  579    H    ILE  73           HN       ILE  73  98.031  -7.370   6.716
  580    HA   ILE  73           HA       ILE  73 100.531  -6.098   7.645
  581    HB   ILE  73           HB       ILE  73  99.645  -3.934   6.957
  582   HG12  ILE  73          HG12      ILE  73  97.371  -5.643   5.918
  583   HG13  ILE  73          HG11      ILE  73  97.272  -4.339   7.099
  584   HG21  ILE  73          HG21      ILE  73  99.353  -5.370   4.407
  585   HG22  ILE  73          HG22      ILE  73 100.749  -5.901   5.337
  586   HG23  ILE  73          HG23      ILE  73 100.578  -4.204   4.902
  587   HD11  ILE  73          HD11      ILE  73  96.498  -3.588   4.885
  588   HD12  ILE  73          HD12      ILE  73  98.058  -4.013   4.188
  589   HD13  ILE  73          HD13      ILE  73  97.942  -2.718   5.368
  590    H    SER  74           HN       SER  74 100.294  -4.546   9.325
  591    HA   SER  74           HA       SER  74  97.849  -4.862  10.980
  592    HB2  SER  74           HB2      SER  74 100.672  -5.295  11.638
  593    HB3  SER  74           HB1      SER  74  99.864  -4.200  12.756
  594    HG   SER  74           HG       SER  74  98.757  -5.819  13.494
  595    H    LEU  75           HN       LEU  75  97.294  -3.021  12.308
  596    HA   LEU  75           HA       LEU  75  97.518  -0.526  10.984
  597    HB2  LEU  75           HB2      LEU  75  95.826  -1.543  12.828
  598    HB3  LEU  75           HB1      LEU  75  96.851  -0.568  13.878
  599    HG   LEU  75           HG       LEU  75  95.036   0.838  13.159
  600   HD11  LEU  75          HD11      LEU  75  97.252   1.652  11.292
  601   HD12  LEU  75          HD12      LEU  75  97.494   1.682  13.039
  602   HD13  LEU  75          HD13      LEU  75  96.225   2.662  12.307
  603   HD21  LEU  75          HD21      LEU  75  95.119  -0.740  10.813
  604   HD22  LEU  75          HD22      LEU  75  95.494   0.902  10.293
  605   HD23  LEU  75          HD23      LEU  75  94.001   0.574  11.172
  606    H    ALA  76           HN       ALA  76  99.216   0.802  10.957
  607    HA   ALA  76           HA       ALA  76 101.163   0.633  13.143
  608    HB1  ALA  76           HB1      ALA  76 101.388   1.877  10.393
  609    HB2  ALA  76           HB2      ALA  76 102.173   0.401  10.953
  610    HB3  ALA  76           HB3      ALA  76 102.647   1.956  11.626
  611    H    TRP  77           HN       TRP  77  99.109   2.854  11.395
  612    HA   TRP  77           HA       TRP  77  98.635   4.503  13.681
  613    HB2  TRP  77           HB2      TRP  77  99.730   6.568  12.875
  614    HB3  TRP  77           HB1      TRP  77 100.934   5.296  13.119
  615    HD1  TRP  77           HD1      TRP  77 102.137   4.313  11.014
  616    HE1  TRP  77           HE1      TRP  77 102.010   4.796   8.487
  617    HE3  TRP  77           HE3      TRP  77  98.293   7.674  10.931
  618    HZ2  TRP  77           HZ2      TRP  77 100.679   6.562   6.724
  619    HZ3  TRP  77           HZ3      TRP  77  97.627   8.761   8.804
  620    HH2  TRP  77           HH2      TRP  77  98.801   8.201   6.692
  621    H    ALA  78           HN       ALA  78  97.349   6.510  13.007
  622    HA   ALA  78           HA       ALA  78  96.078   6.321  10.358
  623    HB1  ALA  78           HB1      ALA  78  93.822   6.326  11.387
  624    HB2  ALA  78           HB2      ALA  78  94.568   6.061  12.964
  625    HB3  ALA  78           HB3      ALA  78  94.713   4.836  11.702
  626    H    ARG  79           HN       ARG  79  95.952   8.420   9.617
  627    HA   ARG  79           HA       ARG  79  95.095  10.485  11.466
  628    HB2  ARG  79           HB2      ARG  79  97.702  10.184  11.506
  629    HB3  ARG  79           HB1      ARG  79  97.639  11.055   9.977
  630    HG2  ARG  79           HG2      ARG  79  96.601  12.961  11.006
  631    HG3  ARG  79           HG1      ARG  79  96.321  12.077  12.507
  632    HD2  ARG  79           HD2      ARG  79  98.834  11.817  12.699
  633    HD3  ARG  79           HD1      ARG  79  98.981  12.942  11.351
  634    HE   ARG  79           HE       ARG  79  97.432  14.343  13.041
  635   HH11  ARG  79          HH21      ARG  79 100.305  12.473  13.521
  636   HH12  ARG  79          HH22      ARG  79 100.875  13.435  14.845
  637   HH21  ARG  79          HH11      ARG  79  98.173  15.608  14.775
  638   HH22  ARG  79          HH12      ARG  79  99.667  15.209  15.555
  639    H    ASP  80           HN       ASP  80  93.911  12.050  10.543
  640    HA   ASP  80           HA       ASP  80  92.801  13.244   8.949
  641    HB2  ASP  80           HB2      ASP  80  95.214  13.972   8.647
  642    HB3  ASP  80           HB1      ASP  80  95.256  12.907   7.245
  643    H    GLY  81           HN       GLY  81  91.942  10.599   8.816
  644    HA2  GLY  81           HA2      GLY  81  90.559   9.477   7.358
  645    HA3  GLY  81           HA1      GLY  81  91.100  10.536   6.067
  646    H    LEU  82           HN       LEU  82  93.996   9.807   6.612
  647    HA   LEU  82           HA       LEU  82  93.933   7.383   4.993
  648    HB2  LEU  82           HB2      LEU  82  96.453   8.768   5.860
  649    HB3  LEU  82           HB1      LEU  82  96.109   7.908   4.359
  650    HG   LEU  82           HG       LEU  82  94.971  10.593   5.189
  651   HD11  LEU  82          HD11      LEU  82  96.350  11.537   3.529
  652   HD12  LEU  82          HD12      LEU  82  96.627   9.983   2.742
  653   HD13  LEU  82          HD13      LEU  82  97.402  10.340   4.286
  654   HD21  LEU  82          HD21      LEU  82  94.046  10.503   2.805
  655   HD22  LEU  82          HD22      LEU  82  93.254   9.447   3.973
  656   HD23  LEU  82          HD23      LEU  82  94.416   8.779   2.827
  657    H    LEU  83           HN       LEU  83  95.278   5.544   5.497
  658    HA   LEU  83           HA       LEU  83  95.690   5.134   8.426
  659    HB2  LEU  83           HB2      LEU  83  94.789   3.065   6.436
  660    HB3  LEU  83           HB1      LEU  83  94.862   2.925   8.190
  661    HG   LEU  83           HG       LEU  83  93.111   4.934   6.748
  662   HD11  LEU  83          HD11      LEU  83  91.296   3.256   7.586
  663   HD12  LEU  83          HD12      LEU  83  92.618   2.093   7.624
  664   HD13  LEU  83          HD13      LEU  83  92.175   2.877   6.107
  665   HD21  LEU  83          HD21      LEU  83  93.414   4.001   9.611
  666   HD22  LEU  83          HD22      LEU  83  91.944   4.794   9.049
  667   HD23  LEU  83          HD23      LEU  83  93.484   5.650   8.988
  668    H    GLY  84           HN       GLY  84  97.727   4.294   8.934
  669    HA2  GLY  84           HA2      GLY  84  99.456   3.536   6.694
  670    HA3  GLY  84           HA1      GLY  84  99.969   3.924   8.330
  671    H    PHE  85           HN       PHE  85 100.627   1.585   6.755
  672    HA   PHE  85           HA       PHE  85  99.772  -0.435   8.706
  673    HB2  PHE  85           HB2      PHE  85  99.220  -0.434   5.765
  674    HB3  PHE  85           HB1      PHE  85  99.545  -1.960   6.573
  675    HD1  PHE  85           HD2      PHE  85  98.106  -2.686   8.495
  676    HD2  PHE  85           HD1      PHE  85  97.163   0.738   6.085
  677    HE1  PHE  85           HE2      PHE  85  95.783  -2.719   9.363
  678    HE2  PHE  85           HE1      PHE  85  94.837   0.701   6.946
  679    HZ   PHE  85           HZ       PHE  85  94.151  -1.023   8.587
  680    H    GLU  86           HN       GLU  86 101.394  -1.829   9.235
  681    HA   GLU  86           HA       GLU  86 103.888  -1.601   7.686
  682    HB2  GLU  86           HB2      GLU  86 103.993  -1.057  10.118
  683    HB3  GLU  86           HB1      GLU  86 103.444  -2.695  10.481
  684    HG2  GLU  86           HG2      GLU  86 105.409  -3.648   9.421
  685    HG3  GLU  86           HG1      GLU  86 105.932  -2.056   8.873
  686    H    CYS  87           HN       CYS  87 104.474  -3.316   6.462
  687    HA   CYS  87           HA       CYS  87 102.793  -5.596   6.259
  688    HB2  CYS  87           HB2      CYS  87 104.424  -4.461   4.523
  689    HB3  CYS  87           HB1      CYS  87 105.584  -5.614   5.184
  690    HG   CYS  87           HG       CYS  87 103.046  -6.353   3.564
  691    H    GLN  88           HN       GLN  88 102.746  -7.362   7.452
  692    HA   GLN  88           HA       GLN  88 105.004  -7.979   9.230
  693    HB2  GLN  88           HB2      GLN  88 102.403  -9.485   9.196
  694    HB3  GLN  88           HB1      GLN  88 103.504  -9.197  10.542
  695    HG2  GLN  88           HG2      GLN  88 102.900  -6.814  10.543
  696    HG3  GLN  88           HG1      GLN  88 101.819  -7.084   9.179
  697   HE21  GLN  88          HE21      GLN  88  99.781  -6.766  10.148
  698   HE22  GLN  88          HE22      GLN  88  99.222  -7.658  11.480
  699    H    HIS  89           HN       HIS  89 103.168  -9.262   6.518
  700    HA   HIS  89           HA       HIS  89 105.305 -11.055   5.835
  701    HB2  HIS  89           HB2      HIS  89 104.561 -12.996   6.699
  702    HB3  HIS  89           HB1      HIS  89 103.380 -12.061   7.616
  703    HD2  HIS  89           HD2      HIS  89 100.830 -12.930   7.057
  704    HE1  HIS  89           HE1      HIS  89 101.483 -14.274   3.102
  705    HE2  HIS  89           HE2      HIS  89  99.751 -14.039   4.950
  706    H    ILE  90           HN       ILE  90 105.217 -11.671   3.727
  707    HA   ILE  90           HA       ILE  90 102.786 -11.244   2.133
  708    HB   ILE  90           HB       ILE  90 103.821  -9.071   1.972
  709   HG12  ILE  90          HG12      ILE  90 104.774 -10.586  -0.461
  710   HG13  ILE  90          HG11      ILE  90 103.063 -10.319  -0.141
  711   HG21  ILE  90          HG21      ILE  90 106.016  -9.431   2.788
  712   HG22  ILE  90          HG22      ILE  90 106.235  -8.984   1.096
  713   HG23  ILE  90          HG23      ILE  90 106.347 -10.677   1.585
  714   HD11  ILE  90          HD11      ILE  90 104.671  -8.577  -1.520
  715   HD12  ILE  90          HD12      ILE  90 104.731  -7.897   0.107
  716   HD13  ILE  90          HD13      ILE  90 103.178  -8.120  -0.699
  717    H    ASP  91           HN       ASP  91 102.608 -12.511   0.412
  718    HA   ASP  91           HA       ASP  91 103.973 -14.944   0.402
  719    HB2  ASP  91           HB2      ASP  91 101.772 -14.661  -0.609
  720    HB3  ASP  91           HB1      ASP  91 102.461 -13.646  -1.870
  721    H    LEU  92           HN       LEU  92 105.542 -15.846  -0.828
  722    HA   LEU  92           HA       LEU  92 107.801 -14.343  -1.455
  723    HB2  LEU  92           HB2      LEU  92 107.807 -16.806  -1.114
  724    HB3  LEU  92           HB1      LEU  92 107.034 -17.001  -2.687
  725    HG   LEU  92           HG       LEU  92 108.969 -15.832  -3.747
  726   HD11  LEU  92          HD11      LEU  92 111.063 -15.874  -2.116
  727   HD12  LEU  92          HD12      LEU  92 109.824 -15.683  -0.876
  728   HD13  LEU  92          HD13      LEU  92 109.984 -14.482  -2.158
  729   HD21  LEU  92          HD21      LEU  92 108.905 -18.294  -3.623
  730   HD22  LEU  92          HD22      LEU  92 109.677 -18.240  -2.038
  731   HD23  LEU  92          HD23      LEU  92 110.561 -17.708  -3.468
  732    H    ASP  93           HN       ASP  93 105.209 -15.457  -3.606
  733    HA   ASP  93           HA       ASP  93 106.364 -14.395  -5.988
  734    HB2  ASP  93           HB2      ASP  93 103.508 -15.143  -5.313
  735    HB3  ASP  93           HB1      ASP  93 104.067 -14.701  -6.925
  736    H    SER  94           HN       SER  94 104.243 -13.167  -3.490
  737    HA   SER  94           HA       SER  94 103.433 -10.789  -4.841
  738    HB2  SER  94           HB2      SER  94 103.468 -11.665  -1.965
  739    HB3  SER  94           HB1      SER  94 103.002 -10.029  -2.409
  740    HG   SER  94           HG       SER  94 101.423 -10.971  -3.795
  741    H    ILE  95           HN       ILE  95 106.094 -11.659  -2.709
  742    HA   ILE  95           HA       ILE  95 107.138  -9.104  -2.216
  743    HB   ILE  95           HB       ILE  95 108.444 -11.823  -2.400
  744   HG12  ILE  95          HG12      ILE  95 107.894  -9.981  -0.057
  745   HG13  ILE  95          HG11      ILE  95 106.858 -11.325  -0.526
  746   HG21  ILE  95          HG21      ILE  95 110.231 -10.345  -2.919
  747   HG22  ILE  95          HG22      ILE  95 110.364 -10.604  -1.182
  748   HG23  ILE  95          HG23      ILE  95 109.646  -9.115  -1.798
  749   HD11  ILE  95          HD11      ILE  95 109.071 -12.731  -0.368
  750   HD12  ILE  95          HD12      ILE  95 108.204 -12.311   1.109
  751   HD13  ILE  95          HD13      ILE  95 109.628 -11.388   0.631
  752    H    SER  96           HN       SER  96 107.569 -11.331  -4.917
  753    HA   SER  96           HA       SER  96 109.623  -9.780  -6.119
  754    HB2  SER  96           HB2      SER  96 108.613 -12.320  -6.549
  755    HB3  SER  96           HB1      SER  96 108.031 -11.442  -7.965
  756    HG   SER  96           HG       SER  96 110.669 -10.996  -7.197
  757    H    HIS  97           HN       HIS  97 106.110  -9.906  -6.641
  758    HA   HIS  97           HA       HIS  97 106.159  -8.160  -8.861
  759    HB2  HIS  97           HB2      HIS  97 104.054  -8.864  -6.829
  760    HB3  HIS  97           HB1      HIS  97 103.772  -7.601  -8.011
  761    HD2  HIS  97           HD2      HIS  97 103.784 -11.457  -7.829
  762    HE1  HIS  97           HE1      HIS  97 103.335 -10.406 -11.892
  763    HE2  HIS  97           HE2      HIS  97 103.251 -12.327 -10.233
  764    H    LEU  98           HN       LEU  98 106.204  -7.609  -5.390
  765    HA   LEU  98           HA       LEU  98 105.933  -4.736  -5.535
  766    HB2  LEU  98           HB2      LEU  98 106.600  -6.757  -3.453
  767    HB3  LEU  98           HB1      LEU  98 107.307  -5.158  -3.221
  768    HG   LEU  98           HG       LEU  98 105.014  -4.172  -3.526
  769   HD11  LEU  98          HD11      LEU  98 104.006  -6.996  -3.155
  770   HD12  LEU  98          HD12      LEU  98 104.203  -6.290  -4.758
  771   HD13  LEU  98          HD13      LEU  98 103.090  -5.557  -3.604
  772   HD21  LEU  98          HD21      LEU  98 105.424  -6.202  -1.311
  773   HD22  LEU  98          HD22      LEU  98 104.165  -4.967  -1.295
  774   HD23  LEU  98          HD23      LEU  98 105.863  -4.494  -1.276
  775    H    ARG  99           HN       ARG  99 108.633  -6.988  -5.746
  776    HA   ARG  99           HA       ARG  99 110.656  -4.978  -5.616
  777    HB2  ARG  99           HB2      ARG  99 110.584  -7.772  -6.760
  778    HB3  ARG  99           HB1      ARG  99 112.019  -6.753  -6.871
  779    HG2  ARG  99           HG2      ARG  99 112.157  -6.562  -4.466
  780    HG3  ARG  99           HG1      ARG  99 110.605  -7.370  -4.263
  781    HD2  ARG  99           HD2      ARG  99 112.066  -9.134  -3.869
  782    HD3  ARG  99           HD1      ARG  99 111.793  -9.319  -5.599
  783    HE   ARG  99           HE       ARG  99 114.021  -7.600  -5.062
  784   HH11  ARG  99          HH21      ARG  99 112.945 -10.886  -5.174
  785   HH12  ARG  99          HH22      ARG  99 114.513 -11.532  -5.526
  786   HH21  ARG  99          HH11      ARG  99 116.079  -8.438  -5.524
  787   HH22  ARG  99          HH12      ARG  99 116.289 -10.145  -5.725
  788    H    ARG 100           HN       ARG 100 108.753  -6.443  -8.171
  789    HA   ARG 100           HA       ARG 100 109.957  -5.300 -10.454
  790    HB2  ARG 100           HB2      ARG 100 107.192  -6.291  -9.819
  791    HB3  ARG 100           HB1      ARG 100 107.576  -5.592 -11.388
  792    HG2  ARG 100           HG2      ARG 100 109.406  -7.700 -10.295
  793    HG3  ARG 100           HG1      ARG 100 107.845  -8.207 -10.941
  794    HD2  ARG 100           HD2      ARG 100 108.352  -6.992 -13.051
  795    HD3  ARG 100           HD1      ARG 100 109.939  -6.578 -12.409
  796    HE   ARG 100           HE       ARG 100 109.186  -9.081 -13.559
  797   HH11  ARG 100          HH21      ARG 100 111.063  -7.606 -11.054
  798   HH12  ARG 100          HH22      ARG 100 112.233  -8.881 -10.990
  799   HH21  ARG 100          HH11      ARG 100 110.717 -10.756 -13.482
  800   HH22  ARG 100          HH12      ARG 100 112.038 -10.665 -12.364
  801    H    LEU 101           HN       LEU 101 107.348  -4.150  -8.344
  802    HA   LEU 101           HA       LEU 101 106.701  -1.851  -9.844
  803    HB2  LEU 101           HB2      LEU 101 106.137  -2.859  -7.128
  804    HB3  LEU 101           HB1      LEU 101 106.153  -1.103  -7.235
  805    HG   LEU 101           HG       LEU 101 104.538  -2.925  -9.048
  806   HD11  LEU 101          HD11      LEU 101 103.731  -2.969  -6.716
  807   HD12  LEU 101          HD12      LEU 101 102.594  -2.125  -7.768
  808   HD13  LEU 101          HD13      LEU 101 103.665  -1.206  -6.709
  809   HD21  LEU 101          HD21      LEU 101 105.090  -0.003  -8.964
  810   HD22  LEU 101          HD22      LEU 101 103.401  -0.452  -9.196
  811   HD23  LEU 101          HD23      LEU 101 104.625  -1.023 -10.326
  812    H    VAL 102           HN       VAL 102 109.124  -2.483  -7.393
  813    HA   VAL 102           HA       VAL 102 109.979   0.206  -7.026
  814    HB   VAL 102           HB       VAL 102 111.391  -2.427  -6.555
  815   HG11  VAL 102          HG11      VAL 102 112.745  -0.905  -4.954
  816   HG12  VAL 102          HG12      VAL 102 112.135   0.430  -5.931
  817   HG13  VAL 102          HG13      VAL 102 113.125  -0.826  -6.674
  818   HG21  VAL 102          HG21      VAL 102 110.372  -0.639  -4.383
  819   HG22  VAL 102          HG22      VAL 102 110.489  -2.396  -4.423
  820   HG23  VAL 102          HG23      VAL 102 109.185  -1.581  -5.285
  821    H    GLU 103           HN       GLU 103 111.167  -2.457  -9.069
  822    HA   GLU 103           HA       GLU 103 113.402  -1.085 -10.119
  823    HB2  GLU 103           HB2      GLU 103 111.798  -3.401 -11.207
  824    HB3  GLU 103           HB1      GLU 103 113.305  -2.824 -11.922
  825    HG2  GLU 103           HG2      GLU 103 114.496  -3.241  -9.831
  826    HG3  GLU 103           HG1      GLU 103 112.996  -3.735  -9.049
  827    H    LEU 104           HN       LEU 104 110.106  -1.490 -11.432
  828    HA   LEU 104           HA       LEU 104 110.683  -0.022 -13.818
  829    HB2  LEU 104           HB2      LEU 104 108.176  -1.049 -12.527
  830    HB3  LEU 104           HB1      LEU 104 108.076   0.052 -13.898
  831    HG   LEU 104           HG       LEU 104 109.276  -1.452 -15.318
  832   HD11  LEU 104          HD11      LEU 104 111.030  -2.270 -13.938
  833   HD12  LEU 104          HD12      LEU 104 110.062  -3.691 -14.325
  834   HD13  LEU 104          HD13      LEU 104 109.899  -2.917 -12.752
  835   HD21  LEU 104          HD21      LEU 104 106.875  -2.006 -14.815
  836   HD22  LEU 104          HD22      LEU 104 107.444  -3.158 -13.608
  837   HD23  LEU 104          HD23      LEU 104 107.833  -3.401 -15.311
  838    H    ASN 105           HN       ASN 105 109.159   0.828 -10.724
  839    HA   ASN 105           HA       ASN 105 108.299   3.408 -11.415
  840    HB2  ASN 105           HB2      ASN 105 109.141   2.148  -8.815
  841    HB3  ASN 105           HB1      ASN 105 108.727   3.859  -8.889
  842   HD21  ASN 105          HD21      ASN 105 106.568   3.895 -10.654
  843   HD22  ASN 105          HD22      ASN 105 105.295   2.962 -10.029
  844    H    LEU 106           HN       LEU 106 111.471   2.155 -10.782
  845    HA   LEU 106           HA       LEU 106 112.842   4.477 -10.061
  846    HB2  LEU 106           HB2      LEU 106 113.598   1.927 -10.414
  847    HB3  LEU 106           HB1      LEU 106 114.181   2.587 -11.941
  848    HG   LEU 106           HG       LEU 106 115.157   4.496 -10.377
  849   HD11  LEU 106          HD11      LEU 106 114.004   3.368  -8.369
  850   HD12  LEU 106          HD12      LEU 106 115.697   3.816  -8.168
  851   HD13  LEU 106          HD13      LEU 106 115.262   2.138  -8.492
  852   HD21  LEU 106          HD21      LEU 106 116.616   3.162 -11.725
  853   HD22  LEU 106          HD22      LEU 106 116.289   1.717 -10.769
  854   HD23  LEU 106          HD23      LEU 106 117.234   3.036 -10.078
  855    H    GLY 107           HN       GLY 107 111.343   3.645 -13.040
  856    HA2  GLY 107           HA2      GLY 107 112.305   6.149 -14.217
  857    HA3  GLY 107           HA1      GLY 107 112.626   4.669 -15.113
  858    H    ASP 108           HN       ASP 108 110.280   3.252 -14.677
  859    HA   ASP 108           HA       ASP 108 108.572   4.331 -16.635
  860    HB2  ASP 108           HB2      ASP 108 107.940   2.270 -14.512
  861    HB3  ASP 108           HB1      ASP 108 107.002   2.561 -15.975
  862    H    GLU 109           HN       GLU 109 108.498   6.548 -15.644
  863    HA   GLU 109           HA       GLU 109 105.924   7.013 -14.534
  864    HB2  GLU 109           HB2      GLU 109 107.670   6.255 -12.592
  865    HB3  GLU 109           HB1      GLU 109 107.943   7.995 -12.595
  866    HG2  GLU 109           HG2      GLU 109 106.170   7.600 -11.039
  867    HG3  GLU 109           HG1      GLU 109 105.413   8.267 -12.485
  868    H    GLU 110           HN       GLU 110 105.388   9.235 -14.513
  869    HA   GLU 110           HA       GLU 110 106.737  10.832 -16.408
  870    HB2  GLU 110           HB2      GLU 110 104.761  11.660 -14.267
  871    HB3  GLU 110           HB1      GLU 110 105.223  12.630 -15.667
  872    HG2  GLU 110           HG2      GLU 110 104.174  11.176 -17.185
  873    HG3  GLU 110           HG1      GLU 110 104.161   9.836 -16.039
  874    H    LEU 111           HN       LEU 111 106.136  12.949 -13.930
  875    HA   LEU 111           HA       LEU 111 108.871  13.700 -13.666
  876    HB2  LEU 111           HB2      LEU 111 106.344  14.520 -12.229
  877    HB3  LEU 111           HB1      LEU 111 107.920  15.175 -11.790
  878    HG   LEU 111           HG       LEU 111 108.251  15.969 -14.093
  879   HD11  LEU 111          HD11      LEU 111 106.104  15.919 -15.551
  880   HD12  LEU 111          HD12      LEU 111 105.588  14.606 -14.494
  881   HD13  LEU 111          HD13      LEU 111 107.063  14.444 -15.450
  882   HD21  LEU 111          HD21      LEU 111 106.738  17.808 -13.979
  883   HD22  LEU 111          HD22      LEU 111 106.986  17.309 -12.306
  884   HD23  LEU 111          HD23      LEU 111 105.512  16.846 -13.156
  885    H    LEU 112           HN       LEU 112 108.371  14.191 -10.653
  886    HA   LEU 112           HA       LEU 112 109.087  13.236  -8.695
  887    HB2  LEU 112           HB2      LEU 112 107.965  10.677  -9.853
  888    HB3  LEU 112           HB1      LEU 112 108.191  11.071  -8.150
  889    HG   LEU 112           HG       LEU 112 106.638  13.187  -9.218
  890   HD11  LEU 112          HD11      LEU 112 105.492  10.491 -10.004
  891   HD12  LEU 112          HD12      LEU 112 106.187  11.640 -11.146
  892   HD13  LEU 112          HD13      LEU 112 104.739  12.068 -10.236
  893   HD21  LEU 112          HD21      LEU 112 106.423  12.359  -6.951
  894   HD22  LEU 112          HD22      LEU 112 105.927  10.769  -7.531
  895   HD23  LEU 112          HD23      LEU 112 104.864  12.159  -7.752
  896    H    GLU 113           HN       GLU 113 111.034  13.428 -10.733
  897    HA   GLU 113           HA       GLU 113 112.829  11.263  -9.891
  898    HB2  GLU 113           HB2      GLU 113 111.906  11.772 -12.685
  899    HB3  GLU 113           HB1      GLU 113 113.606  11.366 -12.451
  900    HG2  GLU 113           HG2      GLU 113 111.399   9.731 -11.198
  901    HG3  GLU 113           HG1      GLU 113 111.980   9.407 -12.830
  902    H    ARG 114           HN       ARG 114 113.987  12.765  -8.684
  903    HA   ARG 114           HA       ARG 114 116.015  14.192 -10.062
  904    HB2  ARG 114           HB2      ARG 114 115.175  16.466  -8.950
  905    HB3  ARG 114           HB1      ARG 114 114.670  15.990 -10.571
  906    HG2  ARG 114           HG2      ARG 114 112.548  15.304  -9.856
  907    HG3  ARG 114           HG1      ARG 114 113.069  15.097  -8.185
  908    HD2  ARG 114           HD2      ARG 114 111.689  17.101  -8.367
  909    HD3  ARG 114           HD1      ARG 114 113.347  17.559  -7.992
  910    HE   ARG 114           HE       ARG 114 111.968  17.951 -10.560
  911   HH11  ARG 114          HH21      ARG 114 114.818  18.210  -8.604
  912   HH12  ARG 114          HH22      ARG 114 115.591  19.358  -9.645
  913   HH21  ARG 114          HH11      ARG 114 112.981  19.452 -11.924
  914   HH22  ARG 114          HH12      ARG 114 114.553  20.060 -11.521
  915    H    GLU 115           HN       GLU 115 117.707  14.039  -8.755
  916    HA   GLU 115           HA       GLU 115 117.713  13.097  -6.165
  917    HB2  GLU 115           HB2      GLU 115 119.667  14.910  -7.589
  918    HB3  GLU 115           HB1      GLU 115 119.982  14.236  -5.991
  919    HG2  GLU 115           HG2      GLU 115 119.300  12.567  -8.427
  920    HG3  GLU 115           HG1      GLU 115 120.944  12.871  -7.872
  921    H    LEU 116           HN       LEU 116 117.372  16.411  -7.301
  922    HA   LEU 116           HA       LEU 116 117.688  17.828  -4.915
  923    HB2  LEU 116           HB2      LEU 116 116.165  18.262  -7.447
  924    HB3  LEU 116           HB1      LEU 116 115.770  19.292  -6.071
  925    HG   LEU 116           HG       LEU 116 118.177  19.886  -5.856
  926   HD11  LEU 116          HD11      LEU 116 119.115  17.838  -6.863
  927   HD12  LEU 116          HD12      LEU 116 119.706  19.272  -7.700
  928   HD13  LEU 116          HD13      LEU 116 118.433  18.291  -8.426
  929   HD21  LEU 116          HD21      LEU 116 116.804  21.402  -7.119
  930   HD22  LEU 116          HD22      LEU 116 116.825  20.342  -8.528
  931   HD23  LEU 116          HD23      LEU 116 118.294  21.186  -8.038
  932    H    ALA 117           HN       ALA 117 114.773  16.236  -6.214
  933    HA   ALA 117           HA       ALA 117 113.014  17.007  -4.116
  934    HB1  ALA 117           HB1      ALA 117 112.252  16.176  -6.291
  935    HB2  ALA 117           HB2      ALA 117 111.596  15.218  -4.965
  936    HB3  ALA 117           HB3      ALA 117 112.936  14.592  -5.924
  937    H    LEU 118           HN       LEU 118 114.743  13.946  -4.727
  938    HA   LEU 118           HA       LEU 118 113.903  12.596  -2.446
  939    HB2  LEU 118           HB2      LEU 118 116.618  12.236  -3.709
  940    HB3  LEU 118           HB1      LEU 118 115.633  11.028  -2.884
  941    HG   LEU 118           HG       LEU 118 115.035  12.365  -5.538
  942   HD11  LEU 118          HD11      LEU 118 116.623  10.531  -5.706
  943   HD12  LEU 118          HD12      LEU 118 115.062   9.982  -6.319
  944   HD13  LEU 118          HD13      LEU 118 115.595   9.503  -4.708
  945   HD21  LEU 118          HD21      LEU 118 112.914  12.183  -4.498
  946   HD22  LEU 118          HD22      LEU 118 113.335  10.663  -3.709
  947   HD23  LEU 118          HD23      LEU 118 113.046  10.704  -5.449
  948    H    LEU 119           HN       LEU 119 116.943  14.493  -2.835
  949    HA   LEU 119           HA       LEU 119 117.724  13.991  -0.133
  950    HB2  LEU 119           HB2      LEU 119 118.667  15.897  -2.266
  951    HB3  LEU 119           HB1      LEU 119 119.330  15.947  -0.634
  952    HG   LEU 119           HG       LEU 119 119.261  13.199  -1.529
  953   HD11  LEU 119          HD11      LEU 119 119.362  13.916  -3.801
  954   HD12  LEU 119          HD12      LEU 119 121.014  13.498  -3.349
  955   HD13  LEU 119          HD13      LEU 119 120.522  15.190  -3.424
  956   HD21  LEU 119          HD21      LEU 119 121.559  15.112  -1.007
  957   HD22  LEU 119          HD22      LEU 119 121.682  13.354  -1.070
  958   HD23  LEU 119          HD23      LEU 119 120.748  14.128   0.211
  959    H    VAL 120           HN       VAL 120 116.411  16.914  -1.741
  960    HA   VAL 120           HA       VAL 120 116.441  18.546   0.466
  961    HB   VAL 120           HB       VAL 120 114.396  18.502  -1.765
  962   HG11  VAL 120          HG11      VAL 120 113.456  19.841  -0.040
  963   HG12  VAL 120          HG12      VAL 120 114.246  20.986  -1.124
  964   HG13  VAL 120          HG13      VAL 120 115.022  20.525   0.391
  965   HG21  VAL 120          HG21      VAL 120 115.867  19.841  -2.975
  966   HG22  VAL 120          HG22      VAL 120 117.012  18.809  -2.120
  967   HG23  VAL 120          HG23      VAL 120 116.682  20.437  -1.528
  968    H    SER 121           HN       SER 121 114.561  15.752   0.059
  969    HA   SER 121           HA       SER 121 112.444  16.588   1.894
  970    HB2  SER 121           HB2      SER 121 111.535  15.123   0.339
  971    HB3  SER 121           HB1      SER 121 113.015  14.172   0.218
  972    HG   SER 121           HG       SER 121 110.885  13.695   1.702
  973    H    ALA 122           HN       ALA 122 115.426  16.306   2.479
  974    HA   ALA 122           HA       ALA 122 115.370  15.648   5.155
  975    HB1  ALA 122           HB1      ALA 122 115.424  13.400   5.358
  976    HB2  ALA 122           HB2      ALA 122 116.776  13.293   4.237
  977    HB3  ALA 122           HB3      ALA 122 115.127  13.268   3.627
  978    H    HIS 123           HN       HIS 123 117.815  14.583   5.699
  979    HA   HIS 123           HA       HIS 123 119.896  15.360   3.972
  980    HB2  HIS 123           HB2      HIS 123 120.604  17.450   4.763
  981    HB3  HIS 123           HB1      HIS 123 118.853  17.633   4.712
  982    HD2  HIS 123           HD2      HIS 123 117.776  18.398   7.145
  983    HE1  HIS 123           HE1      HIS 123 121.027  17.289   9.600
  984    HE2  HIS 123           HE2      HIS 123 118.737  18.390   9.573
  985    H    ASP 124           HN       ASP 124 121.948  15.944   5.548
  986    HA   ASP 124           HA       ASP 124 123.046  13.792   6.568
  987    HB2  ASP 124           HB2      ASP 124 123.138  16.369   8.125
  988    HB3  ASP 124           HB1      ASP 124 124.381  15.122   8.033
  989    H    ASP 125           HN       ASP 125 120.191  15.148   7.995
  990    HA   ASP 125           HA       ASP 125 119.010  13.477   9.432
  991    HB2  ASP 125           HB2      ASP 125 120.961  12.262  10.212
  992    HB3  ASP 125           HB1      ASP 125 121.599  13.715  10.988
  993   H5'1  C2E 501          H5'1      C2E 501 105.475   3.445  10.319
  994   H5'2  C2E 501          H5'2      C2E 501 104.778   2.051  11.158
  995    H4'  C2E 501           H4'      C2E 501 107.040   0.876  10.434
  996    H3'  C2E 501           H3'      C2E 501 106.924   3.292   8.645
  997    H2'  C2E 501           H2'      C2E 501 107.120   2.078   6.664
  998   HO2'  C2E 501          HO2'      C2E 501 107.387  -0.467   7.580
  999    H1'  C2E 501           H1'      C2E 501 105.409   0.078   7.208
 1000    H8   C2E 501           H8       C2E 501 103.689   2.630   9.204
 1001    HN1  C2E 501           HN1      C2E 501 103.366   4.093   2.986
 1002   HN21  C2E 501          HN21      C2E 501 104.828   2.884   1.837
 1003   HN22  C2E 501          HN22      C2E 501 105.871   1.703   2.597
 1004   H511  C2E 501          H511      C2E 501 108.293   4.635   9.981
 1005   H512  C2E 501          H512      C2E 501 109.984   4.655  10.526
 1006    H4A  C2E 501           H4A      C2E 501 109.162   5.464  12.771
 1007    H3A  C2E 501           H3A      C2E 501 106.472   5.494  11.370
 1008    H2A  C2E 501           H2A      C2E 501 105.951   7.511  12.367
 1009   HO2A  C2E 501          HO2A      C2E 501 107.146   8.350  14.123
 1010    H1A  C2E 501           H1A      C2E 501 108.384   8.741  12.101
 1011    H81  C2E 501           H81      C2E 501 108.231   6.844   8.923
 1012   HN11  C2E 501          HN11      C2E 501 104.215  11.827   8.851
 1013   HN24  C2E 501          HN24      C2E 501 104.756  11.933  12.298
 1014   HN23  C2E 501          HN23      C2E 501 103.941  12.619  10.911
 1015   H5'1  C2E 502          H5'1      C2E 502 101.386  10.671   4.328
 1016   H5'2  C2E 502          H5'2      C2E 502  99.813  11.457   4.072
 1017    H4'  C2E 502           H4'      C2E 502  99.686  12.198   6.297
 1018    H3'  C2E 502           H3'      C2E 502 102.664  11.742   6.428
 1019    H2'  C2E 502           H2'      C2E 502 102.404  11.426   8.798
 1020   HO2'  C2E 502          HO2'      C2E 502  99.932  11.642   9.401
 1021    H1'  C2E 502           H1'      C2E 502 100.245   9.810   8.626
 1022    H8   C2E 502           H8       C2E 502 102.375   8.930   5.603
 1023    HN1  C2E 502           HN1      C2E 502 104.346   6.181  11.026
 1024   HN21  C2E 502          HN21      C2E 502 103.280   7.015  12.759
 1025   HN22  C2E 502          HN22      C2E 502 102.078   8.281  12.608
 1026   H511  C2E 502          H511      C2E 502 103.192  16.691   5.748
 1027   H512  C2E 502          H512      C2E 502 102.229  15.273   5.283
 1028    H4A  C2E 502           H4A      C2E 502 103.852  16.226   3.535
 1029    H3A  C2E 502           H3A      C2E 502 103.848  13.289   4.328
 1030    H2A  C2E 502           H2A      C2E 502 105.577  12.898   2.781
 1031   HO2A  C2E 502          HO2A      C2E 502 106.198  14.557   1.262
 1032    H1A  C2E 502           H1A      C2E 502 107.049  15.141   3.330
 1033    H81  C2E 502           H81      C2E 502 106.006  14.358   6.728
 1034   HN11  C2E 502          HN11      C2E 502 109.682   9.668   4.441
 1035   HN24  C2E 502          HN24      C2E 502 109.896   9.868   2.242
 1036   HN23  C2E 502          HN23      C2E 502 109.150  11.171   1.344
  Start of MODEL   17
    1    H    MET   1           H        MET   1 112.667  22.460  12.789
    2    HA   MET   1           HA       MET   1 113.138  19.558  13.195
    3    HB2  MET   1           HB2      MET   1 112.203  21.668  14.936
    4    HB3  MET   1           HB1      MET   1 110.889  20.532  14.638
    5    HG2  MET   1           HG2      MET   1 112.203  19.821  16.587
    6    HG3  MET   1           HG1      MET   1 112.380  18.656  15.274
    7    HE1  MET   1           HE1      MET   1 114.636  19.753  17.998
    8    HE2  MET   1           HE2      MET   1 115.716  18.638  17.165
    9    HE3  MET   1           HE3      MET   1 114.002  18.253  17.308
   10    H    SER   2           HN       SER   2 112.034  21.646  11.024
   11    HA   SER   2           HA       SER   2 109.894  19.852  10.147
   12    HB2  SER   2           HB2      SER   2 108.880  21.711  11.559
   13    HB3  SER   2           HB1      SER   2 109.408  22.828  10.305
   14    HG   SER   2           HG       SER   2 107.214  21.433  10.333
   15    H    ASP   3           HN       ASP   3 112.684  20.838   9.325
   16    HA   ASP   3           HA       ASP   3 112.103  22.044   6.703
   17    HB2  ASP   3           HB2      ASP   3 114.631  21.594   8.289
   18    HB3  ASP   3           HB1      ASP   3 114.616  22.184   6.628
   19    H    GLN   4           HN       GLN   4 112.455  19.048   8.151
   20    HA   GLN   4           HA       GLN   4 113.527  17.795   5.698
   21    HB2  GLN   4           HB2      GLN   4 113.487  15.906   7.811
   22    HB3  GLN   4           HB1      GLN   4 114.890  16.651   7.053
   23    HG2  GLN   4           HG2      GLN   4 115.114  17.170   9.347
   24    HG3  GLN   4           HG1      GLN   4 114.465  18.644   8.637
   25   HE21  GLN   4          HE21      GLN   4 111.741  18.087   8.419
   26   HE22  GLN   4          HE22      GLN   4 111.088  17.769   9.952
   27    H    HIS   5           HN       HIS   5 110.639  18.585   6.694
   28    HA   HIS   5           HA       HIS   5 108.524  17.651   6.678
   29    HB2  HIS   5           HB2      HIS   5 108.661  15.451   5.000
   30    HB3  HIS   5           HB1      HIS   5 108.336  17.102   4.485
   31    HD2  HIS   5           HD2      HIS   5 111.193  14.458   4.294
   32    HE1  HIS   5           HE1      HIS   5 112.533  17.935   2.306
   33    HE2  HIS   5           HE2      HIS   5 113.047  15.491   2.767
   34    H    ASP   6           HN       ASP   6 110.821  16.604   8.361
   35    HA   ASP   6           HA       ASP   6 111.277  14.929   9.854
   36    HB2  ASP   6           HB2      ASP   6 108.279  14.547   9.905
   37    HB3  ASP   6           HB1      ASP   6 109.424  14.282  11.219
   38    H    GLU   7           HN       GLU   7 112.286  13.605   8.275
   39    HA   GLU   7           HA       GLU   7 110.729  11.486   7.047
   40    HB2  GLU   7           HB2      GLU   7 112.444  12.153   5.626
   41    HB3  GLU   7           HB1      GLU   7 113.598  12.350   6.947
   42    HG2  GLU   7           HG2      GLU   7 113.911  10.006   7.170
   43    HG3  GLU   7           HG1      GLU   7 112.474   9.645   6.215
   44    H    ARG   8           HN       ARG   8 110.211   9.697   8.084
   45    HA   ARG   8           HA       ARG   8 111.937   8.761  10.310
   46    HB2  ARG   8           HB2      ARG   8 108.946   8.931  10.104
   47    HB3  ARG   8           HB1      ARG   8 109.739   7.814  11.201
   48    HG2  ARG   8           HG2      ARG   8 109.394   9.713  12.536
   49    HG3  ARG   8           HG1      ARG   8 111.075   9.862  12.036
   50    HD2  ARG   8           HD2      ARG   8 109.562  11.950  11.845
   51    HD3  ARG   8           HD1      ARG   8 110.593  11.550  10.485
   52    HE   ARG   8           HE       ARG   8 108.564  10.496   9.464
   53   HH11  ARG   8          HH21      ARG   8 108.259  12.886  11.965
   54   HH12  ARG   8          HH22      ARG   8 106.695  13.415  11.446
   55   HH21  ARG   8          HH11      ARG   8 106.521  11.202   8.790
   56   HH22  ARG   8          HH12      ARG   8 105.713  12.465   9.656
   57    H    ARG   9           HN       ARG   9 111.621   7.948   7.305
   58    HA   ARG   9           HA       ARG   9 111.061   5.090   7.850
   59    HB2  ARG   9           HB2      ARG   9 110.472   6.580   5.285
   60    HB3  ARG   9           HB1      ARG   9 110.142   4.877   5.611
   61    HG2  ARG   9           HG2      ARG   9 108.535   5.428   7.309
   62    HG3  ARG   9           HG1      ARG   9 108.987   7.131   7.263
   63    HD2  ARG   9           HD2      ARG   9 108.296   6.387   4.604
   64    HD3  ARG   9           HD1      ARG   9 107.038   5.751   5.657
   65    HE   ARG   9           HE       ARG   9 107.112   8.201   6.594
   66   HH11  ARG   9          HH21      ARG   9 107.513   7.157   3.314
   67   HH12  ARG   9          HH22      ARG   9 106.871   8.614   2.633
   68   HH21  ARG   9          HH11      ARG   9 106.269  10.103   5.703
   69   HH22  ARG   9          HH12      ARG   9 106.166  10.275   3.983
   70    H    ARG  10           HN       ARG  10 112.865   4.014   7.775
   71    HA   ARG  10           HA       ARG  10 115.354   4.584   7.050
   72    HB2  ARG  10           HB2      ARG  10 115.156   2.069   5.862
   73    HB3  ARG  10           HB1      ARG  10 115.518   2.394   7.551
   74    HG2  ARG  10           HG2      ARG  10 113.666   0.784   7.321
   75    HG3  ARG  10           HG1      ARG  10 113.119   2.256   8.106
   76    HD2  ARG  10           HD2      ARG  10 112.303   3.054   5.850
   77    HD3  ARG  10           HD1      ARG  10 112.724   1.475   5.206
   78    HE   ARG  10           HE       ARG  10 110.865   1.615   7.486
   79   HH11  ARG  10          HH21      ARG  10 111.492   1.071   4.117
   80   HH12  ARG  10          HH22      ARG  10 109.992   0.256   3.832
   81   HH21  ARG  10          HH11      ARG  10 108.901   0.552   7.107
   82   HH22  ARG  10          HH12      ARG  10 108.527  -0.039   5.522
   83    H    PHE  11           HN       PHE  11 113.239   3.069   4.589
   84    HA   PHE  11           HA       PHE  11 114.790   4.487   2.508
   85    HB2  PHE  11           HB2      PHE  11 113.468   1.797   2.608
   86    HB3  PHE  11           HB1      PHE  11 113.664   2.609   1.056
   87    HD1  PHE  11           HD2      PHE  11 115.943   3.263   0.265
   88    HD2  PHE  11           HD1      PHE  11 115.342   0.845   3.764
   89    HE1  PHE  11           HE2      PHE  11 118.314   2.549   0.177
   90    HE2  PHE  11           HE1      PHE  11 117.715   0.129   3.676
   91    HZ   PHE  11           HZ       PHE  11 119.201   0.981   1.881
   92    H    HIS  12           HN       HIS  12 113.479   4.819   0.451
   93    HA   HIS  12           HA       HIS  12 111.125   6.365   1.127
   94    HB2  HIS  12           HB2      HIS  12 111.867   5.930  -1.720
   95    HB3  HIS  12           HB1      HIS  12 111.450   7.423  -0.878
   96    HD2  HIS  12           HD2      HIS  12 114.614   4.992  -0.979
   97    HE1  HIS  12           HE1      HIS  12 115.896   8.914  -0.088
   98    HE2  HIS  12           HE2      HIS  12 116.671   6.538  -0.536
   99    H    ARG  13           HN       ARG  13 109.062   6.104   0.057
  100    HA   ARG  13           HA       ARG  13 108.435   3.262  -0.434
  101    HB2  ARG  13           HB2      ARG  13 106.145   5.074  -0.212
  102    HB3  ARG  13           HB1      ARG  13 106.499   3.597   0.678
  103    HG2  ARG  13           HG2      ARG  13 108.039   4.829   2.148
  104    HG3  ARG  13           HG1      ARG  13 107.727   6.312   1.245
  105    HD2  ARG  13           HD2      ARG  13 105.351   4.853   2.302
  106    HD3  ARG  13           HD1      ARG  13 106.366   5.687   3.474
  107    HE   ARG  13           HE       ARG  13 105.819   7.410   1.285
  108   HH11  ARG  13          HH21      ARG  13 104.353   5.892   4.026
  109   HH12  ARG  13          HH22      ARG  13 103.191   7.152   4.277
  110   HH21  ARG  13          HH11      ARG  13 104.298   9.064   1.605
  111   HH22  ARG  13          HH12      ARG  13 103.160   8.947   2.905
  112    H    ILE  14           HN       ILE  14 107.312   2.600  -2.237
  113    HA   ILE  14           HA       ILE  14 107.575   4.285  -4.589
  114    HB   ILE  14           HB       ILE  14 106.637   1.455  -4.130
  115   HG12  ILE  14          HG12      ILE  14 108.634   0.850  -5.312
  116   HG13  ILE  14          HG11      ILE  14 108.931   2.517  -5.798
  117   HG21  ILE  14          HG21      ILE  14 106.667   1.407  -6.718
  118   HG22  ILE  14          HG22      ILE  14 106.526   3.161  -6.612
  119   HG23  ILE  14          HG23      ILE  14 105.267   2.134  -5.928
  120   HD11  ILE  14          HD11      ILE  14 110.326   1.640  -3.837
  121   HD12  ILE  14          HD12      ILE  14 108.836   1.674  -2.896
  122   HD13  ILE  14          HD13      ILE  14 109.487   3.167  -3.574
  123    H    ALA  15           HN       ALA  15 106.064   5.899  -4.615
  124    HA   ALA  15           HA       ALA  15 103.301   5.248  -3.890
  125    HB1  ALA  15           HB1      ALA  15 102.999   7.758  -4.264
  126    HB2  ALA  15           HB2      ALA  15 104.757   7.831  -4.403
  127    HB3  ALA  15           HB3      ALA  15 104.014   7.268  -2.906
  128    H    PHE  16           HN       PHE  16 101.910   4.661  -5.310
  129    HA   PHE  16           HA       PHE  16 101.712   5.970  -7.887
  130    HB2  PHE  16           HB2      PHE  16 101.758   3.989  -9.224
  131    HB3  PHE  16           HB1      PHE  16 103.224   3.970  -8.251
  132    HD1  PHE  16           HD2      PHE  16 102.747   2.863  -5.770
  133    HD2  PHE  16           HD1      PHE  16 100.680   1.944  -9.422
  134    HE1  PHE  16           HE2      PHE  16 102.124   0.646  -4.865
  135    HE2  PHE  16           HE1      PHE  16 100.066  -0.278  -8.515
  136    HZ   PHE  16           HZ       PHE  16 100.797  -0.929  -6.236
  137    H    ASP  17           HN       ASP  17  99.556   5.507  -8.875
  138    HA   ASP  17           HA       ASP  17  97.636   5.044  -6.717
  139    HB2  ASP  17           HB2      ASP  17  96.151   5.754  -8.931
  140    HB3  ASP  17           HB1      ASP  17  96.758   6.875  -7.714
  141    H    ALA  18           HN       ALA  18  95.956   3.549  -6.852
  142    HA   ALA  18           HA       ALA  18  95.357   1.906  -9.033
  143    HB1  ALA  18           HB1      ALA  18  97.420   0.799  -7.123
  144    HB2  ALA  18           HB2      ALA  18  97.496   0.868  -8.883
  145    HB3  ALA  18           HB3      ALA  18  96.379  -0.244  -8.090
  146    H    ASP  19           HN       ASP  19  94.288  -0.254  -8.118
  147    HA   ASP  19           HA       ASP  19  92.489   0.674  -5.965
  148    HB2  ASP  19           HB2      ASP  19  91.613  -0.195  -8.195
  149    HB3  ASP  19           HB1      ASP  19  92.156  -1.791  -7.682
  150    H    SER  20           HN       SER  20  92.403  -0.247  -4.004
  151    HA   SER  20           HA       SER  20  93.800  -2.811  -3.567
  152    HB2  SER  20           HB2      SER  20  94.574  -1.787  -1.353
  153    HB3  SER  20           HB1      SER  20  95.416  -1.271  -2.812
  154    HG   SER  20           HG       SER  20  94.610   0.395  -1.251
  155    H    GLU  21           HN       GLU  21  93.068  -3.932  -1.654
  156    HA   GLU  21           HA       GLU  21  90.651  -2.903  -0.343
  157    HB2  GLU  21           HB2      GLU  21  89.393  -4.977  -0.738
  158    HB3  GLU  21           HB1      GLU  21  89.763  -4.163  -2.254
  159    HG2  GLU  21           HG2      GLU  21  90.412  -6.286  -2.832
  160    HG3  GLU  21           HG1      GLU  21  91.929  -5.725  -2.131
  161    H    ILE  22           HN       ILE  22  90.347  -3.700   1.700
  162    HA   ILE  22           HA       ILE  22  92.538  -5.441   2.690
  163    HB   ILE  22           HB       ILE  22  91.115  -3.158   4.067
  164   HG12  ILE  22          HG12      ILE  22  93.184  -3.041   2.226
  165   HG13  ILE  22          HG11      ILE  22  92.838  -1.814   3.440
  166   HG21  ILE  22          HG21      ILE  22  91.636  -4.854   5.695
  167   HG22  ILE  22          HG22      ILE  22  92.843  -3.579   5.860
  168   HG23  ILE  22          HG23      ILE  22  93.252  -5.079   5.029
  169   HD11  ILE  22          HD11      ILE  22  94.439  -2.776   4.972
  170   HD12  ILE  22          HD12      ILE  22  95.234  -2.591   3.412
  171   HD13  ILE  22          HD13      ILE  22  94.670  -4.180   3.928
  172    H    LEU  23           HN       LEU  23  92.081  -7.137   3.917
  173    HA   LEU  23           HA       LEU  23  89.250  -7.612   4.673
  174    HB2  LEU  23           HB2      LEU  23  91.119  -9.882   4.149
  175    HB3  LEU  23           HB1      LEU  23  89.371  -9.785   3.933
  176    HG   LEU  23           HG       LEU  23  90.058  -7.943   2.138
  177   HD11  LEU  23          HD11      LEU  23  92.167  -8.122   1.223
  178   HD12  LEU  23          HD12      LEU  23  92.349  -9.813   1.693
  179   HD13  LEU  23          HD13      LEU  23  92.545  -8.536   2.891
  180   HD21  LEU  23          HD21      LEU  23  90.331 -10.920   1.600
  181   HD22  LEU  23          HD22      LEU  23  89.916  -9.680   0.415
  182   HD23  LEU  23          HD23      LEU  23  88.795 -10.060   1.723
  183    H    GLN  24           HN       GLN  24  88.935  -7.769   6.726
  184    HA   GLN  24           HA       GLN  24  91.077  -8.858   8.471
  185    HB2  GLN  24           HB2      GLN  24  90.958  -6.394   8.701
  186    HB3  GLN  24           HB1      GLN  24  89.258  -6.530   9.144
  187    HG2  GLN  24           HG2      GLN  24  91.001  -8.297  10.727
  188    HG3  GLN  24           HG1      GLN  24  91.394  -6.591  10.920
  189   HE21  GLN  24          HE21      GLN  24  90.512  -6.555  13.119
  190   HE22  GLN  24          HE22      GLN  24  88.836  -6.617  13.389
  191    H    GLY  25           HN       GLY  25  90.209 -10.854   8.880
  192    HA2  GLY  25           HA2      GLY  25  88.873 -12.313  10.096
  193    HA3  GLY  25           HA1      GLY  25  87.826 -10.959  10.525
  194    H    GLU  26           HN       GLU  26  85.828 -11.304   9.782
  195    HA   GLU  26           HA       GLU  26  85.451 -12.707   7.216
  196    HB2  GLU  26           HB2      GLU  26  83.228 -13.156   7.944
  197    HB3  GLU  26           HB1      GLU  26  84.248 -13.424   9.352
  198    HG2  GLU  26           HG2      GLU  26  83.760 -11.043  10.046
  199    HG3  GLU  26           HG1      GLU  26  82.544 -11.000   8.769
  200    H    ARG  27           HN       ARG  27  86.105  -9.719   8.006
  201    HA   ARG  27           HA       ARG  27  83.932  -8.467   6.442
  202    HB2  ARG  27           HB2      ARG  27  85.901  -7.001   8.167
  203    HB3  ARG  27           HB1      ARG  27  84.282  -6.516   7.671
  204    HG2  ARG  27           HG2      ARG  27  84.042  -8.996   9.087
  205    HG3  ARG  27           HG1      ARG  27  85.060  -7.930  10.050
  206    HD2  ARG  27           HD2      ARG  27  83.229  -6.143   9.531
  207    HD3  ARG  27           HD1      ARG  27  82.225  -7.543   9.153
  208    HE   ARG  27           HE       ARG  27  83.426  -8.002  11.645
  209   HH11  ARG  27          HH21      ARG  27  81.187  -5.851  10.116
  210   HH12  ARG  27          HH22      ARG  27  80.294  -5.527  11.564
  211   HH21  ARG  27          HH11      ARG  27  82.263  -7.578  13.550
  212   HH22  ARG  27          HH12      ARG  27  80.903  -6.506  13.509
  213    H    ARG  28           HN       ARG  28  84.353  -7.544   4.544
  214    HA   ARG  28           HA       ARG  28  87.161  -6.916   3.837
  215    HB2  ARG  28           HB2      ARG  28  86.438  -8.954   2.640
  216    HB3  ARG  28           HB1      ARG  28  85.033  -8.091   2.016
  217    HG2  ARG  28           HG2      ARG  28  86.537  -6.476   0.886
  218    HG3  ARG  28           HG1      ARG  28  87.932  -7.371   1.484
  219    HD2  ARG  28           HD2      ARG  28  87.153  -9.380   0.276
  220    HD3  ARG  28           HD1      ARG  28  85.770  -8.473  -0.327
  221    HE   ARG  28           HE       ARG  28  88.547  -7.641  -0.954
  222   HH11  ARG  28          HH21      ARG  28  85.322  -8.515  -1.902
  223   HH12  ARG  28          HH22      ARG  28  85.559  -8.090  -3.563
  224   HH21  ARG  28          HH11      ARG  28  88.847  -7.093  -3.126
  225   HH22  ARG  28          HH12      ARG  28  87.548  -7.288  -4.255
  226    H    TRP  29           HN       TRP  29  87.481  -5.136   2.565
  227    HA   TRP  29           HA       TRP  29  85.197  -3.436   1.887
  228    HB2  TRP  29           HB2      TRP  29  87.488  -2.577   3.655
  229    HB3  TRP  29           HB1      TRP  29  86.213  -1.519   3.051
  230    HD1  TRP  29           HD1      TRP  29  83.613  -2.404   3.800
  231    HE1  TRP  29           HE1      TRP  29  82.889  -3.235   6.122
  232    HE3  TRP  29           HE3      TRP  29  88.159  -3.695   5.745
  233    HZ2  TRP  29           HZ2      TRP  29  84.071  -4.295   8.495
  234    HZ3  TRP  29           HZ3      TRP  29  88.319  -4.614   8.043
  235    HH2  TRP  29           HH2      TRP  29  86.289  -4.916   9.419
  236    H    GLU  30           HN       GLU  30  85.763  -1.713   0.440
  237    HA   GLU  30           HA       GLU  30  88.158  -2.352  -1.127
  238    HB2  GLU  30           HB2      GLU  30  86.037  -0.450  -2.064
  239    HB3  GLU  30           HB1      GLU  30  87.074  -1.529  -3.000
  240    HG2  GLU  30           HG2      GLU  30  84.945  -2.566  -3.051
  241    HG3  GLU  30           HG1      GLU  30  85.842  -3.456  -1.822
  242    H    VAL  31           HN       VAL  31  89.746  -0.737  -1.494
  243    HA   VAL  31           HA       VAL  31  89.273   2.016  -0.587
  244    HB   VAL  31           HB       VAL  31  91.146   2.045   0.918
  245   HG11  VAL  31          HG11      VAL  31  88.922   1.227   1.770
  246   HG12  VAL  31          HG12      VAL  31  90.306   0.657   2.701
  247   HG13  VAL  31          HG13      VAL  31  89.510  -0.422   1.558
  248   HG21  VAL  31          HG21      VAL  31  92.658   0.505  -0.131
  249   HG22  VAL  31          HG22      VAL  31  91.512  -0.823   0.026
  250   HG23  VAL  31          HG23      VAL  31  92.292  -0.159   1.460
  251    H    LEU  32           HN       LEU  32  90.908   3.477  -1.254
  252    HA   LEU  32           HA       LEU  32  92.280   2.606  -3.709
  253    HB2  LEU  32           HB2      LEU  32  91.091   4.590  -4.143
  254    HB3  LEU  32           HB1      LEU  32  91.416   5.256  -2.547
  255    HG   LEU  32           HG       LEU  32  93.768   5.632  -3.158
  256   HD11  LEU  32          HD11      LEU  32  92.904   4.277  -5.717
  257   HD12  LEU  32          HD12      LEU  32  94.267   3.877  -4.677
  258   HD13  LEU  32          HD13      LEU  32  94.312   5.337  -5.658
  259   HD21  LEU  32          HD21      LEU  32  91.890   6.657  -5.309
  260   HD22  LEU  32          HD22      LEU  32  93.405   7.403  -4.797
  261   HD23  LEU  32          HD23      LEU  32  92.030   7.350  -3.693
  262    H    LEU  33           HN       LEU  33  94.442   2.286  -3.682
  263    HA   LEU  33           HA       LEU  33  95.860   2.780  -1.172
  264    HB2  LEU  33           HB2      LEU  33  96.344   0.630  -1.919
  265    HB3  LEU  33           HB1      LEU  33  96.372   1.103  -3.614
  266    HG   LEU  33           HG       LEU  33  98.429   2.204  -1.701
  267   HD11  LEU  33          HD11      LEU  33  99.808   0.172  -2.752
  268   HD12  LEU  33          HD12      LEU  33  98.212  -0.574  -2.785
  269   HD13  LEU  33          HD13      LEU  33  98.890  -0.014  -1.257
  270   HD21  LEU  33          HD21      LEU  33  99.576   1.615  -4.181
  271   HD22  LEU  33          HD22      LEU  33  99.022   3.200  -3.652
  272   HD23  LEU  33          HD23      LEU  33  97.955   2.169  -4.599
  273    H    HIS  34           HN       HIS  34  97.136   4.437  -0.866
  274    HA   HIS  34           HA       HIS  34  97.687   6.221  -3.117
  275    HB2  HIS  34           HB2      HIS  34  97.818   6.496  -0.114
  276    HB3  HIS  34           HB1      HIS  34  98.436   7.752  -1.196
  277    HD2  HIS  34           HD2      HIS  34  94.950   5.895  -0.657
  278    HE1  HIS  34           HE1      HIS  34  94.231   9.779  -2.129
  279    HE2  HIS  34           HE2      HIS  34  93.130   7.651  -1.299
  280    H    ASP  35           HN       ASP  35  99.468   4.077  -0.967
  281    HA   ASP  35           HA       ASP  35 101.611   4.108  -2.753
  282    HB2  ASP  35           HB2      ASP  35 103.347   5.349  -1.641
  283    HB3  ASP  35           HB1      ASP  35 101.931   6.403  -1.632
  284    H    VAL  36           HN       VAL  36 103.444   2.800  -2.081
  285    HA   VAL  36           HA       VAL  36 102.979   1.135   0.284
  286    HB   VAL  36           HB       VAL  36 101.827   0.140  -1.768
  287   HG11  VAL  36          HG11      VAL  36 103.747   0.838  -3.291
  288   HG12  VAL  36          HG12      VAL  36 103.184  -0.823  -3.487
  289   HG13  VAL  36          HG13      VAL  36 104.666  -0.493  -2.593
  290   HG21  VAL  36          HG21      VAL  36 102.421  -2.075  -1.157
  291   HG22  VAL  36          HG22      VAL  36 102.694  -1.125   0.298
  292   HG23  VAL  36          HG23      VAL  36 104.058  -1.601  -0.711
  293    H    SER  37           HN       SER  37 104.805  -0.463   0.555
  294    HA   SER  37           HA       SER  37 107.361   0.456  -0.539
  295    HB2  SER  37           HB2      SER  37 106.955   1.610   1.682
  296    HB3  SER  37           HB1      SER  37 106.919   0.015   2.426
  297    HG   SER  37           HG       SER  37 109.045   1.213   0.971
  298    H    LEU  38           HN       LEU  38 109.096  -1.206   0.192
  299    HA   LEU  38           HA       LEU  38 108.140  -3.766  -0.572
  300    HB2  LEU  38           HB2      LEU  38 110.524  -4.486   0.187
  301    HB3  LEU  38           HB1      LEU  38 110.371  -3.387  -1.180
  302    HG   LEU  38           HG       LEU  38 110.680  -1.464   0.423
  303   HD11  LEU  38          HD11      LEU  38 111.855  -2.219   2.606
  304   HD12  LEU  38          HD12      LEU  38 111.093  -3.781   2.310
  305   HD13  LEU  38          HD13      LEU  38 110.098  -2.341   2.535
  306   HD21  LEU  38          HD21      LEU  38 112.527  -2.505  -0.947
  307   HD22  LEU  38          HD22      LEU  38 112.949  -3.468   0.467
  308   HD23  LEU  38          HD23      LEU  38 113.078  -1.711   0.528
  309    H    HIS  39           HN       HIS  39 107.694  -2.243   2.293
  310    HA   HIS  39           HA       HIS  39 106.982  -4.702   3.614
  311    HB2  HIS  39           HB2      HIS  39 109.566  -4.136   3.984
  312    HB3  HIS  39           HB1      HIS  39 108.900  -3.087   5.234
  313    HD2  HIS  39           HD2      HIS  39 107.020  -4.642   7.022
  314    HE1  HIS  39           HE1      HIS  39 109.191  -8.209   6.396
  315    HE2  HIS  39           HE2      HIS  39 107.446  -7.081   7.855
  316    H    GLY  40           HN       GLY  40 105.617  -2.294   2.785
  317    HA2  GLY  40           HA2      GLY  40 104.122  -1.774   5.161
  318    HA3  GLY  40           HA1      GLY  40 105.154  -0.407   4.763
  319    H    ILE  41           HN       ILE  41 102.248  -0.406   4.743
  320    HA   ILE  41           HA       ILE  41 101.837   0.475   1.963
  321    HB   ILE  41           HB       ILE  41 100.712  -1.353   1.348
  322   HG12  ILE  41          HG12      ILE  41  98.824  -0.791   3.659
  323   HG13  ILE  41          HG11      ILE  41  98.760   0.027   2.096
  324   HG21  ILE  41          HG21      ILE  41 100.336  -3.243   2.861
  325   HG22  ILE  41          HG22      ILE  41 100.737  -2.230   4.248
  326   HG23  ILE  41          HG23      ILE  41 101.969  -2.618   3.047
  327   HD11  ILE  41          HD11      ILE  41  98.444  -2.146   0.972
  328   HD12  ILE  41          HD12      ILE  41  97.168  -1.841   2.150
  329   HD13  ILE  41          HD13      ILE  41  98.478  -2.956   2.538
  330    H    LEU  42           HN       LEU  42 100.193   1.871   1.595
  331    HA   LEU  42           HA       LEU  42  98.868   3.047   3.969
  332    HB2  LEU  42           HB2      LEU  42 100.765   4.303   2.395
  333    HB3  LEU  42           HB1      LEU  42  99.255   4.839   1.665
  334    HG   LEU  42           HG       LEU  42  99.740   4.978   4.644
  335   HD11  LEU  42          HD11      LEU  42 101.424   6.305   3.211
  336   HD12  LEU  42          HD12      LEU  42 100.519   7.214   4.419
  337   HD13  LEU  42          HD13      LEU  42 100.045   7.289   2.724
  338   HD21  LEU  42          HD21      LEU  42  97.456   5.377   3.039
  339   HD22  LEU  42          HD22      LEU  42  98.017   6.993   3.460
  340   HD23  LEU  42          HD23      LEU  42  97.654   5.829   4.732
  341    H    VAL  43           HN       VAL  43  96.679   3.497   3.723
  342    HA   VAL  43           HA       VAL  43  95.472   3.263   1.060
  343    HB   VAL  43           HB       VAL  43  93.877   1.602   1.699
  344   HG11  VAL  43          HG11      VAL  43  95.320  -0.316   1.907
  345   HG12  VAL  43          HG12      VAL  43  96.593   0.657   2.641
  346   HG13  VAL  43          HG13      VAL  43  96.172   0.891   0.944
  347   HG21  VAL  43          HG21      VAL  43  94.166   2.454   4.265
  348   HG22  VAL  43          HG22      VAL  43  95.152   0.996   4.323
  349   HG23  VAL  43          HG23      VAL  43  93.457   0.899   3.846
  350    H    GLY  44           HN       GLY  44  93.014   3.578   1.297
  351    HA2  GLY  44           HA2      GLY  44  92.617   6.005   2.953
  352    HA3  GLY  44           HA1      GLY  44  91.632   5.534   1.564
  353    H    GLN  45           HN       GLN  45  90.867   6.127   4.483
  354    HA   GLN  45           HA       GLN  45  90.041   3.568   5.498
  355    HB2  GLN  45           HB2      GLN  45  90.781   5.378   6.980
  356    HB3  GLN  45           HB1      GLN  45  89.419   6.363   6.450
  357    HG2  GLN  45           HG2      GLN  45  87.835   4.957   7.470
  358    HG3  GLN  45           HG1      GLN  45  88.958   3.603   7.568
  359   HE21  GLN  45          HE21      GLN  45  88.059   3.802   9.952
  360   HE22  GLN  45          HE22      GLN  45  88.967   4.786  10.995
  361    HA   PRO  46           HA       PRO  46  86.098   4.303   3.408
  362    HB2  PRO  46           HB2      PRO  46  85.156   1.759   3.327
  363    HB3  PRO  46           HB1      PRO  46  86.524   2.255   2.304
  364    HG2  PRO  46           HG2      PRO  46  86.544   0.758   4.888
  365    HG3  PRO  46           HG1      PRO  46  87.516   0.496   3.431
  366    HD2  PRO  46           HD2      PRO  46  88.398   1.892   5.691
  367    HD3  PRO  46           HD1      PRO  46  89.101   2.045   4.067
  368    H    GLN  47           HN       GLN  47  83.779   4.104   4.039
  369    HA   GLN  47           HA       GLN  47  83.373   4.666   6.778
  370    HB2  GLN  47           HB2      GLN  47  81.254   3.864   4.780
  371    HB3  GLN  47           HB1      GLN  47  81.046   4.841   6.235
  372    HG2  GLN  47           HG2      GLN  47  82.521   6.574   5.292
  373    HG3  GLN  47           HG1      GLN  47  82.736   5.604   3.835
  374   HE21  GLN  47          HE21      GLN  47  81.732   7.897   3.079
  375   HE22  GLN  47          HE22      GLN  47  80.044   7.887   2.899
  376    H    ASP  48           HN       ASP  48  82.766   1.728   4.877
  377    HA   ASP  48           HA       ASP  48  81.436   0.338   6.991
  378    HB2  ASP  48           HB2      ASP  48  82.558  -0.426   4.322
  379    HB3  ASP  48           HB1      ASP  48  82.083  -1.687   5.458
  380    H    TRP  49           HN       TRP  49  84.455   1.384   7.095
  381    HA   TRP  49           HA       TRP  49  86.101  -0.831   7.604
  382    HB2  TRP  49           HB2      TRP  49  86.861   1.529   7.346
  383    HB3  TRP  49           HB1      TRP  49  86.231   1.864   8.956
  384    HD1  TRP  49           HD1      TRP  49  87.551   0.981  10.993
  385    HE1  TRP  49           HE1      TRP  49  89.952  -0.030  11.268
  386    HE3  TRP  49           HE3      TRP  49  88.496  -0.144   6.162
  387    HZ2  TRP  49           HZ2      TRP  49  92.023  -1.200   9.492
  388    HZ3  TRP  49           HZ3      TRP  49  90.616  -1.201   5.464
  389    HH2  TRP  49           HH2      TRP  49  92.349  -1.733   7.138
  390    H    ASN  50           HN       ASN  50  84.237  -2.082   8.775
  391    HA   ASN  50           HA       ASN  50  84.137  -1.391  11.630
  392    HB2  ASN  50           HB2      ASN  50  82.028  -2.053  10.461
  393    HB3  ASN  50           HB1      ASN  50  82.727  -3.644  10.175
  394   HD21  ASN  50          HD21      ASN  50  83.904  -4.352  12.532
  395   HD22  ASN  50          HD22      ASN  50  82.788  -4.328  13.810
  396    H    GLY  51           HN       GLY  51  86.443  -1.840  11.881
  397    HA2  GLY  51           HA2      GLY  51  86.897  -4.688  12.460
  398    HA3  GLY  51           HA1      GLY  51  88.041  -3.862  11.407
  399    H    ASP  52           HN       ASP  52  88.277  -5.067  14.144
  400    HA   ASP  52           HA       ASP  52  88.732  -2.892  15.964
  401    HB2  ASP  52           HB2      ASP  52  88.118  -5.330  16.515
  402    HB3  ASP  52           HB1      ASP  52  89.829  -5.674  16.273
  403    HA   PRO  53           HA       PRO  53  92.721  -1.835  14.080
  404    HB2  PRO  53           HB2      PRO  53  92.996  -0.425  16.698
  405    HB3  PRO  53           HB1      PRO  53  93.269   0.189  15.055
  406    HG2  PRO  53           HG2      PRO  53  91.089   0.837  16.443
  407    HG3  PRO  53           HG1      PRO  53  91.040   0.590  14.689
  408    HD2  PRO  53           HD2      PRO  53  90.015  -1.178  16.863
  409    HD3  PRO  53           HD1      PRO  53  89.431  -0.971  15.198
  410    H    GLN  54           HN       GLN  54  92.138  -3.313  17.163
  411    HA   GLN  54           HA       GLN  54  94.903  -3.809  17.742
  412    HB2  GLN  54           HB2      GLN  54  92.511  -5.201  18.948
  413    HB3  GLN  54           HB1      GLN  54  94.120  -5.027  19.650
  414    HG2  GLN  54           HG2      GLN  54  92.139  -2.802  19.092
  415    HG3  GLN  54           HG1      GLN  54  92.638  -3.393  20.676
  416   HE21  GLN  54          HE21      GLN  54  95.471  -3.638  20.126
  417   HE22  GLN  54          HE22      GLN  54  96.090  -2.071  19.919
  418    H    ARG  55           HN       ARG  55  92.451  -5.448  15.906
  419    HA   ARG  55           HA       ARG  55  94.001  -7.938  15.885
  420    HB2  ARG  55           HB2      ARG  55  91.250  -7.147  14.982
  421    HB3  ARG  55           HB1      ARG  55  92.014  -8.551  14.240
  422    HG2  ARG  55           HG2      ARG  55  92.389  -9.528  16.483
  423    HG3  ARG  55           HG1      ARG  55  91.592  -8.135  17.214
  424    HD2  ARG  55           HD2      ARG  55  90.220  -9.818  15.119
  425    HD3  ARG  55           HD1      ARG  55  90.156 -10.241  16.826
  426    HE   ARG  55           HE       ARG  55  89.423  -7.554  16.627
  427   HH11  ARG  55          HH21      ARG  55  88.345 -10.659  15.546
  428   HH12  ARG  55          HH22      ARG  55  86.670 -10.219  15.513
  429   HH21  ARG  55          HH11      ARG  55  87.230  -6.970  16.589
  430   HH22  ARG  55          HH12      ARG  55  86.038  -8.130  16.104
  431    HA   PRO  56           HA       PRO  56  96.182  -7.067  12.219
  432    HB2  PRO  56           HB2      PRO  56  96.201  -9.550  10.992
  433    HB3  PRO  56           HB1      PRO  56  97.247  -9.093  12.350
  434    HG2  PRO  56           HG2      PRO  56  94.707 -10.650  12.360
  435    HG3  PRO  56           HG1      PRO  56  96.188 -10.895  13.304
  436    HD2  PRO  56           HD2      PRO  56  93.976  -9.738  14.375
  437    HD3  PRO  56           HD1      PRO  56  95.619  -9.277  14.872
  438    H    PHE  57           HN       PHE  57  96.113  -6.955   9.915
  439    HA   PHE  57           HA       PHE  57  93.429  -7.252   8.702
  440    HB2  PHE  57           HB2      PHE  57  95.331  -4.910   8.382
  441    HB3  PHE  57           HB1      PHE  57  93.818  -5.123   7.508
  442    HD1  PHE  57           HD1      PHE  57  95.221  -4.844  10.970
  443    HD2  PHE  57           HD2      PHE  57  91.789  -4.352   8.438
  444    HE1  PHE  57           HE1      PHE  57  93.986  -3.772  12.837
  445    HE2  PHE  57           HE2      PHE  57  90.558  -3.296  10.304
  446    HZ   PHE  57           HZ       PHE  57  91.650  -3.009  12.504
  447    H    GLU  58           HN       GLU  58  93.547  -7.591   6.329
  448    HA   GLU  58           HA       GLU  58  96.257  -8.337   5.403
  449    HB2  GLU  58           HB2      GLU  58  93.767  -9.714   4.393
  450    HB3  GLU  58           HB1      GLU  58  95.441 -10.264   4.301
  451    HG2  GLU  58           HG2      GLU  58  95.370 -10.274   6.888
  452    HG3  GLU  58           HG1      GLU  58  93.619 -10.188   6.706
  453    H    ALA  59           HN       ALA  59  96.840  -7.586   3.326
  454    HA   ALA  59           HA       ALA  59  94.807  -5.888   1.991
  455    HB1  ALA  59           HB1      ALA  59  97.348  -5.061   1.183
  456    HB2  ALA  59           HB2      ALA  59  97.520  -5.400   2.902
  457    HB3  ALA  59           HB3      ALA  59  96.303  -4.254   2.349
  458    H    ARG  60           HN       ARG  60  94.428  -6.157  -0.105
  459    HA   ARG  60           HA       ARG  60  96.212  -7.932  -1.676
  460    HB2  ARG  60           HB2      ARG  60  93.207  -7.639  -1.947
  461    HB3  ARG  60           HB1      ARG  60  94.244  -8.672  -2.924
  462    HG2  ARG  60           HG2      ARG  60  94.716  -9.214  -0.122
  463    HG3  ARG  60           HG1      ARG  60  92.993  -9.324  -0.463
  464    HD2  ARG  60           HD2      ARG  60  93.521 -10.822  -2.397
  465    HD3  ARG  60           HD1      ARG  60  95.212 -10.794  -1.904
  466    HE   ARG  60           HE       ARG  60  94.667 -12.336  -0.270
  467   HH11  ARG  60          HH21      ARG  60  91.855 -10.579  -1.259
  468   HH12  ARG  60          HH22      ARG  60  90.766 -11.496  -0.273
  469   HH21  ARG  60          HH11      ARG  60  93.243 -13.544   1.023
  470   HH22  ARG  60          HH12      ARG  60  91.552 -13.175   1.018
  471    H    LEU  61           HN       LEU  61  97.063  -6.892  -3.433
  472    HA   LEU  61           HA       LEU  61  95.807  -4.329  -4.223
  473    HB2  LEU  61           HB2      LEU  61  98.662  -5.305  -4.336
  474    HB3  LEU  61           HB1      LEU  61  98.115  -3.878  -5.211
  475    HG   LEU  61           HG       LEU  61  97.261  -2.955  -3.029
  476   HD11  LEU  61          HD11      LEU  61  97.003  -4.641  -1.484
  477   HD12  LEU  61          HD12      LEU  61  98.642  -4.161  -1.059
  478   HD13  LEU  61          HD13      LEU  61  98.377  -5.564  -2.092
  479   HD21  LEU  61          HD21      LEU  61  99.544  -2.389  -2.178
  480   HD22  LEU  61          HD22      LEU  61  99.407  -2.218  -3.928
  481   HD23  LEU  61          HD23      LEU  61 100.214  -3.628  -3.239
  482    H    TYR  62           HN       TYR  62  95.646  -3.793  -6.424
  483    HA   TYR  62           HA       TYR  62  96.013  -6.021  -8.329
  484    HB2  TYR  62           HB2      TYR  62  93.654  -4.146  -8.475
  485    HB3  TYR  62           HB1      TYR  62  93.888  -5.681  -9.309
  486    HD1  TYR  62           HD2      TYR  62  93.707  -7.822  -8.085
  487    HD2  TYR  62           HD1      TYR  62  92.896  -4.054  -6.192
  488    HE1  TYR  62           HE2      TYR  62  92.562  -9.000  -6.227
  489    HE2  TYR  62           HE1      TYR  62  91.750  -5.231  -4.337
  490    HH   TYR  62           HH       TYR  62  90.979  -8.602  -4.500
  491    H    LEU  63           HN       LEU  63  97.557  -5.329  -9.666
  492    HA   LEU  63           HA       LEU  63  97.564  -2.504 -10.536
  493    HB2  LEU  63           HB2      LEU  63  99.648  -3.731  -9.517
  494    HB3  LEU  63           HB1      LEU  63  99.787  -4.451 -11.117
  495    HG   LEU  63           HG       LEU  63  99.717  -1.483 -10.495
  496   HD11  LEU  63          HD11      LEU  63 101.833  -3.086 -10.140
  497   HD12  LEU  63          HD12      LEU  63 102.003  -1.455 -10.786
  498   HD13  LEU  63          HD13      LEU  63 101.991  -2.838 -11.880
  499   HD21  LEU  63          HD21      LEU  63  99.711  -3.048 -13.079
  500   HD22  LEU  63          HD22      LEU  63 100.366  -1.413 -13.010
  501   HD23  LEU  63          HD23      LEU  63  98.674  -1.701 -12.607
  502    H    GLY  64           HN       GLY  64  98.923  -5.295 -12.222
  503    HA2  GLY  64           HA2      GLY  64  97.669  -4.517 -14.699
  504    HA3  GLY  64           HA1      GLY  64  98.681  -5.940 -14.439
  505    H    LEU  65           HN       LEU  65  96.622  -6.585 -15.951
  506    HA   LEU  65           HA       LEU  65  94.243  -7.120 -14.457
  507    HB2  LEU  65           HB2      LEU  65  95.169  -8.187 -17.141
  508    HB3  LEU  65           HB1      LEU  65  93.565  -8.452 -16.463
  509    HG   LEU  65           HG       LEU  65  93.486  -6.584 -18.030
  510   HD11  LEU  65          HD11      LEU  65  92.329  -6.557 -15.643
  511   HD12  LEU  65          HD12      LEU  65  92.247  -5.149 -16.700
  512   HD13  LEU  65          HD13      LEU  65  93.412  -5.191 -15.377
  513   HD21  LEU  65          HD21      LEU  65  94.933  -4.760 -17.999
  514   HD22  LEU  65          HD22      LEU  65  96.019  -6.052 -17.493
  515   HD23  LEU  65          HD23      LEU  65  95.325  -4.961 -16.293
  516    H    ASP  66           HN       ASP  66  97.178  -8.920 -15.239
  517    HA   ASP  66           HA       ASP  66  96.165 -11.387 -13.984
  518    HB2  ASP  66           HB2      ASP  66  98.733 -10.845 -15.457
  519    HB3  ASP  66           HB1      ASP  66  98.047 -12.409 -15.022
  520    H    VAL  67           HN       VAL  67  97.418  -8.612 -12.862
  521    HA   VAL  67           HA       VAL  67  99.486  -9.886 -11.184
  522    HB   VAL  67           HB       VAL  67  98.979  -7.046 -12.019
  523   HG11  VAL  67          HG11      VAL  67  99.325  -6.588  -9.754
  524   HG12  VAL  67          HG12      VAL  67 100.985  -6.627 -10.343
  525   HG13  VAL  67          HG13      VAL  67 100.314  -8.029  -9.508
  526   HG21  VAL  67          HG21      VAL  67 100.515  -8.728 -13.225
  527   HG22  VAL  67          HG22      VAL  67 101.571  -8.595 -11.816
  528   HG23  VAL  67          HG23      VAL  67 101.224  -7.170 -12.799
  529    H    LEU  68           HN       LEU  68  98.299 -10.899  -9.666
  530    HA   LEU  68           HA       LEU  68  96.621  -9.221  -7.899
  531    HB2  LEU  68           HB2      LEU  68  95.208 -10.960  -8.521
  532    HB3  LEU  68           HB1      LEU  68  96.531 -12.106  -8.715
  533    HG   LEU  68           HG       LEU  68  96.802 -12.197  -6.253
  534   HD11  LEU  68          HD11      LEU  68  94.314 -10.461  -6.209
  535   HD12  LEU  68          HD12      LEU  68  95.930  -9.900  -5.790
  536   HD13  LEU  68          HD13      LEU  68  95.141 -11.128  -4.804
  537   HD21  LEU  68          HD21      LEU  68  95.230 -13.727  -7.519
  538   HD22  LEU  68          HD22      LEU  68  93.913 -12.654  -7.042
  539   HD23  LEU  68          HD23      LEU  68  94.835 -13.518  -5.811
  540    H    ILE  69           HN       ILE  69  97.681  -8.599  -6.103
  541    HA   ILE  69           HA       ILE  69  99.820 -10.374  -5.071
  542    HB   ILE  69           HB       ILE  69  99.558  -7.367  -5.018
  543   HG12  ILE  69          HG12      ILE  69 102.039  -8.709  -5.930
  544   HG13  ILE  69          HG11      ILE  69 100.626  -9.052  -6.925
  545   HG21  ILE  69          HG21      ILE  69 100.569  -7.572  -2.975
  546   HG22  ILE  69          HG22      ILE  69 102.010  -7.879  -3.944
  547   HG23  ILE  69          HG23      ILE  69 101.086  -9.227  -3.284
  548   HD11  ILE  69          HD11      ILE  69 101.645  -7.094  -7.850
  549   HD12  ILE  69          HD12      ILE  69 101.797  -6.342  -6.262
  550   HD13  ILE  69          HD13      ILE  69 100.206  -6.543  -6.995
  551    H    ARG  70           HN       ARG  70  99.955 -10.806  -2.905
  552    HA   ARG  70           HA       ARG  70  97.762  -9.813  -1.188
  553    HB2  ARG  70           HB2      ARG  70  97.651 -12.079  -0.160
  554    HB3  ARG  70           HB1      ARG  70  97.179 -12.079  -1.859
  555    HG2  ARG  70           HG2      ARG  70  99.638 -12.656  -2.365
  556    HG3  ARG  70           HG1      ARG  70  99.779 -13.021  -0.644
  557    HD2  ARG  70           HD2      ARG  70  98.052 -14.704  -0.794
  558    HD3  ARG  70           HD1      ARG  70  97.688 -14.252  -2.457
  559    HE   ARG  70           HE       ARG  70  99.892 -15.903  -1.558
  560   HH11  ARG  70          HH21      ARG  70  98.625 -13.820  -4.015
  561   HH12  ARG  70          HH22      ARG  70  99.615 -14.476  -5.276
  562   HH21  ARG  70          HH11      ARG  70 101.191 -16.767  -3.207
  563   HH22  ARG  70          HH12      ARG  70 101.068 -16.144  -4.818
  564    H    MET  71           HN       MET  71  98.377  -9.044   0.717
  565    HA   MET  71           HA       MET  71 100.959  -9.872   1.880
  566    HB2  MET  71           HB2      MET  71 100.277  -6.968   2.014
  567    HB3  MET  71           HB1      MET  71 101.852  -7.757   1.997
  568    HG2  MET  71           HG2      MET  71 101.132  -8.410  -0.470
  569    HG3  MET  71           HG1      MET  71 100.079  -7.008  -0.301
  570    HE1  MET  71           HE1      MET  71 101.117  -4.975   1.173
  571    HE2  MET  71           HE2      MET  71 102.720  -4.310   0.867
  572    HE3  MET  71           HE3      MET  71 102.531  -5.645   1.997
  573    H    GLU  72           HN       GLU  72 101.027  -9.697   4.133
  574    HA   GLU  72           HA       GLU  72  98.391  -9.338   5.382
  575    HB2  GLU  72           HB2      GLU  72  99.683 -11.508   5.709
  576    HB3  GLU  72           HB1      GLU  72 100.853 -10.577   6.639
  577    HG2  GLU  72           HG2      GLU  72  99.442 -11.279   8.343
  578    HG3  GLU  72           HG1      GLU  72  98.688  -9.742   7.924
  579    H    ILE  73           HN       ILE  73  98.109  -7.581   6.822
  580    HA   ILE  73           HA       ILE  73 100.559  -6.209   7.702
  581    HB   ILE  73           HB       ILE  73  99.904  -4.127   6.819
  582   HG12  ILE  73          HG12      ILE  73  97.219  -5.453   6.314
  583   HG13  ILE  73          HG11      ILE  73  97.545  -4.116   7.409
  584   HG21  ILE  73          HG21      ILE  73  99.080  -6.190   4.758
  585   HG22  ILE  73          HG22      ILE  73 100.753  -5.819   5.172
  586   HG23  ILE  73          HG23      ILE  73  99.730  -4.584   4.445
  587   HD11  ILE  73          HD11      ILE  73  96.935  -4.039   4.586
  588   HD12  ILE  73          HD12      ILE  73  98.491  -3.268   4.885
  589   HD13  ILE  73          HD13      ILE  73  97.050  -2.706   5.726
  590    H    SER  74           HN       SER  74 100.264  -4.704   9.425
  591    HA   SER  74           HA       SER  74  97.761  -5.041  10.995
  592    HB2  SER  74           HB2      SER  74  99.335  -6.201  12.286
  593    HB3  SER  74           HB1      SER  74 100.646  -5.109  11.847
  594    HG   SER  74           HG       SER  74  99.073  -5.000  13.962
  595    H    LEU  75           HN       LEU  75  97.138  -3.215  12.308
  596    HA   LEU  75           HA       LEU  75  97.365  -0.736  10.970
  597    HB2  LEU  75           HB2      LEU  75  95.576  -1.685  12.664
  598    HB3  LEU  75           HB1      LEU  75  96.602  -0.909  13.863
  599    HG   LEU  75           HG       LEU  75  94.938   0.699  13.249
  600   HD11  LEU  75          HD11      LEU  75  96.251   2.520  12.502
  601   HD12  LEU  75          HD12      LEU  75  97.307   1.477  11.556
  602   HD13  LEU  75          HD13      LEU  75  97.383   1.445  13.318
  603   HD21  LEU  75          HD21      LEU  75  95.690   0.490  10.338
  604   HD22  LEU  75          HD22      LEU  75  94.247   1.198  11.059
  605   HD23  LEU  75          HD23      LEU  75  94.448  -0.551  11.035
  606    H    ALA  76           HN       ALA  76  99.004   0.603  10.933
  607    HA   ALA  76           HA       ALA  76 100.933   0.577  13.141
  608    HB1  ALA  76           HB1      ALA  76 102.341   1.959  11.539
  609    HB2  ALA  76           HB2      ALA  76 101.145   1.575  10.302
  610    HB3  ALA  76           HB3      ALA  76 102.067   0.286  11.070
  611    H    TRP  77           HN       TRP  77  98.838   2.704  11.266
  612    HA   TRP  77           HA       TRP  77  98.374   4.439  13.509
  613    HB2  TRP  77           HB2      TRP  77  99.443   6.469  12.597
  614    HB3  TRP  77           HB1      TRP  77 100.652   5.212  12.866
  615    HD1  TRP  77           HD1      TRP  77 101.790   4.132  10.798
  616    HE1  TRP  77           HE1      TRP  77 101.667   4.539   8.269
  617    HE3  TRP  77           HE3      TRP  77  97.943   7.487  10.610
  618    HZ2  TRP  77           HZ2      TRP  77 100.322   6.215   6.445
  619    HZ3  TRP  77           HZ3      TRP  77  97.261   8.479   8.441
  620    HH2  TRP  77           HH2      TRP  77  98.430   7.831   6.347
  621    H    ALA  78           HN       ALA  78  97.090   6.425  12.801
  622    HA   ALA  78           HA       ALA  78  95.759   6.210  10.191
  623    HB1  ALA  78           HB1      ALA  78  94.241   6.036  12.802
  624    HB2  ALA  78           HB2      ALA  78  94.450   4.719  11.649
  625    HB3  ALA  78           HB3      ALA  78  93.525   6.151  11.196
  626    H    ARG  79           HN       ARG  79  95.602   8.302   9.443
  627    HA   ARG  79           HA       ARG  79  94.757  10.382  11.277
  628    HB2  ARG  79           HB2      ARG  79  96.885  10.992  11.769
  629    HB3  ARG  79           HB1      ARG  79  97.551  10.065  10.430
  630    HG2  ARG  79           HG2      ARG  79  97.070  11.842   8.865
  631    HG3  ARG  79           HG1      ARG  79  96.163  12.736  10.084
  632    HD2  ARG  79           HD2      ARG  79  98.793  12.150  11.108
  633    HD3  ARG  79           HD1      ARG  79  98.938  12.921   9.531
  634    HE   ARG  79           HE       ARG  79  97.065  14.222  11.318
  635   HH11  ARG  79          HH21      ARG  79 100.337  13.917  10.239
  636   HH12  ARG  79          HH22      ARG  79 100.794  15.513  10.731
  637   HH21  ARG  79          HH11      ARG  79  97.654  16.317  11.963
  638   HH22  ARG  79          HH12      ARG  79  99.274  16.874  11.707
  639    H    ASP  80           HN       ASP  80  93.503  11.869  10.349
  640    HA   ASP  80           HA       ASP  80  92.300  12.970   8.738
  641    HB2  ASP  80           HB2      ASP  80  95.071  12.871   7.595
  642    HB3  ASP  80           HB1      ASP  80  93.759  13.623   6.690
  643    H    GLY  81           HN       GLY  81  91.638  10.270   8.625
  644    HA2  GLY  81           HA2      GLY  81  90.543   8.833   7.219
  645    HA3  GLY  81           HA1      GLY  81  90.637  10.085   5.988
  646    H    LEU  82           HN       LEU  82  93.669   9.241   7.257
  647    HA   LEU  82           HA       LEU  82  94.195   7.457   4.946
  648    HB2  LEU  82           HB2      LEU  82  96.174   9.286   6.345
  649    HB3  LEU  82           HB1      LEU  82  96.478   8.301   4.915
  650    HG   LEU  82           HG       LEU  82  94.629  10.692   5.140
  651   HD11  LEU  82          HD11      LEU  82  96.968  10.152   3.289
  652   HD12  LEU  82          HD12      LEU  82  97.105  11.056   4.798
  653   HD13  LEU  82          HD13      LEU  82  96.097  11.673   3.487
  654   HD21  LEU  82          HD21      LEU  82  93.408   9.267   3.718
  655   HD22  LEU  82          HD22      LEU  82  94.864   8.543   3.036
  656   HD23  LEU  82          HD23      LEU  82  94.397  10.183   2.584
  657    H    LEU  83           HN       LEU  83  95.107   5.516   5.391
  658    HA   LEU  83           HA       LEU  83  95.804   4.929   8.238
  659    HB2  LEU  83           HB2      LEU  83  94.596   3.027   6.258
  660    HB3  LEU  83           HB1      LEU  83  94.834   2.790   7.984
  661    HG   LEU  83           HG       LEU  83  93.030   4.900   6.770
  662   HD11  LEU  83          HD11      LEU  83  91.246   3.348   7.802
  663   HD12  LEU  83          HD12      LEU  83  92.515   2.127   7.859
  664   HD13  LEU  83          HD13      LEU  83  92.010   2.799   6.309
  665   HD21  LEU  83          HD21      LEU  83  92.162   4.835   9.209
  666   HD22  LEU  83          HD22      LEU  83  93.703   5.643   8.925
  667   HD23  LEU  83          HD23      LEU  83  93.673   4.009   9.588
  668    H    GLY  84           HN       GLY  84  97.726   3.938   8.571
  669    HA2  GLY  84           HA2      GLY  84  99.133   2.822   6.222
  670    HA3  GLY  84           HA1      GLY  84  99.955   3.727   7.480
  671    H    PHE  85           HN       PHE  85  99.879   0.792   6.462
  672    HA   PHE  85           HA       PHE  85  99.719  -0.448   9.143
  673    HB2  PHE  85           HB2      PHE  85  99.136  -1.712   6.454
  674    HB3  PHE  85           HB1      PHE  85  99.169  -2.560   7.994
  675    HD1  PHE  85           HD1      PHE  85  97.512   0.363   6.324
  676    HD2  PHE  85           HD2      PHE  85  97.198  -2.793   9.215
  677    HE1  PHE  85           HE1      PHE  85  95.121   0.910   6.688
  678    HE2  PHE  85           HE2      PHE  85  94.821  -2.232   9.584
  679    HZ   PHE  85           HZ       PHE  85  93.783  -0.369   8.326
  680    H    GLU  86           HN       GLU  86 101.202  -2.200   9.498
  681    HA   GLU  86           HA       GLU  86 103.712  -1.915   7.954
  682    HB2  GLU  86           HB2      GLU  86 103.763  -1.470  10.437
  683    HB3  GLU  86           HB1      GLU  86 103.307  -3.157  10.687
  684    HG2  GLU  86           HG2      GLU  86 105.305  -3.879   9.423
  685    HG3  GLU  86           HG1      GLU  86 105.768  -2.193   9.201
  686    H    CYS  87           HN       CYS  87 104.391  -3.590   6.754
  687    HA   CYS  87           HA       CYS  87 102.700  -5.884   6.452
  688    HB2  CYS  87           HB2      CYS  87 103.853  -4.961   4.526
  689    HB3  CYS  87           HB1      CYS  87 105.417  -5.235   5.294
  690    HG   CYS  87           HG       CYS  87 104.899  -7.841   5.175
  691    H    GLN  88           HN       GLN  88 102.760  -7.723   7.542
  692    HA   GLN  88           HA       GLN  88 105.109  -8.317   9.219
  693    HB2  GLN  88           HB2      GLN  88 103.491 -10.050  10.214
  694    HB3  GLN  88           HB1      GLN  88 103.168  -8.351  10.553
  695    HG2  GLN  88           HG2      GLN  88 101.894  -9.177   8.065
  696    HG3  GLN  88           HG1      GLN  88 101.382 -10.199   9.403
  697   HE21  GLN  88          HE21      GLN  88 102.319  -6.759   9.686
  698   HE22  GLN  88          HE22      GLN  88 100.783  -6.221  10.166
  699    H    HIS  89           HN       HIS  89 103.172  -9.554   6.557
  700    HA   HIS  89           HA       HIS  89 105.290 -11.383   5.841
  701    HB2  HIS  89           HB2      HIS  89 104.449 -13.144   6.998
  702    HB3  HIS  89           HB1      HIS  89 102.915 -12.329   7.288
  703    HD2  HIS  89           HD2      HIS  89 101.062 -14.092   6.223
  704    HE1  HIS  89           HE1      HIS  89 102.986 -14.804   2.530
  705    HE2  HIS  89           HE2      HIS  89 100.895 -15.267   3.897
  706    H    ILE  90           HN       ILE  90 105.261 -11.846   3.693
  707    HA   ILE  90           HA       ILE  90 102.884 -11.266   2.048
  708    HB   ILE  90           HB       ILE  90 104.049  -9.129   2.147
  709   HG12  ILE  90          HG12      ILE  90 104.656 -10.607  -0.439
  710   HG13  ILE  90          HG11      ILE  90 103.120  -9.848  -0.032
  711   HG21  ILE  90          HG21      ILE  90 106.459 -10.858   1.606
  712   HG22  ILE  90          HG22      ILE  90 106.232  -9.639   2.855
  713   HG23  ILE  90          HG23      ILE  90 106.468  -9.150   1.180
  714   HD11  ILE  90          HD11      ILE  90 104.142  -8.156  -1.266
  715   HD12  ILE  90          HD12      ILE  90 105.751  -8.561  -0.676
  716   HD13  ILE  90          HD13      ILE  90 104.616  -7.716   0.373
  717    H    ASP  91           HN       ASP  91 102.701 -12.420   0.292
  718    HA   ASP  91           HA       ASP  91 103.958 -14.882   0.108
  719    HB2  ASP  91           HB2      ASP  91 101.986 -13.412  -1.359
  720    HB3  ASP  91           HB1      ASP  91 103.083 -14.176  -2.503
  721    H    LEU  92           HN       LEU  92 105.580 -15.745  -0.990
  722    HA   LEU  92           HA       LEU  92 107.890 -14.279  -1.555
  723    HB2  LEU  92           HB2      LEU  92 107.799 -16.763  -1.200
  724    HB3  LEU  92           HB1      LEU  92 107.149 -16.924  -2.831
  725    HG   LEU  92           HG       LEU  92 109.288 -15.456  -3.457
  726   HD11  LEU  92          HD11      LEU  92 110.146 -16.928  -0.948
  727   HD12  LEU  92          HD12      LEU  92 109.991 -15.178  -1.098
  728   HD13  LEU  92          HD13      LEU  92 111.208 -16.039  -2.039
  729   HD21  LEU  92          HD21      LEU  92 108.773 -17.750  -4.273
  730   HD22  LEU  92          HD22      LEU  92 109.467 -18.413  -2.794
  731   HD23  LEU  92          HD23      LEU  92 110.491 -17.540  -3.934
  732    H    ASP  93           HN       ASP  93 105.354 -15.397  -3.780
  733    HA   ASP  93           HA       ASP  93 106.608 -14.321  -6.114
  734    HB2  ASP  93           HB2      ASP  93 104.798 -15.149  -7.280
  735    HB3  ASP  93           HB1      ASP  93 104.686 -16.138  -5.827
  736    H    SER  94           HN       SER  94 104.268 -13.168  -3.768
  737    HA   SER  94           HA       SER  94 103.473 -10.811  -5.129
  738    HB2  SER  94           HB2      SER  94 102.066 -11.278  -3.353
  739    HB3  SER  94           HB1      SER  94 103.385 -11.809  -2.315
  740    HG   SER  94           HG       SER  94 103.075  -9.128  -3.173
  741    H    ILE  95           HN       ILE  95 106.107 -11.599  -2.935
  742    HA   ILE  95           HA       ILE  95 107.120  -9.021  -2.478
  743    HB   ILE  95           HB       ILE  95 108.349 -11.770  -2.465
  744   HG12  ILE  95          HG12      ILE  95 108.196  -9.709  -0.265
  745   HG13  ILE  95          HG11      ILE  95 106.845 -10.781  -0.622
  746   HG21  ILE  95          HG21      ILE  95 110.222 -10.517  -3.182
  747   HG22  ILE  95          HG22      ILE  95 110.374 -10.524  -1.425
  748   HG23  ILE  95          HG23      ILE  95 109.740  -9.100  -2.251
  749   HD11  ILE  95          HD11      ILE  95 109.550 -12.014  -0.295
  750   HD12  ILE  95          HD12      ILE  95 107.962 -12.668   0.110
  751   HD13  ILE  95          HD13      ILE  95 108.711 -11.461   1.155
  752    H    SER  96           HN       SER  96 107.607 -11.294  -5.124
  753    HA   SER  96           HA       SER  96 109.695  -9.756  -6.305
  754    HB2  SER  96           HB2      SER  96 108.646 -12.296  -6.754
  755    HB3  SER  96           HB1      SER  96 108.136 -11.403  -8.188
  756    HG   SER  96           HG       SER  96 110.757 -11.780  -7.166
  757    H    HIS  97           HN       HIS  97 106.191  -9.858  -6.798
  758    HA   HIS  97           HA       HIS  97 106.218  -8.125  -9.038
  759    HB2  HIS  97           HB2      HIS  97 104.127  -8.818  -6.978
  760    HB3  HIS  97           HB1      HIS  97 103.838  -7.563  -8.167
  761    HD2  HIS  97           HD2      HIS  97 104.026 -11.441  -7.991
  762    HE1  HIS  97           HE1      HIS  97 103.185 -10.367 -11.984
  763    HE2  HIS  97           HE2      HIS  97 103.349 -12.312 -10.358
  764    H    LEU  98           HN       LEU  98 106.239  -7.572  -5.568
  765    HA   LEU  98           HA       LEU  98 105.953  -4.708  -5.722
  766    HB2  LEU  98           HB2      LEU  98 106.144  -6.674  -3.658
  767    HB3  LEU  98           HB1      LEU  98 107.470  -5.541  -3.415
  768    HG   LEU  98           HG       LEU  98 104.606  -4.658  -3.864
  769   HD11  LEU  98          HD11      LEU  98 104.572  -5.896  -1.814
  770   HD12  LEU  98          HD12      LEU  98 104.699  -4.199  -1.356
  771   HD13  LEU  98          HD13      LEU  98 106.127  -5.233  -1.310
  772   HD21  LEU  98          HD21      LEU  98 106.217  -2.922  -4.352
  773   HD22  LEU  98          HD22      LEU  98 107.140  -3.297  -2.896
  774   HD23  LEU  98          HD23      LEU  98 105.538  -2.573  -2.764
  775    H    ARG  99           HN       ARG  99 108.716  -6.914  -5.799
  776    HA   ARG  99           HA       ARG  99 110.672  -4.841  -5.667
  777    HB2  ARG  99           HB2      ARG  99 110.714  -7.694  -6.642
  778    HB3  ARG  99           HB1      ARG  99 112.121  -6.645  -6.824
  779    HG2  ARG  99           HG2      ARG  99 112.032  -6.171  -4.371
  780    HG3  ARG  99           HG1      ARG  99 110.715  -7.333  -4.226
  781    HD2  ARG  99           HD2      ARG  99 112.705  -8.525  -3.663
  782    HD3  ARG  99           HD1      ARG  99 112.272  -9.043  -5.289
  783    HE   ARG  99           HE       ARG  99 114.275  -8.140  -6.010
  784   HH11  ARG  99          HH21      ARG  99 113.283  -6.663  -3.040
  785   HH12  ARG  99          HH22      ARG  99 114.700  -5.678  -2.896
  786   HH21  ARG  99          HH11      ARG  99 116.136  -6.851  -5.826
  787   HH22  ARG  99          HH12      ARG  99 116.315  -5.785  -4.473
  788    H    ARG 100           HN       ARG 100 108.901  -6.413  -8.260
  789    HA   ARG 100           HA       ARG 100 110.167  -5.359 -10.547
  790    HB2  ARG 100           HB2      ARG 100 107.332  -6.167  -9.956
  791    HB3  ARG 100           HB1      ARG 100 107.838  -5.592 -11.542
  792    HG2  ARG 100           HG2      ARG 100 109.318  -7.817 -10.131
  793    HG3  ARG 100           HG1      ARG 100 107.897  -8.147 -11.122
  794    HD2  ARG 100           HD2      ARG 100 109.157  -6.705 -12.925
  795    HD3  ARG 100           HD1      ARG 100 110.582  -7.080 -11.959
  796    HE   ARG 100           HE       ARG 100 109.174  -9.472 -12.441
  797   HH11  ARG 100          HH21      ARG 100 110.981  -7.018 -14.077
  798   HH12  ARG 100          HH22      ARG 100 111.536  -8.071 -15.335
  799   HH21  ARG 100          HH11      ARG 100 109.895 -10.860 -14.089
  800   HH22  ARG 100          HH12      ARG 100 110.921 -10.247 -15.342
  801    H    LEU 101           HN       LEU 101 107.650  -4.073  -8.446
  802    HA   LEU 101           HA       LEU 101 107.122  -1.723  -9.985
  803    HB2  LEU 101           HB2      LEU 101 106.344  -2.776  -7.318
  804    HB3  LEU 101           HB1      LEU 101 106.276  -1.025  -7.506
  805    HG   LEU 101           HG       LEU 101 104.749  -1.183  -9.336
  806   HD11  LEU 101          HD11      LEU 101 105.721  -4.004  -9.439
  807   HD12  LEU 101          HD12      LEU 101 105.353  -2.896 -10.757
  808   HD13  LEU 101          HD13      LEU 101 104.048  -3.717  -9.908
  809   HD21  LEU 101          HD21      LEU 101 103.848  -3.385  -7.470
  810   HD22  LEU 101          HD22      LEU 101 102.859  -2.171  -8.281
  811   HD23  LEU 101          HD23      LEU 101 103.918  -1.699  -6.955
  812    H    VAL 102           HN       VAL 102 109.288  -2.487  -7.312
  813    HA   VAL 102           HA       VAL 102 110.121   0.188  -6.795
  814    HB   VAL 102           HB       VAL 102 111.470  -2.463  -6.237
  815   HG11  VAL 102          HG11      VAL 102 112.132   0.369  -5.394
  816   HG12  VAL 102          HG12      VAL 102 113.184  -0.790  -6.208
  817   HG13  VAL 102          HG13      VAL 102 112.724  -1.047  -4.525
  818   HG21  VAL 102          HG21      VAL 102 110.099  -0.616  -4.282
  819   HG22  VAL 102          HG22      VAL 102 110.494  -2.321  -4.084
  820   HG23  VAL 102          HG23      VAL 102 109.192  -1.839  -5.170
  821    H    GLU 103           HN       GLU 103 111.516  -2.452  -8.725
  822    HA   GLU 103           HA       GLU 103 113.803  -1.021  -9.581
  823    HB2  GLU 103           HB2      GLU 103 112.343  -3.411 -10.705
  824    HB3  GLU 103           HB1      GLU 103 113.814  -2.766 -11.434
  825    HG2  GLU 103           HG2      GLU 103 114.983  -3.027  -9.263
  826    HG3  GLU 103           HG1      GLU 103 113.520  -3.730  -8.576
  827    H    LEU 104           HN       LEU 104 110.584  -1.459 -11.026
  828    HA   LEU 104           HA       LEU 104 111.210  -0.060 -13.424
  829    HB2  LEU 104           HB2      LEU 104 108.559  -0.680 -12.102
  830    HB3  LEU 104           HB1      LEU 104 108.712   0.044 -13.701
  831    HG   LEU 104           HG       LEU 104 110.109  -2.543 -13.006
  832   HD11  LEU 104          HD11      LEU 104 107.675  -2.803 -12.569
  833   HD12  LEU 104          HD12      LEU 104 108.202  -3.751 -13.959
  834   HD13  LEU 104          HD13      LEU 104 107.339  -2.232 -14.203
  835   HD21  LEU 104          HD21      LEU 104 109.707  -2.796 -15.559
  836   HD22  LEU 104          HD22      LEU 104 110.940  -1.652 -15.034
  837   HD23  LEU 104          HD23      LEU 104 109.353  -1.070 -15.533
  838    H    ASN 105           HN       ASN 105 109.772   0.924 -10.337
  839    HA   ASN 105           HA       ASN 105 109.015   3.530 -11.062
  840    HB2  ASN 105           HB2      ASN 105 109.513   2.077  -8.550
  841    HB3  ASN 105           HB1      ASN 105 109.809   3.808  -8.439
  842   HD21  ASN 105          HD21      ASN 105 107.304   1.570  -9.776
  843   HD22  ASN 105          HD22      ASN 105 105.994   2.558  -9.342
  844    H    LEU 106           HN       LEU 106 112.073   2.344  -9.673
  845    HA   LEU 106           HA       LEU 106 113.424   4.782  -9.532
  846    HB2  LEU 106           HB2      LEU 106 114.150   1.928  -9.562
  847    HB3  LEU 106           HB1      LEU 106 115.417   2.988 -10.176
  848    HG   LEU 106           HG       LEU 106 115.156   4.392  -8.102
  849   HD11  LEU 106          HD11      LEU 106 113.876   3.558  -6.246
  850   HD12  LEU 106          HD12      LEU 106 113.544   2.040  -7.080
  851   HD13  LEU 106          HD13      LEU 106 112.806   3.536  -7.647
  852   HD21  LEU 106          HD21      LEU 106 116.897   2.613  -8.335
  853   HD22  LEU 106          HD22      LEU 106 115.782   1.465  -7.592
  854   HD23  LEU 106          HD23      LEU 106 116.379   2.842  -6.664
  855    H    GLY 107           HN       GLY 107 113.036   2.533 -12.236
  856    HA2  GLY 107           HA2      GLY 107 113.332   2.825 -14.501
  857    HA3  GLY 107           HA1      GLY 107 113.308   4.560 -14.196
  858    H    ASP 108           HN       ASP 108 115.349   1.699 -14.346
  859    HA   ASP 108           HA       ASP 108 117.815   2.972 -13.786
  860    HB2  ASP 108           HB2      ASP 108 117.317   0.469 -13.831
  861    HB3  ASP 108           HB1      ASP 108 117.465   0.576 -15.584
  862    H    GLU 109           HN       GLU 109 116.806   4.865 -15.275
  863    HA   GLU 109           HA       GLU 109 117.273   4.617 -18.085
  864    HB2  GLU 109           HB2      GLU 109 117.067   7.119 -18.058
  865    HB3  GLU 109           HB1      GLU 109 115.704   6.276 -17.325
  866    HG2  GLU 109           HG2      GLU 109 117.802   6.811 -15.364
  867    HG3  GLU 109           HG1      GLU 109 117.248   8.295 -16.133
  868    H    GLU 110           HN       GLU 110 119.431   3.679 -17.997
  869    HA   GLU 110           HA       GLU 110 121.702   3.810 -18.285
  870    HB2  GLU 110           HB2      GLU 110 121.260   6.797 -18.456
  871    HB3  GLU 110           HB1      GLU 110 122.628   5.884 -19.092
  872    HG2  GLU 110           HG2      GLU 110 121.237   4.769 -20.707
  873    HG3  GLU 110           HG1      GLU 110 119.769   5.405 -19.966
  874    H    LEU 111           HN       LEU 111 123.441   5.957 -17.469
  875    HA   LEU 111           HA       LEU 111 124.309   5.185 -15.020
  876    HB2  LEU 111           HB2      LEU 111 125.292   6.935 -16.644
  877    HB3  LEU 111           HB1      LEU 111 124.323   8.108 -15.755
  878    HG   LEU 111           HG       LEU 111 125.989   6.235 -14.125
  879   HD11  LEU 111          HD11      LEU 111 127.118   8.479 -15.813
  880   HD12  LEU 111          HD12      LEU 111 127.609   6.785 -15.817
  881   HD13  LEU 111          HD13      LEU 111 127.952   7.799 -14.415
  882   HD21  LEU 111          HD21      LEU 111 126.284   8.303 -12.788
  883   HD22  LEU 111          HD22      LEU 111 124.580   7.957 -13.069
  884   HD23  LEU 111          HD23      LEU 111 125.391   9.210 -14.008
  885    H    LEU 112           HN       LEU 112 123.835   5.522 -12.905
  886    HA   LEU 112           HA       LEU 112 122.009   7.566 -12.024
  887    HB2  LEU 112           HB2      LEU 112 120.501   5.757 -12.974
  888    HB3  LEU 112           HB1      LEU 112 121.104   4.701 -11.697
  889    HG   LEU 112           HG       LEU 112 120.446   6.727 -10.126
  890   HD11  LEU 112          HD11      LEU 112 119.840   8.283 -11.913
  891   HD12  LEU 112          HD12      LEU 112 118.402   7.869 -10.983
  892   HD13  LEU 112          HD13      LEU 112 118.675   7.127 -12.559
  893   HD21  LEU 112          HD21      LEU 112 118.214   5.712  -9.837
  894   HD22  LEU 112          HD22      LEU 112 119.448   4.469 -10.052
  895   HD23  LEU 112          HD23      LEU 112 118.383   4.895 -11.391
  896    H    GLU 113           HN       GLU 113 124.289   7.685 -11.033
  897    HA   GLU 113           HA       GLU 113 124.453   5.976  -8.620
  898    HB2  GLU 113           HB2      GLU 113 126.571   7.444 -10.194
  899    HB3  GLU 113           HB1      GLU 113 126.866   6.763  -8.594
  900    HG2  GLU 113           HG2      GLU 113 125.604   4.993 -10.655
  901    HG3  GLU 113           HG1      GLU 113 127.326   5.342 -10.809
  902    H    ARG 114           HN       ARG 114 124.082   6.894  -6.715
  903    HA   ARG 114           HA       ARG 114 124.957   9.466  -5.949
  904    HB2  ARG 114           HB2      ARG 114 123.130  10.178  -7.488
  905    HB3  ARG 114           HB1      ARG 114 121.984   9.275  -6.500
  906    HG2  ARG 114           HG2      ARG 114 121.792  11.434  -5.616
  907    HG3  ARG 114           HG1      ARG 114 122.962  10.698  -4.524
  908    HD2  ARG 114           HD2      ARG 114 124.641  11.648  -6.440
  909    HD3  ARG 114           HD1      ARG 114 123.347  12.837  -6.543
  910    HE   ARG 114           HE       ARG 114 125.201  12.496  -4.353
  911   HH11  ARG 114          HH21      ARG 114 122.075  13.581  -5.359
  912   HH12  ARG 114          HH22      ARG 114 121.888  14.700  -4.049
  913   HH21  ARG 114          HH11      ARG 114 124.965  13.961  -2.632
  914   HH22  ARG 114          HH12      ARG 114 123.525  14.913  -2.504
  915    H    GLU 115           HN       GLU 115 121.776   8.180  -5.147
  916    HA   GLU 115           HA       GLU 115 122.399   8.040  -2.357
  917    HB2  GLU 115           HB2      GLU 115 120.103   6.733  -2.424
  918    HB3  GLU 115           HB1      GLU 115 120.143   8.471  -2.720
  919    HG2  GLU 115           HG2      GLU 115 120.021   8.170  -5.084
  920    HG3  GLU 115           HG1      GLU 115 120.360   6.445  -4.952
  921    H    LEU 116           HN       LEU 116 123.837   6.324  -4.454
  922    HA   LEU 116           HA       LEU 116 123.210   3.603  -3.993
  923    HB2  LEU 116           HB2      LEU 116 124.573   4.564  -5.897
  924    HB3  LEU 116           HB1      LEU 116 125.908   4.715  -4.756
  925    HG   LEU 116           HG       LEU 116 125.322   2.166  -4.250
  926   HD11  LEU 116          HD11      LEU 116 124.415   2.542  -7.122
  927   HD12  LEU 116          HD12      LEU 116 123.357   2.149  -5.767
  928   HD13  LEU 116          HD13      LEU 116 124.588   0.999  -6.286
  929   HD21  LEU 116          HD21      LEU 116 127.473   3.078  -5.157
  930   HD22  LEU 116          HD22      LEU 116 126.780   2.998  -6.776
  931   HD23  LEU 116          HD23      LEU 116 127.040   1.519  -5.856
  932    H    ALA 117           HN       ALA 117 125.516   5.809  -2.390
  933    HA   ALA 117           HA       ALA 117 126.662   3.742  -0.830
  934    HB1  ALA 117           HB1      ALA 117 126.760   6.761  -0.599
  935    HB2  ALA 117           HB2      ALA 117 128.038   5.678  -1.152
  936    HB3  ALA 117           HB3      ALA 117 127.582   5.707   0.552
  937    H    LEU 118           HN       LEU 118 123.763   5.531  -0.489
  938    HA   LEU 118           HA       LEU 118 123.421   5.586   2.263
  939    HB2  LEU 118           HB2      LEU 118 121.349   4.996   0.135
  940    HB3  LEU 118           HB1      LEU 118 120.979   5.409   1.808
  941    HG   LEU 118           HG       LEU 118 122.448   7.157  -0.189
  942   HD11  LEU 118          HD11      LEU 118 119.880   7.849   1.213
  943   HD12  LEU 118          HD12      LEU 118 119.833   6.789  -0.195
  944   HD13  LEU 118          HD13      LEU 118 120.491   8.418  -0.341
  945   HD21  LEU 118          HD21      LEU 118 123.422   7.805   1.830
  946   HD22  LEU 118          HD22      LEU 118 122.005   7.356   2.778
  947   HD23  LEU 118          HD23      LEU 118 121.992   8.835   1.818
  948    H    LEU 119           HN       LEU 119 123.271   2.824   0.084
  949    HA   LEU 119           HA       LEU 119 121.959   1.004   1.819
  950    HB2  LEU 119           HB2      LEU 119 123.986   0.635  -0.393
  951    HB3  LEU 119           HB1      LEU 119 123.376  -0.732   0.535
  952    HG   LEU 119           HG       LEU 119 122.182  -0.116  -1.688
  953   HD11  LEU 119          HD11      LEU 119 121.180  -1.770  -0.345
  954   HD12  LEU 119          HD12      LEU 119 119.906  -0.568  -0.550
  955   HD13  LEU 119          HD13      LEU 119 120.822  -0.634   0.954
  956   HD21  LEU 119          HD21      LEU 119 120.496   1.603  -1.562
  957   HD22  LEU 119          HD22      LEU 119 122.026   2.334  -1.089
  958   HD23  LEU 119          HD23      LEU 119 120.839   1.899   0.139
  959    H    VAL 120           HN       VAL 120 125.155   2.328   1.704
  960    HA   VAL 120           HA       VAL 120 126.668   0.542   3.268
  961    HB   VAL 120           HB       VAL 120 126.848   3.550   3.213
  962   HG11  VAL 120          HG11      VAL 120 129.314   2.902   3.566
  963   HG12  VAL 120          HG12      VAL 120 128.708   1.307   4.011
  964   HG13  VAL 120          HG13      VAL 120 128.234   2.724   4.949
  965   HG21  VAL 120          HG21      VAL 120 128.478   1.689   1.501
  966   HG22  VAL 120          HG22      VAL 120 128.085   3.387   1.234
  967   HG23  VAL 120          HG23      VAL 120 126.862   2.147   0.965
  968    H    SER 121           HN       SER 121 124.742   3.383   4.258
  969    HA   SER 121           HA       SER 121 125.220   2.799   7.072
  970    HB2  SER 121           HB2      SER 121 125.250   5.078   6.842
  971    HB3  SER 121           HB1      SER 121 124.112   5.064   5.499
  972    HG   SER 121           HG       SER 121 122.668   5.536   6.940
  973    H    ALA 122           HN       ALA 122 122.608   2.508   4.733
  974    HA   ALA 122           HA       ALA 122 120.589   2.100   6.712
  975    HB1  ALA 122           HB1      ALA 122 120.270   2.809   4.244
  976    HB2  ALA 122           HB2      ALA 122 119.103   1.676   4.928
  977    HB3  ALA 122           HB3      ALA 122 120.392   1.088   3.878
  978    H    HIS 123           HN       HIS 123 123.119   0.407   6.652
  979    HA   HIS 123           HA       HIS 123 121.872  -2.268   6.524
  980    HB2  HIS 123           HB2      HIS 123 123.843  -3.085   5.757
  981    HB3  HIS 123           HB1      HIS 123 124.201  -1.404   5.372
  982    HD2  HIS 123           HD2      HIS 123 125.622  -0.071   7.688
  983    HE1  HIS 123           HE1      HIS 123 127.382  -3.729   8.845
  984    HE2  HIS 123           HE2      HIS 123 127.493  -1.207   9.112
  985    H    ASP 124           HN       ASP 124 123.940  -0.197   8.543
  986    HA   ASP 124           HA       ASP 124 123.178  -1.853  10.880
  987    HB2  ASP 124           HB2      ASP 124 125.521  -2.162  10.490
  988    HB3  ASP 124           HB1      ASP 124 125.776  -0.430  10.287
  989    H    ASP 125           HN       ASP 125 123.527   1.336   9.511
  990    HA   ASP 125           HA       ASP 125 122.434   2.507  12.003
  991    HB2  ASP 125           HB2      ASP 125 124.796   3.181  10.609
  992    HB3  ASP 125           HB1      ASP 125 123.650   4.472  10.258
  993   H5'1  C2E 501          H5'1      C2E 501 105.123   2.723  10.577
  994   H5'2  C2E 501          H5'2      C2E 501 104.288   1.272  11.155
  995    H4'  C2E 501           H4'      C2E 501 106.519   0.084  10.303
  996    H3'  C2E 501           H3'      C2E 501 106.416   2.686   8.767
  997    H2'  C2E 501           H2'      C2E 501 106.779   1.583   6.715
  998   HO2'  C2E 501          HO2'      C2E 501 107.433  -0.540   6.586
  999    H1'  C2E 501           H1'      C2E 501 104.924  -0.310   7.045
 1000    H8   C2E 501           H8       C2E 501 103.424   2.306   9.196
 1001    HN1  C2E 501           HN1      C2E 501 103.055   3.941   3.029
 1002   HN21  C2E 501          HN21      C2E 501 104.380   2.638   1.814
 1003   HN22  C2E 501          HN22      C2E 501 105.335   1.353   2.518
 1004   H511  C2E 501          H511      C2E 501 108.105   3.596  10.376
 1005   H512  C2E 501          H512      C2E 501 109.804   3.689  10.876
 1006    H4A  C2E 501           H4A      C2E 501 108.878   4.153  13.255
 1007    H3A  C2E 501           H3A      C2E 501 106.304   4.378  11.699
 1008    H2A  C2E 501           H2A      C2E 501 105.742   6.337  12.821
 1009   HO2A  C2E 501          HO2A      C2E 501 107.565   5.358  14.686
 1010    H1A  C2E 501           H1A      C2E 501 108.132   7.593  12.660
 1011    H81  C2E 501           H81      C2E 501 108.266   5.566   9.544
 1012   HN11  C2E 501          HN11      C2E 501 104.418  10.640   8.915
 1013   HN24  C2E 501          HN24      C2E 501 104.626  10.861  12.390
 1014   HN23  C2E 501          HN23      C2E 501 103.968  11.513  10.906
 1015   H5'1  C2E 502          H5'1      C2E 502 101.712   9.971   4.628
 1016   H5'2  C2E 502          H5'2      C2E 502 100.107  10.676   4.345
 1017    H4'  C2E 502           H4'      C2E 502  99.902  11.377   6.599
 1018    H3'  C2E 502           H3'      C2E 502 102.868  10.821   6.822
 1019    H2'  C2E 502           H2'      C2E 502 102.512  10.421   9.154
 1020   HO2'  C2E 502          HO2'      C2E 502 100.766  11.127  10.217
 1021    H1'  C2E 502           H1'      C2E 502 100.349   8.844   8.820
 1022    H8   C2E 502           H8       C2E 502 102.512   7.990   5.834
 1023    HN1  C2E 502           HN1      C2E 502 104.329   5.246  11.314
 1024   HN21  C2E 502          HN21      C2E 502 103.279   6.143  13.023
 1025   HN22  C2E 502          HN22      C2E 502 102.116   7.442  12.835
 1026   H511  C2E 502          H511      C2E 502 105.313  15.218   6.850
 1027   H512  C2E 502          H512      C2E 502 103.668  15.254   6.185
 1028    H4A  C2E 502           H4A      C2E 502 104.840  15.272   4.218
 1029    H3A  C2E 502           H3A      C2E 502 104.572  12.352   4.955
 1030    H2A  C2E 502           H2A      C2E 502 105.980  11.745   3.155
 1031   HO2A  C2E 502          HO2A      C2E 502 106.610  13.618   1.657
 1032    H1A  C2E 502           H1A      C2E 502 107.807  13.792   3.360
 1033    H81  C2E 502           H81      C2E 502 107.018  12.831   6.873
 1034   HN11  C2E 502          HN11      C2E 502 110.816   8.583   3.956
 1035   HN24  C2E 502          HN24      C2E 502 110.853   8.975   1.772
 1036   HN23  C2E 502          HN23      C2E 502 109.954  10.283   1.037
  Start of MODEL   18
    1    H    MET   1           H        MET   1 110.982  28.496   9.017
    2    HA   MET   1           HA       MET   1 110.859  27.894   6.591
    3    HB2  MET   1           HB2      MET   1 113.532  27.478   6.686
    4    HB3  MET   1           HB1      MET   1 112.801  29.052   6.995
    5    HG2  MET   1           HG2      MET   1 114.447  28.382   8.752
    6    HG3  MET   1           HG1      MET   1 112.827  28.648   9.394
    7    HE1  MET   1           HE1      MET   1 115.644  26.549  10.234
    8    HE2  MET   1           HE2      MET   1 114.597  25.751  11.403
    9    HE3  MET   1           HE3      MET   1 114.495  27.496  11.188
   10    H    SER   2           HN       SER   2 110.447  25.412   8.532
   11    HA   SER   2           HA       SER   2 111.545  23.415   6.633
   12    HB2  SER   2           HB2      SER   2 111.837  21.888   8.428
   13    HB3  SER   2           HB1      SER   2 112.486  23.419   9.010
   14    HG   SER   2           HG       SER   2 110.599  21.965  10.100
   15    H    ASP   3           HN       ASP   3 109.380  24.161   5.609
   16    HA   ASP   3           HA       ASP   3 107.098  22.735   6.800
   17    HB2  ASP   3           HB2      ASP   3 105.708  23.972   5.214
   18    HB3  ASP   3           HB1      ASP   3 106.735  25.085   6.115
   19    H    GLN   4           HN       GLN   4 109.356  21.373   5.513
   20    HA   GLN   4           HA       GLN   4 107.968  20.170   3.193
   21    HB2  GLN   4           HB2      GLN   4 110.308  19.292   2.633
   22    HB3  GLN   4           HB1      GLN   4 110.039  21.016   2.426
   23    HG2  GLN   4           HG2      GLN   4 112.141  20.765   3.562
   24    HG3  GLN   4           HG1      GLN   4 110.979  21.360   4.745
   25   HE21  GLN   4          HE21      GLN   4 110.146  19.793   6.341
   26   HE22  GLN   4          HE22      GLN   4 110.987  18.356   6.644
   27    H    HIS   5           HN       HIS   5 108.028  19.653   6.275
   28    HA   HIS   5           HA       HIS   5 108.027  17.840   7.694
   29    HB2  HIS   5           HB2      HIS   5 107.225  15.852   5.758
   30    HB3  HIS   5           HB1      HIS   5 106.296  16.555   7.077
   31    HD2  HIS   5           HD2      HIS   5 106.894  17.172   3.229
   32    HE1  HIS   5           HE1      HIS   5 103.736  19.667   4.504
   33    HE2  HIS   5           HE2      HIS   5 105.023  18.834   2.480
   34    H    ASP   6           HN       ASP   6 110.049  17.298   8.314
   35    HA   ASP   6           HA       ASP   6 112.126  16.305   6.760
   36    HB2  ASP   6           HB2      ASP   6 111.570  15.529   9.629
   37    HB3  ASP   6           HB1      ASP   6 113.134  15.561   8.815
   38    H    GLU   7           HN       GLU   7 113.004  14.125   6.614
   39    HA   GLU   7           HA       GLU   7 110.874  12.178   6.188
   40    HB2  GLU   7           HB2      GLU   7 112.630  10.856   5.029
   41    HB3  GLU   7           HB1      GLU   7 112.368  12.459   4.339
   42    HG2  GLU   7           HG2      GLU   7 114.454  12.189   6.473
   43    HG3  GLU   7           HG1      GLU   7 114.829  11.545   4.878
   44    H    ARG   8           HN       ARG   8 110.591  10.357   7.316
   45    HA   ARG   8           HA       ARG   8 112.463   9.784   9.541
   46    HB2  ARG   8           HB2      ARG   8 109.454   9.784   9.489
   47    HB3  ARG   8           HB1      ARG   8 110.363   8.865  10.681
   48    HG2  ARG   8           HG2      ARG   8 110.025  10.894  11.789
   49    HG3  ARG   8           HG1      ARG   8 111.629  11.117  11.099
   50    HD2  ARG   8           HD2      ARG   8 110.169  13.089  10.735
   51    HD3  ARG   8           HD1      ARG   8 110.683  12.363   9.225
   52    HE   ARG   8           HE       ARG   8 108.387  11.189   9.350
   53   HH11  ARG   8          HH21      ARG   8 109.120  14.358  10.574
   54   HH12  ARG   8          HH22      ARG   8 107.516  14.964  10.338
   55   HH21  ARG   8          HH11      ARG   8 106.296  12.005   9.027
   56   HH22  ARG   8          HH12      ARG   8 105.922  13.636   9.468
   57    H    ARG   9           HN       ARG   9 111.072   8.626   6.702
   58    HA   ARG   9           HA       ARG   9 111.421   5.798   7.540
   59    HB2  ARG   9           HB2      ARG   9 110.108   5.485   5.226
   60    HB3  ARG   9           HB1      ARG   9 109.261   5.734   6.751
   61    HG2  ARG   9           HG2      ARG   9 109.329   8.211   6.253
   62    HG3  ARG   9           HG1      ARG   9 109.903   7.800   4.640
   63    HD2  ARG   9           HD2      ARG   9 107.883   6.775   4.058
   64    HD3  ARG   9           HD1      ARG   9 107.399   6.544   5.733
   65    HE   ARG   9           HE       ARG   9 106.927   8.942   5.851
   66   HH11  ARG   9          HH21      ARG   9 107.553   7.625   2.699
   67   HH12  ARG   9          HH22      ARG   9 106.729   8.897   1.864
   68   HH21  ARG   9          HH11      ARG   9 105.854  10.594   4.753
   69   HH22  ARG   9          HH12      ARG   9 105.769  10.575   3.024
   70    H    ARG  10           HN       ARG  10 113.577   5.632   7.211
   71    HA   ARG  10           HA       ARG  10 115.605   5.992   5.999
   72    HB2  ARG  10           HB2      ARG  10 115.309   3.993   4.149
   73    HB3  ARG  10           HB1      ARG  10 115.713   3.739   5.844
   74    HG2  ARG  10           HG2      ARG  10 112.815   3.960   5.086
   75    HG3  ARG  10           HG1      ARG  10 113.670   2.463   4.736
   76    HD2  ARG  10           HD2      ARG  10 114.124   2.038   6.999
   77    HD3  ARG  10           HD1      ARG  10 113.861   3.712   7.467
   78    HE   ARG  10           HE       ARG  10 111.523   3.337   7.398
   79   HH11  ARG  10          HH21      ARG  10 113.393   0.561   6.487
   80   HH12  ARG  10          HH22      ARG  10 112.072  -0.546   6.647
   81   HH21  ARG  10          HH11      ARG  10 109.796   1.889   7.598
   82   HH22  ARG  10          HH12      ARG  10 110.037   0.204   7.276
   83    H    PHE  11           HN       PHE  11 113.587   4.948   3.281
   84    HA   PHE  11           HA       PHE  11 114.285   7.455   1.870
   85    HB2  PHE  11           HB2      PHE  11 114.959   4.691   1.210
   86    HB3  PHE  11           HB1      PHE  11 114.089   5.485  -0.097
   87    HD1  PHE  11           HD1      PHE  11 117.037   5.775   2.156
   88    HD2  PHE  11           HD2      PHE  11 115.124   7.177  -1.424
   89    HE1  PHE  11           HE1      PHE  11 119.101   7.001   1.534
   90    HE2  PHE  11           HE2      PHE  11 117.187   8.404  -2.046
   91    HZ   PHE  11           HZ       PHE  11 119.176   8.315  -0.567
   92    H    HIS  12           HN       HIS  12 112.809   8.056   0.165
   93    HA   HIS  12           HA       HIS  12 110.130   8.004   0.852
   94    HB2  HIS  12           HB2      HIS  12 109.666   8.810  -1.410
   95    HB3  HIS  12           HB1      HIS  12 111.109   9.591  -0.767
   96    HD2  HIS  12           HD2      HIS  12 112.833   6.585  -1.575
   97    HE1  HIS  12           HE1      HIS  12 112.270   8.199  -5.431
   98    HE2  HIS  12           HE2      HIS  12 113.572   6.495  -4.075
   99    H    ARG  13           HN       ARG  13 108.445   6.661   0.533
  100    HA   ARG  13           HA       ARG  13 108.988   3.968  -0.322
  101    HB2  ARG  13           HB2      ARG  13 106.185   4.911   0.091
  102    HB3  ARG  13           HB1      ARG  13 106.966   3.425   0.627
  103    HG2  ARG  13           HG2      ARG  13 108.380   4.955   2.168
  104    HG3  ARG  13           HG1      ARG  13 107.158   6.180   1.836
  105    HD2  ARG  13           HD2      ARG  13 106.533   3.415   2.898
  106    HD3  ARG  13           HD1      ARG  13 106.704   4.839   3.914
  107    HE   ARG  13           HE       ARG  13 104.489   4.245   2.113
  108   HH11  ARG  13          HH21      ARG  13 106.168   6.546   4.086
  109   HH12  ARG  13          HH22      ARG  13 104.818   7.620   4.218
  110   HH21  ARG  13          HH11      ARG  13 102.724   5.653   2.285
  111   HH22  ARG  13          HH12      ARG  13 102.871   7.116   3.200
  112    H    ILE  14           HN       ILE  14 107.693   2.839  -1.938
  113    HA   ILE  14           HA       ILE  14 107.677   4.243  -4.440
  114    HB   ILE  14           HB       ILE  14 106.836   1.471  -3.604
  115   HG12  ILE  14          HG12      ILE  14 108.816   0.812  -4.893
  116   HG13  ILE  14          HG11      ILE  14 109.099   2.489  -5.352
  117   HG21  ILE  14          HG21      ILE  14 106.883   1.167  -6.218
  118   HG22  ILE  14          HG22      ILE  14 106.531   2.895  -6.232
  119   HG23  ILE  14          HG23      ILE  14 105.426   1.774  -5.436
  120   HD11  ILE  14          HD11      ILE  14 109.721   3.111  -3.170
  121   HD12  ILE  14          HD12      ILE  14 110.443   1.513  -3.349
  122   HD13  ILE  14          HD13      ILE  14 108.939   1.704  -2.448
  123    H    ALA  15           HN       ALA  15 106.164   5.864  -4.405
  124    HA   ALA  15           HA       ALA  15 103.403   5.214  -3.670
  125    HB1  ALA  15           HB1      ALA  15 104.848   7.794  -4.225
  126    HB2  ALA  15           HB2      ALA  15 104.119   7.248  -2.715
  127    HB3  ALA  15           HB3      ALA  15 103.093   7.716  -4.072
  128    H    PHE  16           HN       PHE  16 101.993   4.613  -5.085
  129    HA   PHE  16           HA       PHE  16 101.798   5.902  -7.673
  130    HB2  PHE  16           HB2      PHE  16 101.838   3.925  -9.006
  131    HB3  PHE  16           HB1      PHE  16 103.296   3.883  -8.018
  132    HD1  PHE  16           HD2      PHE  16 103.316   2.484  -5.914
  133    HD2  PHE  16           HD1      PHE  16 100.191   2.217  -8.847
  134    HE1  PHE  16           HE2      PHE  16 102.657   0.273  -5.012
  135    HE2  PHE  16           HE1      PHE  16  99.534   0.003  -7.941
  136    HZ   PHE  16           HZ       PHE  16 100.774  -0.970  -6.028
  137    H    ASP  17           HN       ASP  17  99.652   5.448  -8.663
  138    HA   ASP  17           HA       ASP  17  97.702   5.003  -6.523
  139    HB2  ASP  17           HB2      ASP  17  96.096   5.834  -8.356
  140    HB3  ASP  17           HB1      ASP  17  97.243   6.994  -7.688
  141    H    ALA  18           HN       ALA  18  96.009   3.519  -6.680
  142    HA   ALA  18           HA       ALA  18  95.416   1.892  -8.868
  143    HB1  ALA  18           HB1      ALA  18  96.439  -0.274  -7.870
  144    HB2  ALA  18           HB2      ALA  18  97.534   0.814  -7.017
  145    HB3  ALA  18           HB3      ALA  18  97.501   0.801  -8.779
  146    H    ASP  19           HN       ASP  19  94.318  -0.245  -8.027
  147    HA   ASP  19           HA       ASP  19  92.526   0.617  -5.849
  148    HB2  ASP  19           HB2      ASP  19  91.594  -0.127  -8.063
  149    HB3  ASP  19           HB1      ASP  19  92.216  -1.740  -7.724
  150    H    SER  20           HN       SER  20  92.422  -0.382  -3.914
  151    HA   SER  20           HA       SER  20  93.801  -2.970  -3.590
  152    HB2  SER  20           HB2      SER  20  94.588  -2.085  -1.333
  153    HB3  SER  20           HB1      SER  20  95.413  -1.447  -2.752
  154    HG   SER  20           HG       SER  20  94.336   0.433  -2.541
  155    H    GLU  21           HN       GLU  21  93.043  -4.231  -1.850
  156    HA   GLU  21           HA       GLU  21  90.494  -3.371  -0.605
  157    HB2  GLU  21           HB2      GLU  21  90.994  -6.129  -1.765
  158    HB3  GLU  21           HB1      GLU  21  89.504  -5.541  -1.030
  159    HG2  GLU  21           HG2      GLU  21  89.134  -3.990  -2.821
  160    HG3  GLU  21           HG1      GLU  21  90.744  -4.272  -3.480
  161    H    ILE  22           HN       ILE  22  90.261  -3.997   1.498
  162    HA   ILE  22           HA       ILE  22  92.475  -5.633   2.601
  163    HB   ILE  22           HB       ILE  22  91.064  -3.234   3.784
  164   HG12  ILE  22          HG12      ILE  22  93.478  -3.585   2.239
  165   HG13  ILE  22          HG11      ILE  22  92.790  -2.096   2.870
  166   HG21  ILE  22          HG21      ILE  22  92.508  -3.584   5.769
  167   HG22  ILE  22          HG22      ILE  22  93.101  -5.086   5.063
  168   HG23  ILE  22          HG23      ILE  22  91.407  -4.936   5.523
  169   HD11  ILE  22          HD11      ILE  22  94.638  -3.974   4.373
  170   HD12  ILE  22          HD12      ILE  22  93.923  -2.505   5.040
  171   HD13  ILE  22          HD13      ILE  22  95.073  -2.401   3.708
  172    H    LEU  23           HN       LEU  23  92.015  -7.282   3.863
  173    HA   LEU  23           HA       LEU  23  89.180  -7.761   4.587
  174    HB2  LEU  23           HB2      LEU  23  91.065 -10.026   4.080
  175    HB3  LEU  23           HB1      LEU  23  89.317  -9.942   3.862
  176    HG   LEU  23           HG       LEU  23  90.008  -8.103   2.045
  177   HD11  LEU  23          HD11      LEU  23  92.100  -8.420   1.046
  178   HD12  LEU  23          HD12      LEU  23  92.302 -10.030   1.737
  179   HD13  LEU  23          HD13      LEU  23  92.485  -8.603   2.755
  180   HD21  LEU  23          HD21      LEU  23  90.274 -11.084   1.526
  181   HD22  LEU  23          HD22      LEU  23  89.832  -9.850   0.346
  182   HD23  LEU  23          HD23      LEU  23  88.736 -10.237   1.673
  183    H    GLN  24           HN       GLN  24  88.858  -7.917   6.644
  184    HA   GLN  24           HA       GLN  24  91.009  -8.996   8.395
  185    HB2  GLN  24           HB2      GLN  24  90.779  -6.507   8.594
  186    HB3  GLN  24           HB1      GLN  24  89.123  -6.749   9.143
  187    HG2  GLN  24           HG2      GLN  24  91.105  -8.405  10.576
  188    HG3  GLN  24           HG1      GLN  24  91.334  -6.671  10.797
  189   HE21  GLN  24          HE21      GLN  24  90.359  -6.143  12.763
  190   HE22  GLN  24          HE22      GLN  24  88.811  -6.653  13.238
  191    H    GLY  25           HN       GLY  25  90.145 -11.020   8.777
  192    HA2  GLY  25           HA2      GLY  25  88.816 -12.486   9.995
  193    HA3  GLY  25           HA1      GLY  25  87.750 -11.143  10.409
  194    H    GLU  26           HN       GLU  26  85.772 -11.522   9.661
  195    HA   GLU  26           HA       GLU  26  85.406 -12.939   7.102
  196    HB2  GLU  26           HB2      GLU  26  83.232 -13.462   7.863
  197    HB3  GLU  26           HB1      GLU  26  84.220 -13.573   9.317
  198    HG2  GLU  26           HG2      GLU  26  83.620 -11.107   9.716
  199    HG3  GLU  26           HG1      GLU  26  82.359 -11.345   8.506
  200    H    ARG  27           HN       ARG  27  86.031  -9.954   7.894
  201    HA   ARG  27           HA       ARG  27  83.847  -8.700   6.350
  202    HB2  ARG  27           HB2      ARG  27  85.756  -7.287   8.182
  203    HB3  ARG  27           HB1      ARG  27  84.124  -6.817   7.685
  204    HG2  ARG  27           HG2      ARG  27  83.343  -9.006   8.806
  205    HG3  ARG  27           HG1      ARG  27  84.930  -9.038   9.568
  206    HD2  ARG  27           HD2      ARG  27  83.934  -6.414   9.924
  207    HD3  ARG  27           HD1      ARG  27  82.608  -7.512  10.297
  208    HE   ARG  27           HE       ARG  27  83.749  -8.117  12.210
  209   HH11  ARG  27          HH21      ARG  27  85.923  -6.763   9.885
  210   HH12  ARG  27          HH22      ARG  27  87.295  -6.802  10.941
  211   HH21  ARG  27          HH11      ARG  27  85.544  -8.174  13.599
  212   HH22  ARG  27          HH12      ARG  27  87.082  -7.604  13.042
  213    H    ARG  28           HN       ARG  28  84.286  -7.668   4.496
  214    HA   ARG  28           HA       ARG  28  87.102  -7.015   3.821
  215    HB2  ARG  28           HB2      ARG  28  86.675  -8.901   2.465
  216    HB3  ARG  28           HB1      ARG  28  85.015  -8.402   2.139
  217    HG2  ARG  28           HG2      ARG  28  85.706  -6.659   0.681
  218    HG3  ARG  28           HG1      ARG  28  87.365  -6.711   1.272
  219    HD2  ARG  28           HD2      ARG  28  87.768  -8.817   0.202
  220    HD3  ARG  28           HD1      ARG  28  86.061  -9.024  -0.177
  221    HE   ARG  28           HE       ARG  28  87.975  -7.410  -1.635
  222   HH11  ARG  28          HH21      ARG  28  84.656  -7.977  -0.835
  223   HH12  ARG  28          HH22      ARG  28  84.038  -7.220  -2.264
  224   HH21  ARG  28          HH11      ARG  28  87.170  -6.417  -3.516
  225   HH22  ARG  28          HH12      ARG  28  85.462  -6.337  -3.782
  226    H    TRP  29           HN       TRP  29  87.400  -5.256   2.458
  227    HA   TRP  29           HA       TRP  29  85.118  -3.557   1.814
  228    HB2  TRP  29           HB2      TRP  29  87.403  -2.661   3.568
  229    HB3  TRP  29           HB1      TRP  29  86.079  -1.645   2.995
  230    HD1  TRP  29           HD1      TRP  29  83.541  -2.658   3.737
  231    HE1  TRP  29           HE1      TRP  29  82.856  -3.558   6.062
  232    HE3  TRP  29           HE3      TRP  29  88.142  -3.756   5.624
  233    HZ2  TRP  29           HZ2      TRP  29  84.120  -4.608   8.413
  234    HZ3  TRP  29           HZ3      TRP  29  88.387  -4.701   7.898
  235    HH2  TRP  29           HH2      TRP  29  86.381  -5.133   9.296
  236    H    GLU  30           HN       GLU  30  85.686  -1.835   0.361
  237    HA   GLU  30           HA       GLU  30  88.075  -2.469  -1.224
  238    HB2  GLU  30           HB2      GLU  30  85.570  -0.897  -1.865
  239    HB3  GLU  30           HB1      GLU  30  86.950  -1.029  -2.956
  240    HG2  GLU  30           HG2      GLU  30  85.327  -2.732  -3.560
  241    HG3  GLU  30           HG1      GLU  30  86.733  -3.521  -2.847
  242    H    VAL  31           HN       VAL  31  89.710  -0.913  -1.510
  243    HA   VAL  31           HA       VAL  31  89.259   1.831  -0.562
  244    HB   VAL  31           HB       VAL  31  91.350   1.702   0.812
  245   HG11  VAL  31          HG11      VAL  31  89.048   1.571   1.779
  246   HG12  VAL  31          HG12      VAL  31  90.254   0.702   2.731
  247   HG13  VAL  31          HG13      VAL  31  89.149  -0.189   1.686
  248   HG21  VAL  31          HG21      VAL  31  92.289  -0.411   1.388
  249   HG22  VAL  31          HG22      VAL  31  92.096  -0.457  -0.363
  250   HG23  VAL  31          HG23      VAL  31  90.940  -1.293   0.674
  251    H    LEU  32           HN       LEU  32  90.938   3.281  -1.135
  252    HA   LEU  32           HA       LEU  32  92.305   2.513  -3.629
  253    HB2  LEU  32           HB2      LEU  32  91.044   4.508  -3.914
  254    HB3  LEU  32           HB1      LEU  32  91.529   5.142  -2.345
  255    HG   LEU  32           HG       LEU  32  93.871   5.350  -3.188
  256   HD11  LEU  32          HD11      LEU  32  92.696   3.891  -5.446
  257   HD12  LEU  32          HD12      LEU  32  94.387   4.099  -4.997
  258   HD13  LEU  32          HD13      LEU  32  93.576   5.334  -5.953
  259   HD21  LEU  32          HD21      LEU  32  92.657   7.360  -3.295
  260   HD22  LEU  32          HD22      LEU  32  91.586   6.757  -4.558
  261   HD23  LEU  32          HD23      LEU  32  93.255   7.172  -4.943
  262    H    LEU  33           HN       LEU  33  94.474   2.186  -3.620
  263    HA   LEU  33           HA       LEU  33  95.905   2.656  -1.111
  264    HB2  LEU  33           HB2      LEU  33  96.288   0.483  -2.003
  265    HB3  LEU  33           HB1      LEU  33  96.573   1.108  -3.623
  266    HG   LEU  33           HG       LEU  33  98.453   2.364  -1.828
  267   HD11  LEU  33          HD11      LEU  33  98.278  -0.652  -1.630
  268   HD12  LEU  33          HD12      LEU  33  98.189   0.513  -0.309
  269   HD13  LEU  33          HD13      LEU  33  99.705   0.282  -1.179
  270   HD21  LEU  33          HD21      LEU  33  98.746   1.995  -4.260
  271   HD22  LEU  33          HD22      LEU  33  98.809   0.255  -3.983
  272   HD23  LEU  33          HD23      LEU  33 100.080   1.297  -3.342
  273    H    HIS  34           HN       HIS  34  97.163   4.303  -0.793
  274    HA   HIS  34           HA       HIS  34  97.739   6.113  -3.016
  275    HB2  HIS  34           HB2      HIS  34  97.843   6.332  -0.009
  276    HB3  HIS  34           HB1      HIS  34  98.532   7.588  -1.049
  277    HD2  HIS  34           HD2      HIS  34  94.991   6.101  -0.140
  278    HE1  HIS  34           HE1      HIS  34  94.406   9.615  -2.402
  279    HE2  HIS  34           HE2      HIS  34  93.242   7.814  -1.044
  280    H    ASP  35           HN       ASP  35  99.497   3.898  -0.920
  281    HA   ASP  35           HA       ASP  35 101.649   3.938  -2.708
  282    HB2  ASP  35           HB2      ASP  35 103.406   5.092  -1.474
  283    HB3  ASP  35           HB1      ASP  35 102.034   6.191  -1.638
  284    H    VAL  36           HN       VAL  36 103.537   2.675  -1.979
  285    HA   VAL  36           HA       VAL  36 103.054   0.957   0.339
  286    HB   VAL  36           HB       VAL  36 101.970   0.008  -1.827
  287   HG11  VAL  36          HG11      VAL  36 103.436  -1.058  -3.388
  288   HG12  VAL  36          HG12      VAL  36 104.848  -0.752  -2.379
  289   HG13  VAL  36          HG13      VAL  36 104.039   0.588  -3.194
  290   HG21  VAL  36          HG21      VAL  36 104.035  -1.753  -0.483
  291   HG22  VAL  36          HG22      VAL  36 102.483  -2.237  -1.165
  292   HG23  VAL  36          HG23      VAL  36 102.535  -1.268   0.303
  293    H    SER  37           HN       SER  37 104.875  -0.613   0.632
  294    HA   SER  37           HA       SER  37 107.455   0.313  -0.397
  295    HB2  SER  37           HB2      SER  37 107.071   1.479   1.788
  296    HB3  SER  37           HB1      SER  37 106.886  -0.095   2.555
  297    HG   SER  37           HG       SER  37 109.157   1.102   1.406
  298    H    LEU  38           HN       LEU  38 109.178  -1.379   0.318
  299    HA   LEU  38           HA       LEU  38 108.196  -3.901  -0.475
  300    HB2  LEU  38           HB2      LEU  38 110.828  -3.166   0.846
  301    HB3  LEU  38           HB1      LEU  38 110.471  -4.753   0.167
  302    HG   LEU  38           HG       LEU  38 109.895  -3.488  -2.010
  303   HD11  LEU  38          HD11      LEU  38 109.799  -1.223  -1.382
  304   HD12  LEU  38          HD12      LEU  38 111.391  -1.350  -2.124
  305   HD13  LEU  38          HD13      LEU  38 111.237  -1.341  -0.369
  306   HD21  LEU  38          HD21      LEU  38 112.403  -3.279  -2.544
  307   HD22  LEU  38          HD22      LEU  38 111.853  -4.850  -1.962
  308   HD23  LEU  38          HD23      LEU  38 112.685  -3.745  -0.868
  309    H    HIS  39           HN       HIS  39 107.648  -2.370   2.344
  310    HA   HIS  39           HA       HIS  39 106.811  -4.796   3.646
  311    HB2  HIS  39           HB2      HIS  39 108.172  -4.390   5.711
  312    HB3  HIS  39           HB1      HIS  39 109.119  -4.901   4.314
  313    HD2  HIS  39           HD2      HIS  39 109.046  -1.999   6.813
  314    HE1  HIS  39           HE1      HIS  39 111.395  -0.684   3.560
  315    HE2  HIS  39           HE2      HIS  39 110.692  -0.167   5.945
  316    H    GLY  40           HN       GLY  40 105.349  -2.546   2.809
  317    HA2  GLY  40           HA2      GLY  40 103.862  -1.929   5.117
  318    HA3  GLY  40           HA1      GLY  40 104.955  -0.590   4.804
  319    H    ILE  41           HN       ILE  41 102.096  -0.422   4.708
  320    HA   ILE  41           HA       ILE  41 101.739   0.550   1.957
  321    HB   ILE  41           HB       ILE  41 100.589  -1.278   1.335
  322   HG12  ILE  41          HG12      ILE  41  98.600  -0.533   3.503
  323   HG13  ILE  41          HG11      ILE  41  98.709   0.291   1.948
  324   HG21  ILE  41          HG21      ILE  41  99.904  -3.040   2.960
  325   HG22  ILE  41          HG22      ILE  41 100.481  -2.010   4.270
  326   HG23  ILE  41          HG23      ILE  41 101.613  -2.627   3.067
  327   HD11  ILE  41          HD11      ILE  41  97.255  -2.054   2.530
  328   HD12  ILE  41          HD12      ILE  41  98.618  -2.570   1.537
  329   HD13  ILE  41          HD13      ILE  41  97.516  -1.327   0.946
  330    H    LEU  42           HN       LEU  42 100.197   2.077   1.682
  331    HA   LEU  42           HA       LEU  42  98.934   3.173   4.128
  332    HB2  LEU  42           HB2      LEU  42 100.895   4.451   2.725
  333    HB3  LEU  42           HB1      LEU  42  99.467   5.030   1.872
  334    HG   LEU  42           HG       LEU  42  99.757   5.127   4.886
  335   HD11  LEU  42          HD11      LEU  42 100.495   7.110   2.743
  336   HD12  LEU  42          HD12      LEU  42 101.406   6.647   4.179
  337   HD13  LEU  42          HD13      LEU  42  99.981   7.668   4.334
  338   HD21  LEU  42          HD21      LEU  42  97.873   6.548   2.988
  339   HD22  LEU  42          HD22      LEU  42  97.876   6.667   4.748
  340   HD23  LEU  42          HD23      LEU  42  97.449   5.147   3.970
  341    H    VAL  43           HN       VAL  43  96.723   3.282   3.953
  342    HA   VAL  43           HA       VAL  43  95.556   3.293   1.233
  343    HB   VAL  43           HB       VAL  43  93.834   1.732   1.981
  344   HG11  VAL  43          HG11      VAL  43  95.167  -0.230   1.924
  345   HG12  VAL  43          HG12      VAL  43  96.510   0.560   2.748
  346   HG13  VAL  43          HG13      VAL  43  96.130   0.980   1.078
  347   HG21  VAL  43          HG21      VAL  43  93.731   2.289   4.339
  348   HG22  VAL  43          HG22      VAL  43  95.408   1.795   4.572
  349   HG23  VAL  43          HG23      VAL  43  94.176   0.588   4.203
  350    H    GLY  44           HN       GLY  44  93.119   3.672   1.410
  351    HA2  GLY  44           HA2      GLY  44  92.705   6.113   3.039
  352    HA3  GLY  44           HA1      GLY  44  91.757   5.646   1.626
  353    H    GLN  45           HN       GLN  45  90.933   6.243   4.559
  354    HA   GLN  45           HA       GLN  45  90.049   3.684   5.522
  355    HB2  GLN  45           HB2      GLN  45  90.764   5.523   7.013
  356    HB3  GLN  45           HB1      GLN  45  89.373   6.464   6.484
  357    HG2  GLN  45           HG2      GLN  45  88.577   3.777   7.307
  358    HG3  GLN  45           HG1      GLN  45  89.423   4.619   8.602
  359   HE21  GLN  45          HE21      GLN  45  86.891   5.390   6.129
  360   HE22  GLN  45          HE22      GLN  45  85.932   6.293   7.199
  361    HA   PRO  46           HA       PRO  46  86.174   4.444   3.308
  362    HB2  PRO  46           HB2      PRO  46  85.235   1.902   3.182
  363    HB3  PRO  46           HB1      PRO  46  86.623   2.414   2.195
  364    HG2  PRO  46           HG2      PRO  46  86.584   0.867   4.746
  365    HG3  PRO  46           HG1      PRO  46  87.606   0.651   3.316
  366    HD2  PRO  46           HD2      PRO  46  88.383   2.008   5.646
  367    HD3  PRO  46           HD1      PRO  46  89.160   2.181   4.060
  368    H    GLN  47           HN       GLN  47  83.852   4.260   3.853
  369    HA   GLN  47           HA       GLN  47  83.332   4.766   6.585
  370    HB2  GLN  47           HB2      GLN  47  80.980   4.854   5.909
  371    HB3  GLN  47           HB1      GLN  47  82.000   5.726   4.765
  372    HG2  GLN  47           HG2      GLN  47  82.084   3.503   3.445
  373    HG3  GLN  47           HG1      GLN  47  80.709   3.021   4.439
  374   HE21  GLN  47          HE21      GLN  47  80.170   3.216   1.757
  375   HE22  GLN  47          HE22      GLN  47  79.284   4.623   1.416
  376    H    ASP  48           HN       ASP  48  83.098   1.833   4.664
  377    HA   ASP  48           HA       ASP  48  81.528   0.407   6.626
  378    HB2  ASP  48           HB2      ASP  48  82.972  -0.451   4.122
  379    HB3  ASP  48           HB1      ASP  48  82.077  -1.570   5.151
  380    H    TRP  49           HN       TRP  49  84.530   1.469   6.939
  381    HA   TRP  49           HA       TRP  49  86.156  -0.748   7.501
  382    HB2  TRP  49           HB2      TRP  49  86.892   1.647   7.332
  383    HB3  TRP  49           HB1      TRP  49  86.226   1.901   8.943
  384    HD1  TRP  49           HD1      TRP  49  87.527   0.968  10.964
  385    HE1  TRP  49           HE1      TRP  49  89.908  -0.078  11.243
  386    HE3  TRP  49           HE3      TRP  49  88.537  -0.021   6.113
  387    HZ2  TRP  49           HZ2      TRP  49  91.998  -1.221   9.463
  388    HZ3  TRP  49           HZ3      TRP  49  90.655  -1.080   5.418
  389    HH2  TRP  49           HH2      TRP  49  92.355  -1.683   7.103
  390    H    ASN  50           HN       ASN  50  84.223  -2.019   8.566
  391    HA   ASN  50           HA       ASN  50  84.023  -1.357  11.417
  392    HB2  ASN  50           HB2      ASN  50  81.923  -1.961  10.277
  393    HB3  ASN  50           HB1      ASN  50  82.613  -3.515   9.812
  394   HD21  ASN  50          HD21      ASN  50  83.738  -4.565  12.024
  395   HD22  ASN  50          HD22      ASN  50  82.647  -4.639  13.322
  396    H    GLY  51           HN       GLY  51  86.276  -1.806  11.785
  397    HA2  GLY  51           HA2      GLY  51  86.737  -4.659  12.343
  398    HA3  GLY  51           HA1      GLY  51  87.927  -3.792  11.376
  399    H    ASP  52           HN       ASP  52  88.500  -5.017  13.825
  400    HA   ASP  52           HA       ASP  52  88.699  -2.876  15.811
  401    HB2  ASP  52           HB2      ASP  52  89.098  -5.843  15.823
  402    HB3  ASP  52           HB1      ASP  52  89.820  -4.862  17.098
  403    HA   PRO  53           HA       PRO  53  92.732  -1.887  13.962
  404    HB2  PRO  53           HB2      PRO  53  92.923  -0.373  16.529
  405    HB3  PRO  53           HB1      PRO  53  93.257   0.170  14.873
  406    HG2  PRO  53           HG2      PRO  53  91.026   0.873  16.163
  407    HG3  PRO  53           HG1      PRO  53  91.050   0.578  14.416
  408    HD2  PRO  53           HD2      PRO  53  89.906  -1.107  16.588
  409    HD3  PRO  53           HD1      PRO  53  89.422  -0.972  14.884
  410    H    GLN  54           HN       GLN  54  92.039  -3.250  17.075
  411    HA   GLN  54           HA       GLN  54  94.770  -3.729  17.781
  412    HB2  GLN  54           HB2      GLN  54  92.343  -5.152  18.881
  413    HB3  GLN  54           HB1      GLN  54  93.908  -4.931  19.663
  414    HG2  GLN  54           HG2      GLN  54  93.470  -2.404  19.445
  415    HG3  GLN  54           HG1      GLN  54  91.801  -2.847  19.086
  416   HE21  GLN  54          HE21      GLN  54  94.067  -4.384  21.419
  417   HE22  GLN  54          HE22      GLN  54  93.091  -4.098  22.778
  418    H    ARG  55           HN       ARG  55  92.416  -5.396  15.853
  419    HA   ARG  55           HA       ARG  55  93.991  -7.874  15.895
  420    HB2  ARG  55           HB2      ARG  55  91.221  -7.133  15.142
  421    HB3  ARG  55           HB1      ARG  55  91.973  -8.362  14.125
  422    HG2  ARG  55           HG2      ARG  55  92.499  -9.713  16.109
  423    HG3  ARG  55           HG1      ARG  55  91.814  -8.469  17.153
  424    HD2  ARG  55           HD2      ARG  55  90.135  -9.628  14.950
  425    HD3  ARG  55           HD1      ARG  55  90.343 -10.534  16.446
  426    HE   ARG  55           HE       ARG  55  89.618  -8.143  17.404
  427   HH11  ARG  55          HH21      ARG  55  88.407 -10.031  14.770
  428   HH12  ARG  55          HH22      ARG  55  86.785  -9.443  14.914
  429   HH21  ARG  55          HH11      ARG  55  87.493  -7.370  17.602
  430   HH22  ARG  55          HH12      ARG  55  86.267  -7.937  16.519
  431    HA   PRO  56           HA       PRO  56  96.131  -7.028  12.187
  432    HB2  PRO  56           HB2      PRO  56  96.199  -9.498  10.973
  433    HB3  PRO  56           HB1      PRO  56  97.197  -9.055  12.371
  434    HG2  PRO  56           HG2      PRO  56  94.667 -10.621  12.275
  435    HG3  PRO  56           HG1      PRO  56  96.112 -10.869  13.270
  436    HD2  PRO  56           HD2      PRO  56  93.836  -9.712  14.240
  437    HD3  PRO  56           HD1      PRO  56  95.456  -9.311  14.854
  438    H    PHE  57           HN       PHE  57  96.036  -6.932   9.875
  439    HA   PHE  57           HA       PHE  57  93.335  -7.264   8.703
  440    HB2  PHE  57           HB2      PHE  57  95.217  -4.907   8.366
  441    HB3  PHE  57           HB1      PHE  57  93.713  -5.143   7.479
  442    HD1  PHE  57           HD2      PHE  57  95.113  -4.753  10.923
  443    HD2  PHE  57           HD1      PHE  57  91.636  -4.491   8.419
  444    HE1  PHE  57           HE2      PHE  57  93.846  -3.704  12.780
  445    HE2  PHE  57           HE1      PHE  57  90.370  -3.453  10.274
  446    HZ   PHE  57           HZ       PHE  57  91.473  -3.059  12.455
  447    H    GLU  58           HN       GLU  58  93.439  -7.598   6.321
  448    HA   GLU  58           HA       GLU  58  96.146  -8.341   5.395
  449    HB2  GLU  58           HB2      GLU  58  93.633  -9.716   4.423
  450    HB3  GLU  58           HB1      GLU  58  95.305 -10.252   4.252
  451    HG2  GLU  58           HG2      GLU  58  95.451 -10.518   6.714
  452    HG3  GLU  58           HG1      GLU  58  93.760 -10.044   6.851
  453    H    ALA  59           HN       ALA  59  96.728  -7.575   3.334
  454    HA   ALA  59           HA       ALA  59  94.695  -5.875   1.980
  455    HB1  ALA  59           HB1      ALA  59  97.073  -4.875   1.177
  456    HB2  ALA  59           HB2      ALA  59  97.491  -5.430   2.796
  457    HB3  ALA  59           HB3      ALA  59  96.173  -4.281   2.570
  458    H    ARG  60           HN       ARG  60  94.400  -6.085  -0.139
  459    HA   ARG  60           HA       ARG  60  96.214  -7.862  -1.667
  460    HB2  ARG  60           HB2      ARG  60  93.199  -7.655  -1.704
  461    HB3  ARG  60           HB1      ARG  60  94.107  -8.346  -3.048
  462    HG2  ARG  60           HG2      ARG  60  95.249  -9.774  -1.117
  463    HG3  ARG  60           HG1      ARG  60  93.758  -9.392  -0.257
  464    HD2  ARG  60           HD2      ARG  60  93.982 -10.742  -2.957
  465    HD3  ARG  60           HD1      ARG  60  93.484 -11.500  -1.448
  466    HE   ARG  60           HE       ARG  60  91.685  -9.494  -1.709
  467   HH11  ARG  60          HH21      ARG  60  92.882 -11.926  -3.861
  468   HH12  ARG  60          HH22      ARG  60  91.408 -12.047  -4.765
  469   HH21  ARG  60          HH11      ARG  60  89.750  -9.647  -2.891
  470   HH22  ARG  60          HH12      ARG  60  89.637 -10.756  -4.217
  471    H    LEU  61           HN       LEU  61  97.121  -6.828  -3.391
  472    HA   LEU  61           HA       LEU  61  95.931  -4.245  -4.198
  473    HB2  LEU  61           HB2      LEU  61  98.738  -5.301  -4.120
  474    HB3  LEU  61           HB1      LEU  61  98.324  -4.030  -5.268
  475    HG   LEU  61           HG       LEU  61  97.425  -2.661  -3.395
  476   HD11  LEU  61          HD11      LEU  61  96.770  -4.137  -1.711
  477   HD12  LEU  61          HD12      LEU  61  98.295  -3.533  -1.067
  478   HD13  LEU  61          HD13      LEU  61  98.233  -5.112  -1.850
  479   HD21  LEU  61          HD21      LEU  61  99.727  -2.371  -2.233
  480   HD22  LEU  61          HD22      LEU  61  99.654  -2.125  -3.977
  481   HD23  LEU  61          HD23      LEU  61 100.281  -3.639  -3.325
  482    H    TYR  62           HN       TYR  62  95.777  -3.701  -6.384
  483    HA   TYR  62           HA       TYR  62  96.078  -5.919  -8.306
  484    HB2  TYR  62           HB2      TYR  62  93.698  -4.046  -8.237
  485    HB3  TYR  62           HB1      TYR  62  93.932  -5.436  -9.296
  486    HD1  TYR  62           HD1      TYR  62  93.311  -4.371  -5.805
  487    HD2  TYR  62           HD2      TYR  62  93.560  -7.683  -8.528
  488    HE1  TYR  62           HE1      TYR  62  92.279  -5.855  -4.099
  489    HE2  TYR  62           HE2      TYR  62  92.530  -9.164  -6.825
  490    HH   TYR  62           HH       TYR  62  90.888  -8.663  -4.711
  491    H    LEU  63           HN       LEU  63  97.618  -5.228  -9.604
  492    HA   LEU  63           HA       LEU  63  97.663  -2.401 -10.474
  493    HB2  LEU  63           HB2      LEU  63  99.749  -4.553 -10.246
  494    HB3  LEU  63           HB1      LEU  63  99.987  -3.215 -11.370
  495    HG   LEU  63           HG       LEU  63  99.787  -1.598  -9.579
  496   HD11  LEU  63          HD11      LEU  63  98.152  -2.440  -8.118
  497   HD12  LEU  63          HD12      LEU  63  99.631  -2.623  -7.178
  498   HD13  LEU  63          HD13      LEU  63  98.931  -4.018  -8.000
  499   HD21  LEU  63          HD21      LEU  63 101.974  -2.819  -9.931
  500   HD22  LEU  63          HD22      LEU  63 101.532  -3.869  -8.586
  501   HD23  LEU  63          HD23      LEU  63 101.772  -2.143  -8.316
  502    H    GLY  64           HN       GLY  64  99.142  -5.083 -12.175
  503    HA2  GLY  64           HA2      GLY  64  97.919  -4.353 -14.662
  504    HA3  GLY  64           HA1      GLY  64  98.915  -5.781 -14.370
  505    H    LEU  65           HN       LEU  65  96.851  -6.337 -15.957
  506    HA   LEU  65           HA       LEU  65  94.453  -6.898 -14.511
  507    HB2  LEU  65           HB2      LEU  65  95.022  -8.393 -17.034
  508    HB3  LEU  65           HB1      LEU  65  93.550  -7.569 -16.523
  509    HG   LEU  65           HG       LEU  65  95.116  -5.409 -16.748
  510   HD11  LEU  65          HD11      LEU  65  96.851  -5.579 -18.301
  511   HD12  LEU  65          HD12      LEU  65  96.201  -7.050 -19.023
  512   HD13  LEU  65          HD13      LEU  65  97.004  -7.120 -17.456
  513   HD21  LEU  65          HD21      LEU  65  93.040  -5.678 -17.965
  514   HD22  LEU  65          HD22      LEU  65  93.757  -6.903 -19.012
  515   HD23  LEU  65          HD23      LEU  65  94.290  -5.225 -19.124
  516    H    ASP  66           HN       ASP  66  97.380  -8.708 -15.292
  517    HA   ASP  66           HA       ASP  66  96.330 -11.195 -14.112
  518    HB2  ASP  66           HB2      ASP  66  97.514 -11.039 -16.374
  519    HB3  ASP  66           HB1      ASP  66  98.980 -10.730 -15.444
  520    H    VAL  67           HN       VAL  67  97.575  -8.465 -12.882
  521    HA   VAL  67           HA       VAL  67  99.591  -9.817 -11.186
  522    HB   VAL  67           HB       VAL  67  99.183  -6.922 -11.923
  523   HG11  VAL  67          HG11      VAL  67  99.619  -6.758  -9.594
  524   HG12  VAL  67          HG12      VAL  67 101.205  -6.592 -10.343
  525   HG13  VAL  67          HG13      VAL  67 100.729  -8.128  -9.622
  526   HG21  VAL  67          HG21      VAL  67 101.722  -8.558 -11.949
  527   HG22  VAL  67          HG22      VAL  67 101.337  -7.107 -12.876
  528   HG23  VAL  67          HG23      VAL  67 100.575  -8.643 -13.287
  529    H    LEU  68           HN       LEU  68  98.411 -10.764  -9.649
  530    HA   LEU  68           HA       LEU  68  96.757  -9.024  -7.919
  531    HB2  LEU  68           HB2      LEU  68  95.314 -10.719  -8.661
  532    HB3  LEU  68           HB1      LEU  68  96.589 -11.934  -8.672
  533    HG   LEU  68           HG       LEU  68  96.645 -11.952  -6.236
  534   HD11  LEU  68          HD11      LEU  68  94.859  -9.581  -6.602
  535   HD12  LEU  68          HD12      LEU  68  96.136  -9.853  -5.416
  536   HD13  LEU  68          HD13      LEU  68  94.562 -10.617  -5.206
  537   HD21  LEU  68          HD21      LEU  68  93.920 -12.224  -7.518
  538   HD22  LEU  68          HD22      LEU  68  94.215 -12.680  -5.840
  539   HD23  LEU  68          HD23      LEU  68  95.076 -13.502  -7.142
  540    H    ILE  69           HN       ILE  69  97.810  -8.463  -6.106
  541    HA   ILE  69           HA       ILE  69  99.882 -10.308  -5.053
  542    HB   ILE  69           HB       ILE  69  99.666  -7.298  -4.959
  543   HG12  ILE  69          HG12      ILE  69 102.179  -8.504  -5.836
  544   HG13  ILE  69          HG11      ILE  69 100.829  -9.099  -6.798
  545   HG21  ILE  69          HG21      ILE  69 102.113  -7.928  -3.876
  546   HG22  ILE  69          HG22      ILE  69 101.096  -9.198  -3.200
  547   HG23  ILE  69          HG23      ILE  69 100.688  -7.508  -2.927
  548   HD11  ILE  69          HD11      ILE  69 101.511  -6.188  -6.299
  549   HD12  ILE  69          HD12      ILE  69 100.119  -6.760  -7.219
  550   HD13  ILE  69          HD13      ILE  69 101.754  -7.070  -7.809
  551    H    ARG  70           HN       ARG  70  99.977 -10.760  -2.881
  552    HA   ARG  70           HA       ARG  70  97.763  -9.768  -1.189
  553    HB2  ARG  70           HB2      ARG  70  97.597 -12.023  -0.177
  554    HB3  ARG  70           HB1      ARG  70  97.176 -12.023  -1.889
  555    HG2  ARG  70           HG2      ARG  70  99.417 -12.839  -2.465
  556    HG3  ARG  70           HG1      ARG  70  99.884 -12.796  -0.765
  557    HD2  ARG  70           HD2      ARG  70  97.774 -14.548  -2.042
  558    HD3  ARG  70           HD1      ARG  70  99.272 -15.067  -1.275
  559    HE   ARG  70           HE       ARG  70  96.810 -14.486   0.054
  560   HH11  ARG  70          HH21      ARG  70 100.253 -14.247   0.294
  561   HH12  ARG  70          HH22      ARG  70 100.273 -14.267   2.026
  562   HH21  ARG  70          HH11      ARG  70  96.827 -14.509   2.324
  563   HH22  ARG  70          HH12      ARG  70  98.333 -14.413   3.174
  564    H    MET  71           HN       MET  71  98.291  -9.150   0.803
  565    HA   MET  71           HA       MET  71 100.874  -9.923   1.969
  566    HB2  MET  71           HB2      MET  71 100.703  -7.168   2.471
  567    HB3  MET  71           HB1      MET  71 101.857  -7.981   1.422
  568    HG2  MET  71           HG2      MET  71 100.696  -7.439  -0.511
  569    HG3  MET  71           HG1      MET  71  99.143  -7.361   0.317
  570    HE1  MET  71           HE1      MET  71 102.390  -5.707   1.779
  571    HE2  MET  71           HE2      MET  71 102.497  -4.248   0.797
  572    HE3  MET  71           HE3      MET  71 102.645  -5.829   0.033
  573    H    GLU  72           HN       GLU  72 100.941  -9.675   4.240
  574    HA   GLU  72           HA       GLU  72  98.298  -9.259   5.466
  575    HB2  GLU  72           HB2      GLU  72  99.672 -11.437   5.841
  576    HB3  GLU  72           HB1      GLU  72 100.676 -10.445   6.900
  577    HG2  GLU  72           HG2      GLU  72  98.551  -9.743   8.090
  578    HG3  GLU  72           HG1      GLU  72  97.707 -10.979   7.157
  579    H    ILE  73           HN       ILE  73  98.046  -7.536   6.945
  580    HA   ILE  73           HA       ILE  73 100.502  -6.134   7.766
  581    HB   ILE  73           HB       ILE  73  99.871  -4.087   6.832
  582   HG12  ILE  73          HG12      ILE  73  97.133  -5.364   6.570
  583   HG13  ILE  73          HG11      ILE  73  97.566  -3.929   7.491
  584   HG21  ILE  73          HG21      ILE  73 100.588  -5.839   5.172
  585   HG22  ILE  73          HG22      ILE  73  99.577  -4.583   4.473
  586   HG23  ILE  73          HG23      ILE  73  98.885  -6.158   4.847
  587   HD11  ILE  73          HD11      ILE  73  98.350  -3.210   4.953
  588   HD12  ILE  73          HD12      ILE  73  96.800  -2.794   5.680
  589   HD13  ILE  73          HD13      ILE  73  96.931  -4.203   4.636
  590    H    SER  74           HN       SER  74 100.230  -4.587   9.448
  591    HA   SER  74           HA       SER  74  97.748  -4.892  11.045
  592    HB2  SER  74           HB2      SER  74  99.218  -5.980  12.448
  593    HB3  SER  74           HB1      SER  74 100.618  -5.099  11.840
  594    HG   SER  74           HG       SER  74 100.131  -3.423  13.123
  595    H    LEU  75           HN       LEU  75  97.175  -3.034  12.357
  596    HA   LEU  75           HA       LEU  75  97.436  -0.547  11.011
  597    HB2  LEU  75           HB2      LEU  75  95.628  -1.457  12.695
  598    HB3  LEU  75           HB1      LEU  75  96.680  -0.730  13.905
  599    HG   LEU  75           HG       LEU  75  95.054   0.930  13.300
  600   HD11  LEU  75          HD11      LEU  75  96.438   2.725  12.651
  601   HD12  LEU  75          HD12      LEU  75  97.465   1.690  11.662
  602   HD13  LEU  75          HD13      LEU  75  97.535   1.581  13.421
  603   HD21  LEU  75          HD21      LEU  75  94.401   1.479  11.114
  604   HD22  LEU  75          HD22      LEU  75  94.597  -0.268  11.030
  605   HD23  LEU  75          HD23      LEU  75  95.856   0.793  10.397
  606    H    ALA  76           HN       ALA  76  99.121   0.754  10.977
  607    HA   ALA  76           HA       ALA  76 101.065   0.642  13.172
  608    HB1  ALA  76           HB1      ALA  76 101.313   1.833  10.403
  609    HB2  ALA  76           HB2      ALA  76 102.042   0.330  10.963
  610    HB3  ALA  76           HB3      ALA  76 102.579   1.868  11.631
  611    H    TRP  77           HN       TRP  77  99.029   2.833  11.349
  612    HA   TRP  77           HA       TRP  77  98.578   4.564  13.587
  613    HB2  TRP  77           HB2      TRP  77  99.692   6.585  12.716
  614    HB3  TRP  77           HB1      TRP  77 100.881   5.306  12.986
  615    HD1  TRP  77           HD1      TRP  77 102.072   4.266  10.910
  616    HE1  TRP  77           HE1      TRP  77 101.952   4.680   8.377
  617    HE3  TRP  77           HE3      TRP  77  98.240   7.644  10.734
  618    HZ2  TRP  77           HZ2      TRP  77 100.640   6.426   6.561
  619    HZ3  TRP  77           HZ3      TRP  77  97.590   8.687   8.581
  620    HH2  TRP  77           HH2      TRP  77  98.764   8.068   6.484
  621    H    ALA  78           HN       ALA  78  97.324   6.566  12.869
  622    HA   ALA  78           HA       ALA  78  96.039   6.367  10.234
  623    HB1  ALA  78           HB1      ALA  78  94.613   4.909  11.464
  624    HB2  ALA  78           HB2      ALA  78  93.777   6.458  11.349
  625    HB3  ALA  78           HB3      ALA  78  94.583   6.000  12.850
  626    H    ARG  79           HN       ARG  79  95.913   8.469   9.495
  627    HA   ARG  79           HA       ARG  79  95.048  10.536  11.342
  628    HB2  ARG  79           HB2      ARG  79  97.143  11.174  11.872
  629    HB3  ARG  79           HB1      ARG  79  97.849  10.203  10.586
  630    HG2  ARG  79           HG2      ARG  79  97.443  11.949   8.954
  631    HG3  ARG  79           HG1      ARG  79  96.516  12.890  10.124
  632    HD2  ARG  79           HD2      ARG  79  99.358  12.122  10.726
  633    HD3  ARG  79           HD1      ARG  79  99.016  13.513   9.701
  634    HE   ARG  79           HE       ARG  79  97.447  14.017  11.829
  635   HH11  ARG  79          HH21      ARG  79 100.732  12.975  11.534
  636   HH12  ARG  79          HH22      ARG  79 101.254  13.742  12.996
  637   HH21  ARG  79          HH11      ARG  79  98.123  15.030  13.748
  638   HH22  ARG  79          HH12      ARG  79  99.776  14.907  14.250
  639    H    ASP  80           HN       ASP  80  93.864  12.088  10.423
  640    HA   ASP  80           HA       ASP  80  92.747  13.282   8.829
  641    HB2  ASP  80           HB2      ASP  80  95.408  12.974   7.445
  642    HB3  ASP  80           HB1      ASP  80  94.132  14.071   6.920
  643    H    GLY  81           HN       GLY  81  91.919  10.620   8.654
  644    HA2  GLY  81           HA2      GLY  81  90.544   9.525   7.160
  645    HA3  GLY  81           HA1      GLY  81  91.125  10.579   5.883
  646    H    LEU  82           HN       LEU  82  94.008   9.829   6.499
  647    HA   LEU  82           HA       LEU  82  93.966   7.408   4.879
  648    HB2  LEU  82           HB2      LEU  82  96.477   8.763   5.811
  649    HB3  LEU  82           HB1      LEU  82  96.155   7.922   4.296
  650    HG   LEU  82           HG       LEU  82  95.051  10.619   5.123
  651   HD11  LEU  82          HD11      LEU  82  96.890   9.808   2.848
  652   HD12  LEU  82          HD12      LEU  82  97.422  10.576   4.344
  653   HD13  LEU  82          HD13      LEU  82  96.366  11.447   3.233
  654   HD21  LEU  82          HD21      LEU  82  94.456   8.788   2.793
  655   HD22  LEU  82          HD22      LEU  82  94.197  10.529   2.685
  656   HD23  LEU  82          HD23      LEU  82  93.315   9.580   3.880
  657    H    LEU  83           HN       LEU  83  95.239   5.546   5.409
  658    HA   LEU  83           HA       LEU  83  95.629   5.119   8.342
  659    HB2  LEU  83           HB2      LEU  83  94.643   3.107   6.333
  660    HB3  LEU  83           HB1      LEU  83  94.769   2.911   8.079
  661    HG   LEU  83           HG       LEU  83  93.005   4.967   6.717
  662   HD11  LEU  83          HD11      LEU  83  91.180   3.378   7.598
  663   HD12  LEU  83          HD12      LEU  83  92.463   2.183   7.762
  664   HD13  LEU  83          HD13      LEU  83  92.075   2.845   6.175
  665   HD21  LEU  83          HD21      LEU  83  91.946   4.856   9.089
  666   HD22  LEU  83          HD22      LEU  83  93.467   5.733   8.915
  667   HD23  LEU  83          HD23      LEU  83  93.462   4.099   9.577
  668    H    GLY  84           HN       GLY  84  97.618   4.219   8.868
  669    HA2  GLY  84           HA2      GLY  84  99.356   3.381   6.658
  670    HA3  GLY  84           HA1      GLY  84  99.863   3.780   8.294
  671    H    PHE  85           HN       PHE  85 100.443   1.375   6.743
  672    HA   PHE  85           HA       PHE  85  99.551  -0.557   8.753
  673    HB2  PHE  85           HB2      PHE  85  99.001  -0.731   5.798
  674    HB3  PHE  85           HB1      PHE  85  99.118  -2.174   6.798
  675    HD1  PHE  85           HD2      PHE  85  97.692  -2.244   8.946
  676    HD2  PHE  85           HD1      PHE  85  96.968   0.469   5.709
  677    HE1  PHE  85           HE2      PHE  85  95.380  -1.919   9.754
  678    HE2  PHE  85           HE1      PHE  85  94.641   0.798   6.518
  679    HZ   PHE  85           HZ       PHE  85  93.854  -0.387   8.542
  680    H    GLU  86           HN       GLU  86 101.104  -2.029   9.255
  681    HA   GLU  86           HA       GLU  86 103.609  -1.853   7.721
  682    HB2  GLU  86           HB2      GLU  86 104.503  -3.050   9.832
  683    HB3  GLU  86           HB1      GLU  86 104.038  -1.354   9.992
  684    HG2  GLU  86           HG2      GLU  86 101.866  -1.996  10.901
  685    HG3  GLU  86           HG1      GLU  86 102.236  -3.700  10.652
  686    H    CYS  87           HN       CYS  87 104.214  -3.570   6.508
  687    HA   CYS  87           HA       CYS  87 102.528  -5.901   6.404
  688    HB2  CYS  87           HB2      CYS  87 103.480  -5.028   4.352
  689    HB3  CYS  87           HB1      CYS  87 105.110  -5.233   4.990
  690    HG   CYS  87           HG       CYS  87 103.256  -7.715   4.560
  691    H    GLN  88           HN       GLN  88 102.761  -7.762   7.419
  692    HA   GLN  88           HA       GLN  88 105.226  -8.232   8.971
  693    HB2  GLN  88           HB2      GLN  88 103.157 -10.106   9.616
  694    HB3  GLN  88           HB1      GLN  88 103.833  -8.833  10.630
  695    HG2  GLN  88           HG2      GLN  88 102.287  -7.200   9.564
  696    HG3  GLN  88           HG1      GLN  88 101.574  -8.518   8.634
  697   HE21  GLN  88          HE21      GLN  88 100.405  -6.756  10.844
  698   HE22  GLN  88          HE22      GLN  88  99.793  -7.861  11.978
  699    H    HIS  89           HN       HIS  89 103.217  -9.483   6.414
  700    HA   HIS  89           HA       HIS  89 105.289 -11.339   5.645
  701    HB2  HIS  89           HB2      HIS  89 104.459 -13.088   6.831
  702    HB3  HIS  89           HB1      HIS  89 102.938 -12.258   7.150
  703    HD2  HIS  89           HD2      HIS  89 101.024 -13.955   6.104
  704    HE1  HIS  89           HE1      HIS  89 102.908 -14.776   2.415
  705    HE2  HIS  89           HE2      HIS  89 100.810 -15.161   3.797
  706    H    ILE  90           HN       ILE  90 105.204 -11.812   3.515
  707    HA   ILE  90           HA       ILE  90 102.793 -11.293   1.923
  708    HB   ILE  90           HB       ILE  90 103.846  -9.108   1.932
  709   HG12  ILE  90          HG12      ILE  90 104.641 -10.525  -0.628
  710   HG13  ILE  90          HG11      ILE  90 102.982 -10.077  -0.238
  711   HG21  ILE  90          HG21      ILE  90 106.257  -9.061   0.910
  712   HG22  ILE  90          HG22      ILE  90 106.332 -10.732   1.474
  713   HG23  ILE  90          HG23      ILE  90 106.052  -9.425   2.623
  714   HD11  ILE  90          HD11      ILE  90 103.685  -8.220  -1.471
  715   HD12  ILE  90          HD12      ILE  90 105.329  -8.300  -0.838
  716   HD13  ILE  90          HD13      ILE  90 104.022  -7.693   0.177
  717    H    ASP  91           HN       ASP  91 102.615 -12.427   0.155
  718    HA   ASP  91           HA       ASP  91 103.878 -14.890  -0.006
  719    HB2  ASP  91           HB2      ASP  91 101.995 -13.366  -1.615
  720    HB3  ASP  91           HB1      ASP  91 103.038 -14.373  -2.616
  721    H    LEU  92           HN       LEU  92 105.518 -15.759  -1.081
  722    HA   LEU  92           HA       LEU  92 107.817 -14.281  -1.667
  723    HB2  LEU  92           HB2      LEU  92 107.877 -16.694  -1.250
  724    HB3  LEU  92           HB1      LEU  92 107.007 -16.993  -2.754
  725    HG   LEU  92           HG       LEU  92 109.444 -15.330  -3.049
  726   HD11  LEU  92          HD11      LEU  92 110.922 -17.366  -2.956
  727   HD12  LEU  92          HD12      LEU  92 109.587 -18.236  -2.200
  728   HD13  LEU  92          HD13      LEU  92 110.315 -16.853  -1.382
  729   HD21  LEU  92          HD21      LEU  92 107.907 -16.373  -4.859
  730   HD22  LEU  92          HD22      LEU  92 108.709 -17.893  -4.473
  731   HD23  LEU  92          HD23      LEU  92 109.649 -16.532  -5.083
  732    H    ASP  93           HN       ASP  93 105.269 -15.456  -3.828
  733    HA   ASP  93           HA       ASP  93 106.438 -14.488  -6.233
  734    HB2  ASP  93           HB2      ASP  93 104.741 -16.196  -6.369
  735    HB3  ASP  93           HB1      ASP  93 103.583 -15.186  -5.505
  736    H    SER  94           HN       SER  94 104.242 -13.165  -3.830
  737    HA   SER  94           HA       SER  94 103.563 -10.785  -5.236
  738    HB2  SER  94           HB2      SER  94 103.413 -11.689  -2.379
  739    HB3  SER  94           HB1      SER  94 103.115 -10.000  -2.779
  740    HG   SER  94           HG       SER  94 101.820 -11.499  -4.537
  741    H    ILE  95           HN       ILE  95 106.142 -11.710  -3.035
  742    HA   ILE  95           HA       ILE  95 107.244  -9.181  -2.514
  743    HB   ILE  95           HB       ILE  95 108.356 -11.973  -2.593
  744   HG12  ILE  95          HG12      ILE  95 106.945 -10.667  -0.693
  745   HG13  ILE  95          HG11      ILE  95 108.153 -11.886  -0.307
  746   HG21  ILE  95          HG21      ILE  95 110.475 -10.901  -1.591
  747   HG22  ILE  95          HG22      ILE  95 109.903  -9.399  -2.318
  748   HG23  ILE  95          HG23      ILE  95 110.260 -10.795  -3.337
  749   HD11  ILE  95          HD11      ILE  95 108.390  -9.742   1.004
  750   HD12  ILE  95          HD12      ILE  95 108.771  -8.925  -0.511
  751   HD13  ILE  95          HD13      ILE  95 109.831 -10.195   0.101
  752    H    SER  96           HN       SER  96 107.675 -11.423  -5.216
  753    HA   SER  96           HA       SER  96 109.767  -9.891  -6.375
  754    HB2  SER  96           HB2      SER  96 108.668 -12.419  -6.854
  755    HB3  SER  96           HB1      SER  96 108.247 -11.500  -8.300
  756    HG   SER  96           HG       SER  96 110.293 -11.424  -8.836
  757    H    HIS  97           HN       HIS  97 106.259  -9.905  -6.858
  758    HA   HIS  97           HA       HIS  97 106.372  -8.202  -9.120
  759    HB2  HIS  97           HB2      HIS  97 104.227  -8.787  -7.079
  760    HB3  HIS  97           HB1      HIS  97 104.003  -7.534  -8.283
  761    HD2  HIS  97           HD2      HIS  97 103.981 -11.409  -8.058
  762    HE1  HIS  97           HE1      HIS  97 103.253 -10.339 -12.076
  763    HE2  HIS  97           HE2      HIS  97 103.282 -12.270 -10.426
  764    H    LEU  98           HN       LEU  98 106.192  -7.572  -5.647
  765    HA   LEU  98           HA       LEU  98 106.071  -4.727  -5.797
  766    HB2  LEU  98           HB2      LEU  98 106.632  -6.764  -3.734
  767    HB3  LEU  98           HB1      LEU  98 107.499  -5.248  -3.497
  768    HG   LEU  98           HG       LEU  98 105.314  -4.030  -3.755
  769   HD11  LEU  98          HD11      LEU  98 104.078  -6.777  -3.464
  770   HD12  LEU  98          HD12      LEU  98 104.243  -5.969  -5.022
  771   HD13  LEU  98          HD13      LEU  98 103.250  -5.248  -3.757
  772   HD21  LEU  98          HD21      LEU  98 106.119  -4.432  -1.522
  773   HD22  LEU  98          HD22      LEU  98 105.607  -6.118  -1.580
  774   HD23  LEU  98          HD23      LEU  98 104.401  -4.832  -1.525
  775    H    ARG  99           HN       ARG  99 108.779  -6.973  -6.050
  776    HA   ARG  99           HA       ARG  99 110.814  -5.017  -5.796
  777    HB2  ARG  99           HB2      ARG  99 110.639  -7.756  -6.990
  778    HB3  ARG  99           HB1      ARG  99 112.039  -6.760  -7.385
  779    HG2  ARG  99           HG2      ARG  99 112.848  -6.787  -5.225
  780    HG3  ARG  99           HG1      ARG  99 111.240  -6.895  -4.507
  781    HD2  ARG  99           HD2      ARG  99 112.883  -8.989  -4.513
  782    HD3  ARG  99           HD1      ARG  99 111.147  -9.190  -4.712
  783    HE   ARG  99           HE       ARG  99 111.517  -9.811  -6.930
  784   HH11  ARG  99          HH21      ARG  99 114.339  -8.414  -5.504
  785   HH12  ARG  99          HH22      ARG  99 115.382  -8.834  -6.821
  786   HH21  ARG  99          HH11      ARG  99 112.877 -10.364  -8.665
  787   HH22  ARG  99          HH12      ARG  99 114.554  -9.937  -8.610
  788    H    ARG 100           HN       ARG 100 108.853  -6.107  -8.505
  789    HA   ARG 100           HA       ARG 100 110.178  -4.841 -10.640
  790    HB2  ARG 100           HB2      ARG 100 107.211  -5.299 -10.290
  791    HB3  ARG 100           HB1      ARG 100 108.047  -4.988 -11.809
  792    HG2  ARG 100           HG2      ARG 100 109.001  -7.264 -10.102
  793    HG3  ARG 100           HG1      ARG 100 107.522  -7.477 -11.038
  794    HD2  ARG 100           HD2      ARG 100 110.198  -6.606 -12.164
  795    HD3  ARG 100           HD1      ARG 100 109.503  -8.217 -12.316
  796    HE   ARG 100           HE       ARG 100 107.647  -6.325 -13.295
  797   HH11  ARG 100          HH21      ARG 100 110.741  -7.705 -13.997
  798   HH12  ARG 100          HH22      ARG 100 110.597  -7.503 -15.711
  799   HH21  ARG 100          HH11      ARG 100 107.451  -6.056 -15.542
  800   HH22  ARG 100          HH12      ARG 100 108.734  -6.571 -16.586
  801    H    LEU 101           HN       LEU 101 107.468  -3.702  -8.667
  802    HA   LEU 101           HA       LEU 101 107.230  -1.147  -9.868
  803    HB2  LEU 101           HB2      LEU 101 106.518  -2.026  -7.055
  804    HB3  LEU 101           HB1      LEU 101 106.109  -0.453  -7.716
  805    HG   LEU 101           HG       LEU 101 104.170  -1.408  -8.394
  806   HD11  LEU 101          HD11      LEU 101 105.935  -2.954 -10.318
  807   HD12  LEU 101          HD12      LEU 101 105.283  -1.335 -10.585
  808   HD13  LEU 101          HD13      LEU 101 104.200  -2.717 -10.480
  809   HD21  LEU 101          HD21      LEU 101 103.916  -3.940  -8.496
  810   HD22  LEU 101          HD22      LEU 101 104.336  -3.267  -6.920
  811   HD23  LEU 101          HD23      LEU 101 105.575  -4.029  -7.911
  812    H    VAL 102           HN       VAL 102 109.289  -2.357  -7.316
  813    HA   VAL 102           HA       VAL 102 110.311   0.167  -6.473
  814    HB   VAL 102           HB       VAL 102 111.411  -2.641  -6.250
  815   HG11  VAL 102          HG11      VAL 102 113.273  -1.080  -6.101
  816   HG12  VAL 102          HG12      VAL 102 112.882  -1.640  -4.477
  817   HG13  VAL 102          HG13      VAL 102 112.360  -0.041  -5.007
  818   HG21  VAL 102          HG21      VAL 102 110.242  -0.876  -4.095
  819   HG22  VAL 102          HG22      VAL 102 110.505  -2.620  -4.056
  820   HG23  VAL 102          HG23      VAL 102 109.233  -1.942  -5.072
  821    H    GLU 103           HN       GLU 103 111.457  -2.295  -8.761
  822    HA   GLU 103           HA       GLU 103 113.889  -1.042  -9.426
  823    HB2  GLU 103           HB2      GLU 103 113.322  -3.410  -9.934
  824    HB3  GLU 103           HB1      GLU 103 112.210  -2.846 -11.179
  825    HG2  GLU 103           HG2      GLU 103 114.885  -1.639 -11.404
  826    HG3  GLU 103           HG1      GLU 103 114.909  -3.392 -11.560
  827    H    LEU 104           HN       LEU 104 110.698  -0.894 -11.039
  828    HA   LEU 104           HA       LEU 104 111.556   0.806 -13.130
  829    HB2  LEU 104           HB2      LEU 104 108.863   0.154 -11.954
  830    HB3  LEU 104           HB1      LEU 104 109.018   1.411 -13.177
  831    HG   LEU 104           HG       LEU 104 110.341  -0.392 -14.530
  832   HD11  LEU 104          HD11      LEU 104 110.480  -1.992 -12.623
  833   HD12  LEU 104          HD12      LEU 104 109.697  -2.694 -14.038
  834   HD13  LEU 104          HD13      LEU 104 108.725  -2.158 -12.669
  835   HD21  LEU 104          HD21      LEU 104 107.351  -0.602 -14.051
  836   HD22  LEU 104          HD22      LEU 104 108.199  -1.275 -15.444
  837   HD23  LEU 104          HD23      LEU 104 108.148   0.470 -15.201
  838    H    ASN 105           HN       ASN 105 110.215   1.495  -9.915
  839    HA   ASN 105           HA       ASN 105 109.838   4.248 -10.210
  840    HB2  ASN 105           HB2      ASN 105 110.024   2.338  -8.017
  841    HB3  ASN 105           HB1      ASN 105 110.711   3.899  -7.576
  842   HD21  ASN 105          HD21      ASN 105 107.998   3.329  -9.852
  843   HD22  ASN 105          HD22      ASN 105 106.850   4.172  -8.929
  844    H    LEU 106           HN       LEU 106 112.732   2.469  -9.120
  845    HA   LEU 106           HA       LEU 106 114.337   4.785  -8.740
  846    HB2  LEU 106           HB2      LEU 106 115.164   1.927  -9.308
  847    HB3  LEU 106           HB1      LEU 106 116.232   3.202  -8.722
  848    HG   LEU 106           HG       LEU 106 113.744   2.243  -7.278
  849   HD11  LEU 106          HD11      LEU 106 116.674   1.567  -6.974
  850   HD12  LEU 106          HD12      LEU 106 115.310   0.461  -7.138
  851   HD13  LEU 106          HD13      LEU 106 115.532   1.371  -5.644
  852   HD21  LEU 106          HD21      LEU 106 114.093   4.423  -6.511
  853   HD22  LEU 106          HD22      LEU 106 115.839   4.334  -6.738
  854   HD23  LEU 106          HD23      LEU 106 115.081   3.500  -5.382
  855    H    GLY 107           HN       GLY 107 113.505   2.869 -11.525
  856    HA2  GLY 107           HA2      GLY 107 113.659   3.766 -13.738
  857    HA3  GLY 107           HA1      GLY 107 115.042   4.726 -13.223
  858    H    ASP 108           HN       ASP 108 117.000   3.420 -12.545
  859    HA   ASP 108           HA       ASP 108 117.261   0.758 -13.641
  860    HB2  ASP 108           HB2      ASP 108 118.574   3.124 -14.986
  861    HB3  ASP 108           HB1      ASP 108 119.134   1.466 -15.193
  862    H    GLU 109           HN       GLU 109 117.684   0.843 -11.215
  863    HA   GLU 109           HA       GLU 109 120.557   1.391 -10.734
  864    HB2  GLU 109           HB2      GLU 109 118.141   1.845  -9.008
  865    HB3  GLU 109           HB1      GLU 109 119.700   1.513  -8.255
  866    HG2  GLU 109           HG2      GLU 109 119.503   3.600 -10.414
  867    HG3  GLU 109           HG1      GLU 109 119.022   3.998  -8.766
  868    H    GLU 110           HN       GLU 110 121.037   0.110  -8.469
  869    HA   GLU 110           HA       GLU 110 120.922  -2.664  -9.240
  870    HB2  GLU 110           HB2      GLU 110 121.929  -1.501  -6.635
  871    HB3  GLU 110           HB1      GLU 110 122.349  -3.059  -7.348
  872    HG2  GLU 110           HG2      GLU 110 123.223  -1.739  -9.360
  873    HG3  GLU 110           HG1      GLU 110 123.085  -0.303  -8.348
  874    H    LEU 111           HN       LEU 111 120.854  -3.132  -6.126
  875    HA   LEU 111           HA       LEU 111 117.908  -3.166  -5.857
  876    HB2  LEU 111           HB2      LEU 111 119.596  -5.419  -6.202
  877    HB3  LEU 111           HB1      LEU 111 119.118  -5.418  -4.506
  878    HG   LEU 111           HG       LEU 111 116.715  -5.030  -5.368
  879   HD11  LEU 111          HD11      LEU 111 117.870  -6.208  -7.904
  880   HD12  LEU 111          HD12      LEU 111 117.598  -4.477  -7.715
  881   HD13  LEU 111          HD13      LEU 111 116.238  -5.596  -7.636
  882   HD21  LEU 111          HD21      LEU 111 117.355  -7.157  -4.417
  883   HD22  LEU 111          HD22      LEU 111 118.230  -7.606  -5.881
  884   HD23  LEU 111          HD23      LEU 111 116.470  -7.490  -5.906
  885    H    LEU 112           HN       LEU 112 117.549  -4.095  -3.413
  886    HA   LEU 112           HA       LEU 112 117.628  -3.583  -1.179
  887    HB2  LEU 112           HB2      LEU 112 120.158  -4.203  -1.754
  888    HB3  LEU 112           HB1      LEU 112 120.403  -2.494  -1.400
  889    HG   LEU 112           HG       LEU 112 118.932  -3.032   0.732
  890   HD11  LEU 112          HD11      LEU 112 120.091  -5.738  -0.011
  891   HD12  LEU 112          HD12      LEU 112 118.378  -5.335   0.102
  892   HD13  LEU 112          HD13      LEU 112 119.380  -5.342   1.552
  893   HD21  LEU 112          HD21      LEU 112 121.838  -3.799   0.338
  894   HD22  LEU 112          HD22      LEU 112 121.069  -3.720   1.924
  895   HD23  LEU 112          HD23      LEU 112 121.203  -2.265   0.936
  896    H    GLU 113           HN       GLU 113 117.695  -1.389  -3.586
  897    HA   GLU 113           HA       GLU 113 117.533   0.920  -3.726
  898    HB2  GLU 113           HB2      GLU 113 115.991   0.613  -1.148
  899    HB3  GLU 113           HB1      GLU 113 115.729   1.785  -2.441
  900    HG2  GLU 113           HG2      GLU 113 114.054   0.161  -2.805
  901    HG3  GLU 113           HG1      GLU 113 115.318  -0.269  -3.956
  902    H    ARG 114           HN       ARG 114 116.943   2.170  -0.853
  903    HA   ARG 114           HA       ARG 114 118.381   3.863   0.073
  904    HB2  ARG 114           HB2      ARG 114 118.958   1.202   1.394
  905    HB3  ARG 114           HB1      ARG 114 119.296   2.779   2.106
  906    HG2  ARG 114           HG2      ARG 114 116.786   3.282   1.667
  907    HG3  ARG 114           HG1      ARG 114 116.620   1.535   1.483
  908    HD2  ARG 114           HD2      ARG 114 117.443   3.101   3.919
  909    HD3  ARG 114           HD1      ARG 114 116.188   1.874   3.770
  910    HE   ARG 114           HE       ARG 114 119.044   1.407   4.130
  911   HH11  ARG 114          HH21      ARG 114 115.928   0.174   3.277
  912   HH12  ARG 114          HH22      ARG 114 116.335  -1.476   3.609
  913   HH21  ARG 114          HH11      ARG 114 119.588  -0.755   4.568
  914   HH22  ARG 114          HH12      ARG 114 118.408  -2.002   4.340
  915    H    GLU 115           HN       GLU 115 120.038   4.761  -1.063
  916    HA   GLU 115           HA       GLU 115 122.678   3.725  -0.630
  917    HB2  GLU 115           HB2      GLU 115 121.554   2.480  -2.697
  918    HB3  GLU 115           HB1      GLU 115 122.052   3.945  -3.543
  919    HG2  GLU 115           HG2      GLU 115 124.363   3.624  -2.647
  920    HG3  GLU 115           HG1      GLU 115 123.839   2.097  -1.938
  921    H    LEU 116           HN       LEU 116 124.235   5.238  -0.913
  922    HA   LEU 116           HA       LEU 116 123.627   7.948  -0.820
  923    HB2  LEU 116           HB2      LEU 116 125.807   6.698  -0.223
  924    HB3  LEU 116           HB1      LEU 116 126.229   6.905  -1.921
  925    HG   LEU 116           HG       LEU 116 125.258   9.345  -0.496
  926   HD11  LEU 116          HD11      LEU 116 126.725   8.356   1.202
  927   HD12  LEU 116          HD12      LEU 116 127.507   9.753   0.465
  928   HD13  LEU 116          HD13      LEU 116 127.990   8.124  -0.004
  929   HD21  LEU 116          HD21      LEU 116 127.533   8.757  -2.423
  930   HD22  LEU 116          HD22      LEU 116 127.073  10.362  -1.858
  931   HD23  LEU 116          HD23      LEU 116 125.960   9.426  -2.852
  932    H    ALA 117           HN       ALA 117 124.295   5.878  -3.589
  933    HA   ALA 117           HA       ALA 117 124.579   7.982  -5.480
  934    HB1  ALA 117           HB1      ALA 117 125.441   5.597  -5.735
  935    HB2  ALA 117           HB2      ALA 117 124.628   6.274  -7.146
  936    HB3  ALA 117           HB3      ALA 117 123.779   5.136  -6.102
  937    H    LEU 118           HN       LEU 118 121.795   6.473  -4.077
  938    HA   LEU 118           HA       LEU 118 119.952   6.754  -6.140
  939    HB2  LEU 118           HB2      LEU 118 119.664   6.999  -3.155
  940    HB3  LEU 118           HB1      LEU 118 118.279   7.232  -4.216
  941    HG   LEU 118           HG       LEU 118 120.052   4.775  -4.277
  942   HD11  LEU 118          HD11      LEU 118 118.704   5.175  -2.122
  943   HD12  LEU 118          HD12      LEU 118 118.440   3.641  -2.949
  944   HD13  LEU 118          HD13      LEU 118 117.268   4.948  -3.118
  945   HD21  LEU 118          HD21      LEU 118 117.715   3.991  -5.348
  946   HD22  LEU 118          HD22      LEU 118 118.984   4.723  -6.327
  947   HD23  LEU 118          HD23      LEU 118 117.627   5.702  -5.767
  948    H    LEU 119           HN       LEU 119 120.992   9.270  -3.791
  949    HA   LEU 119           HA       LEU 119 119.222  11.256  -4.567
  950    HB2  LEU 119           HB2      LEU 119 121.915  11.198  -3.319
  951    HB3  LEU 119           HB1      LEU 119 121.447  12.734  -4.045
  952    HG   LEU 119           HG       LEU 119 119.311  12.649  -2.749
  953   HD11  LEU 119          HD11      LEU 119 119.171  10.220  -2.457
  954   HD12  LEU 119          HD12      LEU 119 119.178  11.012  -0.882
  955   HD13  LEU 119          HD13      LEU 119 120.641  10.234  -1.484
  956   HD21  LEU 119          HD21      LEU 119 121.938  12.514  -1.247
  957   HD22  LEU 119          HD22      LEU 119 120.424  13.000  -0.486
  958   HD23  LEU 119          HD23      LEU 119 121.092  13.956  -1.809
  959    H    VAL 120           HN       VAL 120 121.773   9.860  -6.382
  960    HA   VAL 120           HA       VAL 120 122.611  11.870  -8.127
  961    HB   VAL 120           HB       VAL 120 122.081   8.952  -8.647
  962   HG11  VAL 120          HG11      VAL 120 123.271  11.154 -10.305
  963   HG12  VAL 120          HG12      VAL 120 122.239   9.815 -10.804
  964   HG13  VAL 120          HG13      VAL 120 123.938   9.526 -10.435
  965   HG21  VAL 120          HG21      VAL 120 124.315   8.605  -7.999
  966   HG22  VAL 120          HG22      VAL 120 123.788   9.830  -6.845
  967   HG23  VAL 120          HG23      VAL 120 124.751  10.295  -8.247
  968    H    SER 121           HN       SER 121 119.464  10.860  -7.581
  969    HA   SER 121           HA       SER 121 118.560  11.288 -10.350
  970    HB2  SER 121           HB2      SER 121 116.373  10.438  -9.447
  971    HB3  SER 121           HB1      SER 121 117.698   9.282  -9.360
  972    HG   SER 121           HG       SER 121 117.944   9.776  -7.193
  973    H    ALA 122           HN       ALA 122 118.217  12.596  -7.076
  974    HA   ALA 122           HA       ALA 122 116.735  14.883  -8.241
  975    HB1  ALA 122           HB1      ALA 122 115.563  15.109  -6.105
  976    HB2  ALA 122           HB2      ALA 122 116.426  13.708  -5.475
  977    HB3  ALA 122           HB3      ALA 122 115.287  13.514  -6.805
  978    H    HIS 123           HN       HIS 123 117.967  14.478  -4.982
  979    HA   HIS 123           HA       HIS 123 119.097  16.017  -3.700
  980    HB2  HIS 123           HB2      HIS 123 121.093  15.003  -3.926
  981    HB3  HIS 123           HB1      HIS 123 120.795  14.673  -5.629
  982    HD2  HIS 123           HD2      HIS 123 121.146  17.409  -7.128
  983    HE1  HIS 123           HE1      HIS 123 124.511  18.200  -4.709
  984    HE2  HIS 123           HE2      HIS 123 123.302  18.850  -6.845
  985    H    ASP 124           HN       ASP 124 120.425  18.051  -3.633
  986    HA   ASP 124           HA       ASP 124 120.255  19.866  -5.861
  987    HB2  ASP 124           HB2      ASP 124 118.833  21.510  -4.456
  988    HB3  ASP 124           HB1      ASP 124 117.999  20.201  -5.291
  989    H    ASP 125           HN       ASP 125 120.799  19.318  -2.432
  990    HA   ASP 125           HA       ASP 125 122.028  20.641  -0.906
  991    HB2  ASP 125           HB2      ASP 125 123.406  18.749  -1.649
  992    HB3  ASP 125           HB1      ASP 125 124.028  19.721  -2.981
  993   H5'1  C2E 501          H5'1      C2E 501 105.526   3.212  10.266
  994   H5'2  C2E 501          H5'2      C2E 501 104.828   1.856  11.169
  995    H4'  C2E 501           H4'      C2E 501 107.056   0.628  10.396
  996    H3'  C2E 501           H3'      C2E 501 106.864   2.972   8.518
  997    H2'  C2E 501           H2'      C2E 501 106.953   1.669   6.582
  998   HO2'  C2E 501          HO2'      C2E 501 107.442  -0.633   6.748
  999    H1'  C2E 501           H1'      C2E 501 105.252  -0.275   7.296
 1000    H8   C2E 501           H8       C2E 501 103.643   2.359   9.257
 1001    HN1  C2E 501           HN1      C2E 501 103.043   3.541   2.999
 1002   HN21  C2E 501          HN21      C2E 501 104.400   2.224   1.840
 1003   HN22  C2E 501          HN22      C2E 501 105.454   1.057   2.604
 1004   H511  C2E 501          H511      C2E 501 108.553   4.398   9.812
 1005   H512  C2E 501          H512      C2E 501 110.206   4.303  10.453
 1006    H4A  C2E 501           H4A      C2E 501 109.343   5.144  12.653
 1007    H3A  C2E 501           H3A      C2E 501 106.680   5.209  11.218
 1008    H2A  C2E 501           H2A      C2E 501 106.173   7.271  12.126
 1009   HO2A  C2E 501          HO2A      C2E 501 108.038   6.483  14.050
 1010    H1A  C2E 501           H1A      C2E 501 108.612   8.477  11.864
 1011    H81  C2E 501           H81      C2E 501 108.685   6.460   8.794
 1012   HN11  C2E 501          HN11      C2E 501 104.526  11.289   8.258
 1013   HN24  C2E 501          HN24      C2E 501 104.754  11.477  11.736
 1014   HN23  C2E 501          HN23      C2E 501 104.035  12.101  10.269
 1015   H5'1  C2E 502          H5'1      C2E 502 101.480  10.071   4.315
 1016   H5'2  C2E 502          H5'2      C2E 502 100.029  11.045   4.000
 1017    H4'  C2E 502           H4'      C2E 502  99.868  11.761   6.197
 1018    H3'  C2E 502           H3'      C2E 502 102.847  11.302   6.392
 1019    H2'  C2E 502           H2'      C2E 502 102.567  11.083   8.769
 1020   HO2'  C2E 502          HO2'      C2E 502  99.803  11.660   8.533
 1021    H1'  C2E 502           H1'      C2E 502 100.415   9.455   8.635
 1022    H8   C2E 502           H8       C2E 502 102.634   8.557   5.667
 1023    HN1  C2E 502           HN1      C2E 502 104.456   5.884  11.185
 1024   HN21  C2E 502          HN21      C2E 502 103.293   6.717  12.869
 1025   HN22  C2E 502          HN22      C2E 502 102.072   7.952  12.649
 1026   H511  C2E 502          H511      C2E 502 102.667  16.031   5.249
 1027   H512  C2E 502          H512      C2E 502 102.285  14.302   5.122
 1028    H4A  C2E 502           H4A      C2E 502 103.852  15.626   3.348
 1029    H3A  C2E 502           H3A      C2E 502 103.977  12.722   4.220
 1030    H2A  C2E 502           H2A      C2E 502 105.891  12.420   2.871
 1031   HO2A  C2E 502          HO2A      C2E 502 105.741  15.040   1.807
 1032    H1A  C2E 502           H1A      C2E 502 107.162  14.751   3.541
 1033    H81  C2E 502           H81      C2E 502 105.797  13.971   6.834
 1034   HN11  C2E 502          HN11      C2E 502 110.285   9.785   5.148
 1035   HN24  C2E 502          HN24      C2E 502 110.792  10.018   3.003
 1036   HN23  C2E 502          HN23      C2E 502 110.015  11.209   1.983
  Start of MODEL   19
    1    H    MET   1           H        MET   1 121.742  19.115   4.338
    2    HA   MET   1           HA       MET   1 121.194  21.031   5.304
    3    HB2  MET   1           HB2      MET   1 118.435  20.498   4.174
    4    HB3  MET   1           HB1      MET   1 118.842  21.940   5.106
    5    HG2  MET   1           HG2      MET   1 120.723  22.344   3.445
    6    HG3  MET   1           HG1      MET   1 120.018  21.066   2.457
    7    HE1  MET   1           HE1      MET   1 119.025  24.231   4.540
    8    HE2  MET   1           HE2      MET   1 118.553  25.299   3.220
    9    HE3  MET   1           HE3      MET   1 120.189  24.648   3.274
   10    H    SER   2           HN       SER   2 117.981  20.574   6.121
   11    HA   SER   2           HA       SER   2 118.325  18.765   8.334
   12    HB2  SER   2           HB2      SER   2 119.441  20.750   9.253
   13    HB3  SER   2           HB1      SER   2 118.015  21.723   8.903
   14    HG   SER   2           HG       SER   2 117.876  19.371  10.461
   15    H    ASP   3           HN       ASP   3 116.423  21.314   6.792
   16    HA   ASP   3           HA       ASP   3 113.949  20.200   7.908
   17    HB2  ASP   3           HB2      ASP   3 112.866  22.170   6.933
   18    HB3  ASP   3           HB1      ASP   3 114.241  22.650   7.928
   19    H    GLN   4           HN       GLN   4 114.742  18.250   6.451
   20    HA   GLN   4           HA       GLN   4 114.437  18.352   3.665
   21    HB2  GLN   4           HB2      GLN   4 113.891  15.903   5.302
   22    HB3  GLN   4           HB1      GLN   4 114.660  16.045   3.721
   23    HG2  GLN   4           HG2      GLN   4 116.541  15.780   5.040
   24    HG3  GLN   4           HG1      GLN   4 116.397  17.535   5.083
   25   HE21  GLN   4          HE21      GLN   4 113.812  16.847   6.854
   26   HE22  GLN   4          HE22      GLN   4 114.497  16.678   8.397
   27    H    HIS   5           HN       HIS   5 112.309  17.630   6.348
   28    HA   HIS   5           HA       HIS   5 109.839  18.341   5.716
   29    HB2  HIS   5           HB2      HIS   5 108.851  16.195   4.642
   30    HB3  HIS   5           HB1      HIS   5 109.658  17.342   3.580
   31    HD2  HIS   5           HD2      HIS   5 111.636  14.706   5.776
   32    HE1  HIS   5           HE1      HIS   5 112.294  13.838   1.697
   33    HE2  HIS   5           HE2      HIS   5 112.947  13.224   4.073
   34    H    ASP   6           HN       ASP   6 111.884  17.066   7.576
   35    HA   ASP   6           HA       ASP   6 111.922  15.834   9.502
   36    HB2  ASP   6           HB2      ASP   6 108.899  15.968   9.444
   37    HB3  ASP   6           HB1      ASP   6 109.948  15.834  10.854
   38    H    GLU   7           HN       GLU   7 112.549  14.234   7.734
   39    HA   GLU   7           HA       GLU   7 110.632  12.155   7.191
   40    HB2  GLU   7           HB2      GLU   7 111.986  12.154   5.380
   41    HB3  GLU   7           HB1      GLU   7 113.301  12.919   6.264
   42    HG2  GLU   7           HG2      GLU   7 114.033  10.821   7.179
   43    HG3  GLU   7           HG1      GLU   7 112.590   9.994   6.597
   44    H    ARG   8           HN       ARG   8 110.346  10.294   8.203
   45    HA   ARG   8           HA       ARG   8 112.230   9.571  10.366
   46    HB2  ARG   8           HB2      ARG   8 109.220   9.472  10.316
   47    HB3  ARG   8           HB1      ARG   8 110.179   8.536  11.452
   48    HG2  ARG   8           HG2      ARG   8 109.700  10.503  12.646
   49    HG3  ARG   8           HG1      ARG   8 111.335  10.760  12.052
   50    HD2  ARG   8           HD2      ARG   8 109.540  12.657  11.794
   51    HD3  ARG   8           HD1      ARG   8 110.663  12.341  10.484
   52    HE   ARG   8           HE       ARG   8 108.651  10.815   9.695
   53   HH11  ARG   8          HH21      ARG   8 108.590  13.945  11.184
   54   HH12  ARG   8          HH22      ARG   8 107.153  14.455  10.366
   55   HH21  ARG   8          HH11      ARG   8 106.775  11.495   8.611
   56   HH22  ARG   8          HH12      ARG   8 106.126  13.072   8.916
   57    H    ARG   9           HN       ARG   9 110.862   8.638   7.433
   58    HA   ARG   9           HA       ARG   9 111.148   5.761   8.049
   59    HB2  ARG   9           HB2      ARG   9 110.204   5.751   5.511
   60    HB3  ARG   9           HB1      ARG   9 109.164   5.770   6.927
   61    HG2  ARG   9           HG2      ARG   9 109.227   8.307   6.799
   62    HG3  ARG   9           HG1      ARG   9 109.998   8.112   5.225
   63    HD2  ARG   9           HD2      ARG   9 108.096   7.037   4.308
   64    HD3  ARG   9           HD1      ARG   9 107.392   6.745   5.893
   65    HE   ARG   9           HE       ARG   9 106.740   9.033   5.992
   66   HH11  ARG   9          HH21      ARG   9 108.413   8.177   3.080
   67   HH12  ARG   9          HH22      ARG   9 107.880   9.573   2.206
   68   HH21  ARG   9          HH11      ARG   9 106.040  10.857   4.845
   69   HH22  ARG   9          HH12      ARG   9 106.540  11.087   3.202
   70    H    ARG  10           HN       ARG  10 113.179   5.178   7.849
   71    HA   ARG  10           HA       ARG  10 115.434   5.755   6.989
   72    HB2  ARG  10           HB2      ARG  10 114.626   3.615   5.095
   73    HB3  ARG  10           HB1      ARG  10 115.945   3.656   6.259
   74    HG2  ARG  10           HG2      ARG  10 114.507   2.061   7.184
   75    HG3  ARG  10           HG1      ARG  10 114.047   3.521   8.051
   76    HD2  ARG  10           HD2      ARG  10 112.342   3.802   6.045
   77    HD3  ARG  10           HD1      ARG  10 112.587   2.069   5.871
   78    HE   ARG  10           HE       ARG  10 111.069   3.357   7.915
   79   HH11  ARG  10          HH21      ARG  10 113.217   0.726   7.251
   80   HH12  ARG  10          HH22      ARG  10 112.596  -0.281   8.516
   81   HH21  ARG  10          HH11      ARG  10 110.252   2.044   9.569
   82   HH22  ARG  10          HH12      ARG  10 110.916   0.467   9.832
   83    H    PHE  11           HN       PHE  11 113.317   4.975   4.207
   84    HA   PHE  11           HA       PHE  11 114.380   7.322   2.788
   85    HB2  PHE  11           HB2      PHE  11 115.267   4.670   2.300
   86    HB3  PHE  11           HB1      PHE  11 114.218   5.099   0.951
   87    HD1  PHE  11           HD1      PHE  11 116.951   6.588   3.050
   88    HD2  PHE  11           HD2      PHE  11 115.149   6.287  -0.838
   89    HE1  PHE  11           HE1      PHE  11 118.756   7.999   2.105
   90    HE2  PHE  11           HE2      PHE  11 116.958   7.696  -1.782
   91    HZ   PHE  11           HZ       PHE  11 118.758   8.553  -0.311
   92    H    HIS  12           HN       HIS  12 113.184   7.600   0.649
   93    HA   HIS  12           HA       HIS  12 110.435   7.856   1.130
   94    HB2  HIS  12           HB2      HIS  12 110.781   7.735  -1.683
   95    HB3  HIS  12           HB1      HIS  12 110.679   9.176  -0.673
   96    HD2  HIS  12           HD2      HIS  12 113.508   9.540   0.632
   97    HE1  HIS  12           HE1      HIS  12 115.246   8.522  -3.079
   98    HE2  HIS  12           HE2      HIS  12 115.680   9.586  -0.814
   99    H    ARG  13           HN       ARG  13 108.656   6.833  -0.123
  100    HA   ARG  13           HA       ARG  13 109.171   3.938  -0.493
  101    HB2  ARG  13           HB2      ARG  13 106.373   4.730  -0.060
  102    HB3  ARG  13           HB1      ARG  13 107.316   3.453   0.707
  103    HG2  ARG  13           HG2      ARG  13 108.449   5.194   2.105
  104    HG3  ARG  13           HG1      ARG  13 107.369   6.402   1.406
  105    HD2  ARG  13           HD2      ARG  13 106.313   3.912   2.750
  106    HD3  ARG  13           HD1      ARG  13 106.664   5.376   3.662
  107    HE   ARG  13           HE       ARG  13 104.496   4.999   1.743
  108   HH11  ARG  13          HH21      ARG  13 106.426   7.155   3.646
  109   HH12  ARG  13          HH22      ARG  13 105.253   8.429   3.640
  110   HH21  ARG  13          HH11      ARG  13 102.955   6.673   1.734
  111   HH22  ARG  13          HH12      ARG  13 103.293   8.159   2.558
  112    H    ILE  14           HN       ILE  14 107.766   2.845  -2.056
  113    HA   ILE  14           HA       ILE  14 107.701   4.238  -4.561
  114    HB   ILE  14           HB       ILE  14 106.407   1.588  -3.914
  115   HG12  ILE  14          HG12      ILE  14 108.673   1.435  -3.099
  116   HG13  ILE  14          HG11      ILE  14 108.624   0.621  -4.663
  117   HG21  ILE  14          HG21      ILE  14 107.780   2.000  -6.488
  118   HG22  ILE  14          HG22      ILE  14 106.412   3.084  -6.240
  119   HG23  ILE  14          HG23      ILE  14 106.177   1.338  -6.163
  120   HD11  ILE  14          HD11      ILE  14 109.769   3.329  -3.990
  121   HD12  ILE  14          HD12      ILE  14 109.319   2.921  -5.646
  122   HD13  ILE  14          HD13      ILE  14 110.550   1.976  -4.807
  123    H    ALA  15           HN       ALA  15 106.229   5.967  -4.411
  124    HA   ALA  15           HA       ALA  15 103.464   5.316  -3.667
  125    HB1  ALA  15           HB1      ALA  15 104.182   7.322  -2.657
  126    HB2  ALA  15           HB2      ALA  15 103.168   7.831  -4.008
  127    HB3  ALA  15           HB3      ALA  15 104.925   7.902  -4.148
  128    H    PHE  16           HN       PHE  16 102.077   4.736  -5.106
  129    HA   PHE  16           HA       PHE  16 101.862   6.117  -7.635
  130    HB2  PHE  16           HB2      PHE  16 101.955   4.205  -9.057
  131    HB3  PHE  16           HB1      PHE  16 103.420   4.181  -8.083
  132    HD1  PHE  16           HD2      PHE  16 103.138   2.872  -5.750
  133    HD2  PHE  16           HD1      PHE  16 100.787   2.215  -9.283
  134    HE1  PHE  16           HE2      PHE  16 102.613   0.577  -4.979
  135    HE2  PHE  16           HE1      PHE  16 100.269  -0.080  -8.511
  136    HZ   PHE  16           HZ       PHE  16 101.192  -0.904  -6.365
  137    H    ASP  17           HN       ASP  17  99.720   5.636  -8.657
  138    HA   ASP  17           HA       ASP  17  97.806   5.107  -6.512
  139    HB2  ASP  17           HB2      ASP  17  96.285   6.401  -7.678
  140    HB3  ASP  17           HB1      ASP  17  97.802   7.123  -8.209
  141    H    ALA  18           HN       ALA  18  96.146   3.593  -6.646
  142    HA   ALA  18           HA       ALA  18  95.536   1.996  -8.859
  143    HB1  ALA  18           HB1      ALA  18  97.601   0.876  -8.789
  144    HB2  ALA  18           HB2      ALA  18  96.550  -0.182  -7.847
  145    HB3  ALA  18           HB3      ALA  18  97.665   0.911  -7.028
  146    H    ASP  19           HN       ASP  19  94.413  -0.133  -8.043
  147    HA   ASP  19           HA       ASP  19  92.630   0.720  -5.858
  148    HB2  ASP  19           HB2      ASP  19  92.077  -0.317  -8.324
  149    HB3  ASP  19           HB1      ASP  19  92.012  -1.768  -7.328
  150    H    SER  20           HN       SER  20  92.490  -0.312  -3.938
  151    HA   SER  20           HA       SER  20  93.842  -2.918  -3.647
  152    HB2  SER  20           HB2      SER  20  94.617  -2.080  -1.366
  153    HB3  SER  20           HB1      SER  20  95.466  -1.431  -2.768
  154    HG   SER  20           HG       SER  20  94.313   0.443  -2.583
  155    H    GLU  21           HN       GLU  21  93.061  -4.194  -1.913
  156    HA   GLU  21           HA       GLU  21  90.513  -3.321  -0.681
  157    HB2  GLU  21           HB2      GLU  21  90.983  -6.079  -1.851
  158    HB3  GLU  21           HB1      GLU  21  89.487  -5.452  -1.158
  159    HG2  GLU  21           HG2      GLU  21  89.328  -3.785  -2.948
  160    HG3  GLU  21           HG1      GLU  21  90.854  -4.348  -3.626
  161    H    ILE  22           HN       ILE  22  90.220  -4.054   1.417
  162    HA   ILE  22           HA       ILE  22  92.442  -5.698   2.497
  163    HB   ILE  22           HB       ILE  22  91.133  -3.238   3.646
  164   HG12  ILE  22          HG12      ILE  22  94.045  -4.036   3.347
  165   HG13  ILE  22          HG11      ILE  22  93.166  -3.091   2.147
  166   HG21  ILE  22          HG21      ILE  22  92.562  -5.492   5.041
  167   HG22  ILE  22          HG22      ILE  22  91.114  -4.621   5.540
  168   HG23  ILE  22          HG23      ILE  22  92.693  -3.847   5.660
  169   HD11  ILE  22          HD11      ILE  22  94.566  -1.842   3.969
  170   HD12  ILE  22          HD12      ILE  22  93.201  -2.205   5.021
  171   HD13  ILE  22          HD13      ILE  22  92.959  -1.241   3.566
  172    H    LEU  23           HN       LEU  23  91.993  -7.330   3.769
  173    HA   LEU  23           HA       LEU  23  89.154  -7.818   4.459
  174    HB2  LEU  23           HB2      LEU  23  90.981 -10.134   4.101
  175    HB3  LEU  23           HB1      LEU  23  89.283  -9.952   3.660
  176    HG   LEU  23           HG       LEU  23  90.242  -8.203   1.928
  177   HD11  LEU  23          HD11      LEU  23  92.462  -8.318   1.393
  178   HD12  LEU  23          HD12      LEU  23  92.574 -10.039   1.762
  179   HD13  LEU  23          HD13      LEU  23  92.612  -8.853   3.065
  180   HD21  LEU  23          HD21      LEU  23  90.126  -9.870   0.250
  181   HD22  LEU  23          HD22      LEU  23  89.129 -10.527   1.546
  182   HD23  LEU  23          HD23      LEU  23  90.774 -11.113   1.318
  183    H    GLN  24           HN       GLN  24  88.773  -7.981   6.506
  184    HA   GLN  24           HA       GLN  24  90.891  -8.956   8.337
  185    HB2  GLN  24           HB2      GLN  24  90.769  -6.636   8.828
  186    HB3  GLN  24           HB1      GLN  24  89.013  -6.610   8.672
  187    HG2  GLN  24           HG2      GLN  24  88.675  -7.476  10.776
  188    HG3  GLN  24           HG1      GLN  24  90.130  -8.468  10.716
  189   HE21  GLN  24          HE21      GLN  24  88.836  -5.764  12.228
  190   HE22  GLN  24          HE22      GLN  24  90.285  -4.999  12.672
  191    H    GLY  25           HN       GLY  25  90.195 -10.644   9.594
  192    HA2  GLY  25           HA2      GLY  25  88.790 -12.359  10.253
  193    HA3  GLY  25           HA1      GLY  25  87.716 -11.041  10.720
  194    H    GLU  26           HN       GLU  26  85.735 -11.220   9.869
  195    HA   GLU  26           HA       GLU  26  85.370 -12.661   7.314
  196    HB2  GLU  26           HB2      GLU  26  83.018 -12.852   8.051
  197    HB3  GLU  26           HB1      GLU  26  84.143 -13.568   9.208
  198    HG2  GLU  26           HG2      GLU  26  84.089 -11.446  10.519
  199    HG3  GLU  26           HG1      GLU  26  82.878 -10.819   9.402
  200    H    ARG  27           HN       ARG  27  85.969  -9.617   8.008
  201    HA   ARG  27           HA       ARG  27  83.735  -8.475   6.432
  202    HB2  ARG  27           HB2      ARG  27  85.649  -7.159   8.348
  203    HB3  ARG  27           HB1      ARG  27  84.455  -6.317   7.365
  204    HG2  ARG  27           HG2      ARG  27  83.020  -6.645   9.087
  205    HG3  ARG  27           HG1      ARG  27  82.948  -8.322   8.550
  206    HD2  ARG  27           HD2      ARG  27  84.861  -8.857  10.016
  207    HD3  ARG  27           HD1      ARG  27  84.883  -7.188  10.579
  208    HE   ARG  27           HE       ARG  27  82.977  -9.246  11.335
  209   HH11  ARG  27          HH21      ARG  27  83.701  -5.872  11.090
  210   HH12  ARG  27          HH22      ARG  27  82.555  -5.396  12.298
  211   HH21  ARG  27          HH11      ARG  27  81.470  -8.630  12.920
  212   HH22  ARG  27          HH12      ARG  27  81.291  -6.958  13.334
  213    H    ARG  28           HN       ARG  28  84.136  -7.592   4.493
  214    HA   ARG  28           HA       ARG  28  86.940  -7.008   3.736
  215    HB2  ARG  28           HB2      ARG  28  86.299  -9.030   2.550
  216    HB3  ARG  28           HB1      ARG  28  84.736  -8.347   2.125
  217    HG2  ARG  28           HG2      ARG  28  85.865  -8.015   0.132
  218    HG3  ARG  28           HG1      ARG  28  86.232  -6.495   0.927
  219    HD2  ARG  28           HD2      ARG  28  88.442  -6.968   0.975
  220    HD3  ARG  28           HD1      ARG  28  88.147  -8.552   1.677
  221    HE   ARG  28           HE       ARG  28  88.821  -8.069  -1.008
  222   HH11  ARG  28          HH21      ARG  28  86.519  -9.818   0.895
  223   HH12  ARG  28          HH22      ARG  28  86.330 -11.095  -0.259
  224   HH21  ARG  28          HH11      ARG  28  88.581  -9.741  -2.524
  225   HH22  ARG  28          HH12      ARG  28  87.498 -11.053  -2.196
  226    H    TRP  29           HN       TRP  29  87.307  -5.233   2.507
  227    HA   TRP  29           HA       TRP  29  85.051  -3.510   1.780
  228    HB2  TRP  29           HB2      TRP  29  87.380  -2.640   3.488
  229    HB3  TRP  29           HB1      TRP  29  86.069  -1.608   2.923
  230    HD1  TRP  29           HD1      TRP  29  83.532  -2.541   3.775
  231    HE1  TRP  29           HE1      TRP  29  82.910  -3.306   6.173
  232    HE3  TRP  29           HE3      TRP  29  88.160  -3.680   5.530
  233    HZ2  TRP  29           HZ2      TRP  29  84.248  -4.268   8.531
  234    HZ3  TRP  29           HZ3      TRP  29  88.485  -4.507   7.840
  235    HH2  TRP  29           HH2      TRP  29  86.533  -4.813   9.347
  236    H    GLU  30           HN       GLU  30  85.646  -1.823   0.321
  237    HA   GLU  30           HA       GLU  30  88.036  -2.477  -1.252
  238    HB2  GLU  30           HB2      GLU  30  85.613  -0.790  -1.936
  239    HB3  GLU  30           HB1      GLU  30  86.972  -1.096  -3.018
  240    HG2  GLU  30           HG2      GLU  30  86.441  -3.630  -2.466
  241    HG3  GLU  30           HG1      GLU  30  84.851  -2.990  -2.055
  242    H    VAL  31           HN       VAL  31  89.687  -0.941  -1.496
  243    HA   VAL  31           HA       VAL  31  89.252   1.809  -0.544
  244    HB   VAL  31           HB       VAL  31  91.305   1.685   0.862
  245   HG11  VAL  31          HG11      VAL  31  89.120  -0.255   1.674
  246   HG12  VAL  31          HG12      VAL  31  89.024   1.499   1.837
  247   HG13  VAL  31          HG13      VAL  31  90.223   0.591   2.756
  248   HG21  VAL  31          HG21      VAL  31  92.405  -0.240  -0.081
  249   HG22  VAL  31          HG22      VAL  31  91.008  -1.266   0.240
  250   HG23  VAL  31          HG23      VAL  31  91.975  -0.653   1.578
  251    H    LEU  32           HN       LEU  32  90.963   3.249  -1.096
  252    HA   LEU  32           HA       LEU  32  92.362   2.411  -3.547
  253    HB2  LEU  32           HB2      LEU  32  92.505   4.723  -4.121
  254    HB3  LEU  32           HB1      LEU  32  90.868   4.479  -3.523
  255    HG   LEU  32           HG       LEU  32  93.188   5.622  -1.933
  256   HD11  LEU  32          HD11      LEU  32  91.605   7.645  -1.951
  257   HD12  LEU  32          HD12      LEU  32  90.755   6.822  -3.260
  258   HD13  LEU  32          HD13      LEU  32  92.447   7.282  -3.458
  259   HD21  LEU  32          HD21      LEU  32  91.173   6.177  -0.367
  260   HD22  LEU  32          HD22      LEU  32  91.827   4.541  -0.332
  261   HD23  LEU  32          HD23      LEU  32  90.347   4.881  -1.229
  262    H    LEU  33           HN       LEU  33  94.530   2.160  -3.553
  263    HA   LEU  33           HA       LEU  33  95.924   2.685  -1.028
  264    HB2  LEU  33           HB2      LEU  33  96.348   0.491  -1.819
  265    HB3  LEU  33           HB1      LEU  33  96.600   1.040  -3.473
  266    HG   LEU  33           HG       LEU  33  98.444   2.290  -1.528
  267   HD11  LEU  33          HD11      LEU  33  98.317   0.120  -0.448
  268   HD12  LEU  33          HD12      LEU  33  99.841   0.227  -1.327
  269   HD13  LEU  33          HD13      LEU  33  98.501  -0.702  -1.997
  270   HD21  LEU  33          HD21      LEU  33  99.060   0.629  -3.983
  271   HD22  LEU  33          HD22      LEU  33 100.023   1.928  -3.279
  272   HD23  LEU  33          HD23      LEU  33  98.507   2.300  -4.099
  273    H    HIS  34           HN       HIS  34  97.199   4.340  -0.757
  274    HA   HIS  34           HA       HIS  34  97.739   6.093  -3.029
  275    HB2  HIS  34           HB2      HIS  34  97.872   6.387  -0.031
  276    HB3  HIS  34           HB1      HIS  34  98.535   7.624  -1.108
  277    HD2  HIS  34           HD2      HIS  34  95.024   6.128  -0.113
  278    HE1  HIS  34           HE1      HIS  34  94.364   9.517  -2.540
  279    HE2  HIS  34           HE2      HIS  34  93.240   7.765  -1.087
  280    H    ASP  35           HN       ASP  35  99.526   3.904  -0.958
  281    HA   ASP  35           HA       ASP  35 101.661   3.956  -2.756
  282    HB2  ASP  35           HB2      ASP  35 103.440   5.087  -1.494
  283    HB3  ASP  35           HB1      ASP  35 102.084   6.199  -1.714
  284    H    VAL  36           HN       VAL  36 103.539   2.666  -2.081
  285    HA   VAL  36           HA       VAL  36 103.089   0.945   0.244
  286    HB   VAL  36           HB       VAL  36 101.987   0.004  -1.917
  287   HG11  VAL  36          HG11      VAL  36 104.096   0.609  -3.259
  288   HG12  VAL  36          HG12      VAL  36 103.414  -0.996  -3.527
  289   HG13  VAL  36          HG13      VAL  36 104.836  -0.804  -2.504
  290   HG21  VAL  36          HG21      VAL  36 104.062  -1.779  -0.632
  291   HG22  VAL  36          HG22      VAL  36 102.471  -2.229  -1.241
  292   HG23  VAL  36          HG23      VAL  36 102.611  -1.264   0.224
  293    H    SER  37           HN       SER  37 104.895  -0.627   0.507
  294    HA   SER  37           HA       SER  37 107.471   0.262  -0.547
  295    HB2  SER  37           HB2      SER  37 106.923   1.401   1.720
  296    HB3  SER  37           HB1      SER  37 107.098  -0.206   2.415
  297    HG   SER  37           HG       SER  37 109.091   0.755   2.479
  298    H    LEU  38           HN       LEU  38 109.174  -1.469   0.152
  299    HA   LEU  38           HA       LEU  38 108.111  -3.992  -0.561
  300    HB2  LEU  38           HB2      LEU  38 110.446  -4.802   0.370
  301    HB3  LEU  38           HB1      LEU  38 110.366  -3.846  -1.109
  302    HG   LEU  38           HG       LEU  38 110.916  -1.819   0.093
  303   HD11  LEU  38          HD11      LEU  38 111.463  -2.033   2.581
  304   HD12  LEU  38          HD12      LEU  38 110.618  -3.580   2.533
  305   HD13  LEU  38          HD13      LEU  38 109.753  -2.090   2.159
  306   HD21  LEU  38          HD21      LEU  38 113.165  -2.371   0.850
  307   HD22  LEU  38          HD22      LEU  38 112.776  -3.382  -0.543
  308   HD23  LEU  38          HD23      LEU  38 112.709  -4.058   1.085
  309    H    HIS  39           HN       HIS  39 107.616  -2.394   2.230
  310    HA   HIS  39           HA       HIS  39 106.676  -4.740   3.561
  311    HB2  HIS  39           HB2      HIS  39 108.136  -4.890   5.393
  312    HB3  HIS  39           HB1      HIS  39 109.211  -4.695   4.012
  313    HD2  HIS  39           HD2      HIS  39 108.467  -2.951   7.346
  314    HE1  HIS  39           HE1      HIS  39 110.759  -0.229   5.074
  315    HE2  HIS  39           HE2      HIS  39 109.821  -0.719   7.383
  316    H    GLY  40           HN       GLY  40 105.373  -2.431   2.751
  317    HA2  GLY  40           HA2      GLY  40 104.017  -1.658   5.114
  318    HA3  GLY  40           HA1      GLY  40 105.128  -0.376   4.642
  319    H    ILE  41           HN       ILE  41 102.181  -0.315   4.677
  320    HA   ILE  41           HA       ILE  41 101.777   0.621   1.924
  321    HB   ILE  41           HB       ILE  41 100.685  -1.252   1.332
  322   HG12  ILE  41          HG12      ILE  41  98.658  -0.428   3.437
  323   HG13  ILE  41          HG11      ILE  41  98.778   0.293   1.834
  324   HG21  ILE  41          HG21      ILE  41 101.699  -2.523   3.146
  325   HG22  ILE  41          HG22      ILE  41 100.014  -2.999   2.950
  326   HG23  ILE  41          HG23      ILE  41 100.479  -1.931   4.274
  327   HD11  ILE  41          HD11      ILE  41  97.352  -1.322   1.160
  328   HD12  ILE  41          HD12      ILE  41  97.577  -2.245   2.646
  329   HD13  ILE  41          HD13      ILE  41  98.709  -2.439   1.306
  330    H    LEU  42           HN       LEU  42 100.197   2.103   1.648
  331    HA   LEU  42           HA       LEU  42  98.943   3.207   4.097
  332    HB2  LEU  42           HB2      LEU  42 100.842   4.480   2.518
  333    HB3  LEU  42           HB1      LEU  42  99.326   5.080   1.854
  334    HG   LEU  42           HG       LEU  42  99.865   5.072   4.823
  335   HD11  LEU  42          HD11      LEU  42 101.644   6.393   3.873
  336   HD12  LEU  42          HD12      LEU  42 100.429   7.512   4.490
  337   HD13  LEU  42          HD13      LEU  42 100.528   7.185   2.761
  338   HD21  LEU  42          HD21      LEU  42  98.021   6.709   3.058
  339   HD22  LEU  42          HD22      LEU  42  98.120   6.797   4.817
  340   HD23  LEU  42          HD23      LEU  42  97.523   5.330   4.040
  341    H    VAL  43           HN       VAL  43  96.745   3.513   3.941
  342    HA   VAL  43           HA       VAL  43  95.521   3.385   1.257
  343    HB   VAL  43           HB       VAL  43  93.886   1.734   1.994
  344   HG11  VAL  43          HG11      VAL  43  95.295  -0.157   1.866
  345   HG12  VAL  43          HG12      VAL  43  96.596   0.640   2.749
  346   HG13  VAL  43          HG13      VAL  43  96.239   1.114   1.088
  347   HG21  VAL  43          HG21      VAL  43  95.474   1.826   4.577
  348   HG22  VAL  43          HG22      VAL  43  94.288   0.579   4.197
  349   HG23  VAL  43          HG23      VAL  43  93.777   2.260   4.362
  350    H    GLY  44           HN       GLY  44  93.068   3.660   1.483
  351    HA2  GLY  44           HA2      GLY  44  92.597   6.050   3.170
  352    HA3  GLY  44           HA1      GLY  44  91.646   5.581   1.762
  353    H    GLN  45           HN       GLN  45  90.864   6.099   4.702
  354    HA   GLN  45           HA       GLN  45  90.048   3.492   5.607
  355    HB2  GLN  45           HB2      GLN  45  89.305   4.593   7.579
  356    HB3  GLN  45           HB1      GLN  45  90.816   5.358   7.101
  357    HG2  GLN  45           HG2      GLN  45  89.556   7.250   7.474
  358    HG3  GLN  45           HG1      GLN  45  89.166   6.986   5.778
  359   HE21  GLN  45          HE21      GLN  45  87.937   5.146   8.613
  360   HE22  GLN  45          HE22      GLN  45  86.309   5.548   8.355
  361    HA   PRO  46           HA       PRO  46  86.112   4.263   3.531
  362    HB2  PRO  46           HB2      PRO  46  85.178   1.712   3.400
  363    HB3  PRO  46           HB1      PRO  46  86.512   2.266   2.363
  364    HG2  PRO  46           HG2      PRO  46  86.607   0.635   4.856
  365    HG3  PRO  46           HG1      PRO  46  87.588   0.507   3.386
  366    HD2  PRO  46           HD2      PRO  46  88.393   1.792   5.755
  367    HD3  PRO  46           HD1      PRO  46  89.136   2.020   4.160
  368    H    GLN  47           HN       GLN  47  83.795   4.044   4.126
  369    HA   GLN  47           HA       GLN  47  83.357   4.543   6.873
  370    HB2  GLN  47           HB2      GLN  47  80.929   4.463   6.228
  371    HB3  GLN  47           HB1      GLN  47  81.912   5.552   5.251
  372    HG2  GLN  47           HG2      GLN  47  82.007   2.947   4.047
  373    HG3  GLN  47           HG1      GLN  47  80.321   3.335   4.368
  374   HE21  GLN  47          HE21      GLN  47  79.991   3.568   2.004
  375   HE22  GLN  47          HE22      GLN  47  80.522   4.969   1.205
  376    H    ASP  48           HN       ASP  48  82.819   1.637   4.916
  377    HA   ASP  48           HA       ASP  48  81.426   0.225   6.987
  378    HB2  ASP  48           HB2      ASP  48  82.618  -0.533   4.339
  379    HB3  ASP  48           HB1      ASP  48  82.016  -1.773   5.438
  380    H    TRP  49           HN       TRP  49  84.454   1.244   7.119
  381    HA   TRP  49           HA       TRP  49  86.095  -0.974   7.589
  382    HB2  TRP  49           HB2      TRP  49  86.841   1.401   7.405
  383    HB3  TRP  49           HB1      TRP  49  86.209   1.678   9.025
  384    HD1  TRP  49           HD1      TRP  49  87.549   0.767  11.030
  385    HE1  TRP  49           HE1      TRP  49  89.945  -0.249  11.274
  386    HE3  TRP  49           HE3      TRP  49  88.480  -0.263   6.168
  387    HZ2  TRP  49           HZ2      TRP  49  92.013  -1.380   9.473
  388    HZ3  TRP  49           HZ3      TRP  49  90.600  -1.305   5.448
  389    HH2  TRP  49           HH2      TRP  49  92.335  -1.867   7.108
  390    H    ASN  50           HN       ASN  50  84.246  -2.285   8.723
  391    HA   ASN  50           HA       ASN  50  84.135  -1.655  11.587
  392    HB2  ASN  50           HB2      ASN  50  82.078  -2.406  10.206
  393    HB3  ASN  50           HB1      ASN  50  82.790  -4.016  10.271
  394   HD21  ASN  50          HD21      ASN  50  83.961  -3.458  13.009
  395   HD22  ASN  50          HD22      ASN  50  82.644  -3.566  14.073
  396    H    GLY  51           HN       GLY  51  86.421  -2.065  11.863
  397    HA2  GLY  51           HA2      GLY  51  86.930  -4.903  12.417
  398    HA3  GLY  51           HA1      GLY  51  88.057  -4.060  11.361
  399    H    ASP  52           HN       ASP  52  88.308  -5.258  14.104
  400    HA   ASP  52           HA       ASP  52  88.762  -3.064  15.902
  401    HB2  ASP  52           HB2      ASP  52  88.175  -5.553  16.438
  402    HB3  ASP  52           HB1      ASP  52  89.915  -5.804  16.305
  403    HA   PRO  53           HA       PRO  53  92.755  -1.991  14.178
  404    HB2  PRO  53           HB2      PRO  53  93.565  -0.459  16.370
  405    HB3  PRO  53           HB1      PRO  53  92.628   0.136  14.990
  406    HG2  PRO  53           HG2      PRO  53  91.719  -0.642  17.699
  407    HG3  PRO  53           HG1      PRO  53  91.100   0.611  16.609
  408    HD2  PRO  53           HD2      PRO  53  89.821  -1.757  16.997
  409    HD3  PRO  53           HD1      PRO  53  89.740  -0.872  15.456
  410    H    GLN  54           HN       GLN  54  92.223  -3.534  17.250
  411    HA   GLN  54           HA       GLN  54  95.013  -4.019  17.748
  412    HB2  GLN  54           HB2      GLN  54  92.471  -5.004  19.025
  413    HB3  GLN  54           HB1      GLN  54  94.046  -5.635  19.499
  414    HG2  GLN  54           HG2      GLN  54  93.435  -3.781  20.969
  415    HG3  GLN  54           HG1      GLN  54  94.808  -3.316  19.968
  416   HE21  GLN  54          HE21      GLN  54  94.528  -1.146  19.424
  417   HE22  GLN  54          HE22      GLN  54  93.069  -0.463  18.888
  418    H    ARG  55           HN       ARG  55  92.501  -5.648  15.968
  419    HA   ARG  55           HA       ARG  55  94.039  -8.138  15.892
  420    HB2  ARG  55           HB2      ARG  55  91.269  -7.332  15.204
  421    HB3  ARG  55           HB1      ARG  55  91.979  -8.542  14.140
  422    HG2  ARG  55           HG2      ARG  55  92.624  -9.845  16.222
  423    HG3  ARG  55           HG1      ARG  55  91.638  -8.709  17.144
  424    HD2  ARG  55           HD2      ARG  55  89.664  -9.310  15.840
  425    HD3  ARG  55           HD1      ARG  55  90.630 -10.370  14.818
  426    HE   ARG  55           HE       ARG  55  90.900 -11.124  17.549
  427   HH11  ARG  55          HH21      ARG  55  88.704 -11.144  14.874
  428   HH12  ARG  55          HH22      ARG  55  87.859 -12.561  15.402
  429   HH21  ARG  55          HH11      ARG  55  89.798 -12.981  18.245
  430   HH22  ARG  55          HH12      ARG  55  88.478 -13.600  17.310
  431    HA   PRO  56           HA       PRO  56  96.136  -7.270  12.183
  432    HB2  PRO  56           HB2      PRO  56  96.179  -9.720  10.937
  433    HB3  PRO  56           HB1      PRO  56  97.169  -9.323  12.355
  434    HG2  PRO  56           HG2      PRO  56  94.597 -10.822  12.206
  435    HG3  PRO  56           HG1      PRO  56  96.035 -11.144  13.190
  436    HD2  PRO  56           HD2      PRO  56  93.803  -9.948  14.208
  437    HD3  PRO  56           HD1      PRO  56  95.439  -9.599  14.814
  438    H    PHE  57           HN       PHE  57  96.039  -7.138   9.882
  439    HA   PHE  57           HA       PHE  57  93.340  -7.426   8.699
  440    HB2  PHE  57           HB2      PHE  57  95.245  -5.088   8.362
  441    HB3  PHE  57           HB1      PHE  57  93.713  -5.294   7.517
  442    HD1  PHE  57           HD1      PHE  57  95.210  -4.981  10.927
  443    HD2  PHE  57           HD2      PHE  57  91.682  -4.597   8.511
  444    HE1  PHE  57           HE1      PHE  57  94.021  -3.913  12.826
  445    HE2  PHE  57           HE2      PHE  57  90.493  -3.540  10.408
  446    HZ   PHE  57           HZ       PHE  57  91.659  -3.198  12.565
  447    H    GLU  58           HN       GLU  58  93.444  -7.701   6.314
  448    HA   GLU  58           HA       GLU  58  96.137  -8.486   5.386
  449    HB2  GLU  58           HB2      GLU  58  93.484  -9.866   5.008
  450    HB3  GLU  58           HB1      GLU  58  94.762 -10.074   3.810
  451    HG2  GLU  58           HG2      GLU  58  96.232 -11.061   5.375
  452    HG3  GLU  58           HG1      GLU  58  95.301 -10.472   6.752
  453    H    ALA  59           HN       ALA  59  96.780  -7.577   3.413
  454    HA   ALA  59           HA       ALA  59  94.776  -5.855   2.064
  455    HB1  ALA  59           HB1      ALA  59  97.436  -5.367   3.091
  456    HB2  ALA  59           HB2      ALA  59  96.246  -4.220   2.474
  457    HB3  ALA  59           HB3      ALA  59  97.354  -5.023   1.364
  458    H    ARG  60           HN       ARG  60  94.482  -6.053  -0.055
  459    HA   ARG  60           HA       ARG  60  96.298  -7.840  -1.573
  460    HB2  ARG  60           HB2      ARG  60  93.286  -7.620  -1.645
  461    HB3  ARG  60           HB1      ARG  60  94.210  -8.307  -2.980
  462    HG2  ARG  60           HG2      ARG  60  95.314  -9.774  -1.079
  463    HG3  ARG  60           HG1      ARG  60  93.855  -9.355  -0.183
  464    HD2  ARG  60           HD2      ARG  60  92.899 -10.081  -2.705
  465    HD3  ARG  60           HD1      ARG  60  94.192 -11.234  -2.395
  466    HE   ARG  60           HE       ARG  60  92.331 -10.852  -0.193
  467   HH11  ARG  60          HH21      ARG  60  93.195 -12.602  -3.049
  468   HH12  ARG  60          HH22      ARG  60  92.258 -14.001  -2.643
  469   HH21  ARG  60          HH11      ARG  60  91.096 -12.682   0.346
  470   HH22  ARG  60          HH12      ARG  60  91.069 -14.047  -0.722
  471    H    LEU  61           HN       LEU  61  97.219  -6.811  -3.296
  472    HA   LEU  61           HA       LEU  61  96.048  -4.219  -4.099
  473    HB2  LEU  61           HB2      LEU  61  98.807  -5.124  -4.862
  474    HB3  LEU  61           HB1      LEU  61  98.189  -3.486  -4.661
  475    HG   LEU  61           HG       LEU  61  98.654  -5.492  -2.430
  476   HD11  LEU  61          HD11      LEU  61 100.462  -3.996  -1.764
  477   HD12  LEU  61          HD12      LEU  61 100.071  -2.890  -3.081
  478   HD13  LEU  61          HD13      LEU  61 100.713  -4.493  -3.437
  479   HD21  LEU  61          HD21      LEU  61  96.847  -4.149  -1.710
  480   HD22  LEU  61          HD22      LEU  61  97.469  -2.716  -2.523
  481   HD23  LEU  61          HD23      LEU  61  98.255  -3.313  -1.062
  482    H    TYR  62           HN       TYR  62  95.653  -3.748  -6.242
  483    HA   TYR  62           HA       TYR  62  95.963  -5.979  -8.159
  484    HB2  TYR  62           HB2      TYR  62  93.582  -4.118  -8.106
  485    HB3  TYR  62           HB1      TYR  62  93.781  -5.597  -9.046
  486    HD1  TYR  62           HD1      TYR  62  93.662  -4.336  -5.527
  487    HD2  TYR  62           HD2      TYR  62  93.047  -7.655  -8.183
  488    HE1  TYR  62           HE1      TYR  62  92.687  -5.653  -3.662
  489    HE2  TYR  62           HE2      TYR  62  92.072  -8.969  -6.319
  490    HH   TYR  62           HH       TYR  62  92.486  -8.407  -3.258
  491    H    LEU  63           HN       LEU  63  97.415  -5.333  -9.571
  492    HA   LEU  63           HA       LEU  63  97.411  -2.523 -10.501
  493    HB2  LEU  63           HB2      LEU  63  99.517  -4.604 -10.165
  494    HB3  LEU  63           HB1      LEU  63  99.690  -3.507 -11.534
  495    HG   LEU  63           HG       LEU  63  99.494  -1.578 -10.025
  496   HD11  LEU  63          HD11      LEU  63  99.634  -2.117  -7.518
  497   HD12  LEU  63          HD12      LEU  63  99.142  -3.753  -7.954
  498   HD13  LEU  63          HD13      LEU  63  98.074  -2.391  -8.292
  499   HD21  LEU  63          HD21      LEU  63 101.533  -3.179  -8.579
  500   HD22  LEU  63          HD22      LEU  63 101.710  -1.661  -9.458
  501   HD23  LEU  63          HD23      LEU  63 101.683  -3.188 -10.337
  502    H    GLY  64           HN       GLY  64  98.834  -5.212 -12.226
  503    HA2  GLY  64           HA2      GLY  64  97.496  -4.535 -14.661
  504    HA3  GLY  64           HA1      GLY  64  98.496  -5.963 -14.390
  505    H    LEU  65           HN       LEU  65  96.418  -6.569 -15.878
  506    HA   LEU  65           HA       LEU  65  94.047  -7.101 -14.363
  507    HB2  LEU  65           HB2      LEU  65  93.114  -7.890 -16.343
  508    HB3  LEU  65           HB1      LEU  65  94.349  -6.797 -16.959
  509    HG   LEU  65           HG       LEU  65  95.882  -8.941 -16.894
  510   HD11  LEU  65          HD11      LEU  65  94.889 -10.923 -16.489
  511   HD12  LEU  65          HD12      LEU  65  93.641 -10.603 -17.687
  512   HD13  LEU  65          HD13      LEU  65  93.428 -10.055 -16.027
  513   HD21  LEU  65          HD21      LEU  65  93.728  -8.317 -18.921
  514   HD22  LEU  65          HD22      LEU  65  94.959  -9.546 -19.212
  515   HD23  LEU  65          HD23      LEU  65  95.432  -7.865 -18.969
  516    H    ASP  66           HN       ASP  66  96.986  -8.894 -15.148
  517    HA   ASP  66           HA       ASP  66  95.966 -11.367 -13.911
  518    HB2  ASP  66           HB2      ASP  66  97.118 -11.259 -16.192
  519    HB3  ASP  66           HB1      ASP  66  98.592 -10.909 -15.295
  520    H    VAL  67           HN       VAL  67  97.243  -8.600 -12.768
  521    HA   VAL  67           HA       VAL  67  99.298  -9.920 -11.104
  522    HB   VAL  67           HB       VAL  67  98.842  -7.047 -11.879
  523   HG11  VAL  67          HG11      VAL  67 100.331  -8.151  -9.492
  524   HG12  VAL  67          HG12      VAL  67  99.219  -6.785  -9.554
  525   HG13  VAL  67          HG13      VAL  67 100.829  -6.641 -10.255
  526   HG21  VAL  67          HG21      VAL  67 101.457  -8.538 -11.770
  527   HG22  VAL  67          HG22      VAL  67 100.972  -7.217 -12.835
  528   HG23  VAL  67          HG23      VAL  67 100.339  -8.841 -13.103
  529    H    LEU  68           HN       LEU  68  98.135 -10.899  -9.556
  530    HA   LEU  68           HA       LEU  68  96.502  -9.174  -7.788
  531    HB2  LEU  68           HB2      LEU  68  95.044 -10.883  -8.417
  532    HB3  LEU  68           HB1      LEU  68  96.337 -12.069  -8.570
  533    HG   LEU  68           HG       LEU  68  96.569 -12.185  -6.144
  534   HD11  LEU  68          HD11      LEU  68  94.516 -10.934  -4.935
  535   HD12  LEU  68          HD12      LEU  68  94.748  -9.821  -6.283
  536   HD13  LEU  68          HD13      LEU  68  96.077 -10.152  -5.172
  537   HD21  LEU  68          HD21      LEU  68  94.377 -13.177  -5.611
  538   HD22  LEU  68          HD22      LEU  68  94.877 -13.621  -7.243
  539   HD23  LEU  68          HD23      LEU  68  93.664 -12.363  -7.004
  540    H    ILE  69           HN       ILE  69  97.604  -8.576  -6.023
  541    HA   ILE  69           HA       ILE  69  99.723 -10.383  -5.016
  542    HB   ILE  69           HB       ILE  69  99.483  -7.371  -4.957
  543   HG12  ILE  69          HG12      ILE  69 101.962  -8.665  -5.894
  544   HG13  ILE  69          HG11      ILE  69 100.550  -9.108  -6.851
  545   HG21  ILE  69          HG21      ILE  69 101.970  -7.962  -3.932
  546   HG22  ILE  69          HG22      ILE  69 100.974  -9.219  -3.199
  547   HG23  ILE  69          HG23      ILE  69 100.566  -7.523  -2.957
  548   HD11  ILE  69          HD11      ILE  69 100.009  -6.686  -7.112
  549   HD12  ILE  69          HD12      ILE  69 101.573  -7.113  -7.807
  550   HD13  ILE  69          HD13      ILE  69 101.495  -6.290  -6.248
  551    H    ARG  70           HN       ARG  70  99.867 -10.826  -2.850
  552    HA   ARG  70           HA       ARG  70  97.691  -9.815  -1.120
  553    HB2  ARG  70           HB2      ARG  70  97.615 -12.090  -0.071
  554    HB3  ARG  70           HB1      ARG  70  97.043 -12.049  -1.738
  555    HG2  ARG  70           HG2      ARG  70  99.394 -12.719  -2.442
  556    HG3  ARG  70           HG1      ARG  70  99.733 -13.009  -0.737
  557    HD2  ARG  70           HD2      ARG  70  98.344 -14.856  -0.630
  558    HD3  ARG  70           HD1      ARG  70  97.277 -14.260  -1.900
  559    HE   ARG  70           HE       ARG  70  99.999 -15.115  -2.633
  560   HH11  ARG  70          HH21      ARG  70  96.566 -15.604  -2.644
  561   HH12  ARG  70          HH22      ARG  70  96.602 -16.765  -3.928
  562   HH21  ARG  70          HH11      ARG  70 100.043 -16.637  -4.311
  563   HH22  ARG  70          HH12      ARG  70  98.568 -17.349  -4.869
  564    H    MET  71           HN       MET  71  98.320  -9.053   0.766
  565    HA   MET  71           HA       MET  71 100.895  -9.897   1.924
  566    HB2  MET  71           HB2      MET  71 100.247  -6.986   2.053
  567    HB3  MET  71           HB1      MET  71 101.815  -7.790   2.006
  568    HG2  MET  71           HG2      MET  71 101.028  -8.441  -0.447
  569    HG3  MET  71           HG1      MET  71 100.008  -7.020  -0.256
  570    HE1  MET  71           HE1      MET  71 102.442  -5.585   1.948
  571    HE2  MET  71           HE2      MET  71 101.022  -4.990   1.089
  572    HE3  MET  71           HE3      MET  71 102.608  -4.303   0.741
  573    H    GLU  72           HN       GLU  72 100.964  -9.727   4.167
  574    HA   GLU  72           HA       GLU  72  98.334  -9.363   5.433
  575    HB2  GLU  72           HB2      GLU  72  99.697 -11.504   5.779
  576    HB3  GLU  72           HB1      GLU  72 100.815 -10.520   6.726
  577    HG2  GLU  72           HG2      GLU  72  99.056  -9.909   8.277
  578    HG3  GLU  72           HG1      GLU  72  97.840 -10.701   7.276
  579    H    ILE  73           HN       ILE  73  98.032  -7.575   6.837
  580    HA   ILE  73           HA       ILE  73 100.479  -6.153   7.649
  581    HB   ILE  73           HB       ILE  73  99.627  -4.065   6.816
  582   HG12  ILE  73          HG12      ILE  73  97.201  -5.716   6.024
  583   HG13  ILE  73          HG11      ILE  73  97.234  -4.421   7.216
  584   HG21  ILE  73          HG21      ILE  73  99.187  -6.141   4.657
  585   HG22  ILE  73          HG22      ILE  73 100.789  -5.734   5.267
  586   HG23  ILE  73          HG23      ILE  73  99.815  -4.507   4.468
  587   HD11  ILE  73          HD11      ILE  73  96.455  -4.022   4.675
  588   HD12  ILE  73          HD12      ILE  73  98.179  -3.723   4.474
  589   HD13  ILE  73          HD13      ILE  73  97.248  -2.773   5.620
  590    H    SER  74           HN       SER  74 100.215  -4.634   9.323
  591    HA   SER  74           HA       SER  74  97.766  -4.950  10.962
  592    HB2  SER  74           HB2      SER  74  99.462  -4.486  12.897
  593    HB3  SER  74           HB1      SER  74  99.360  -6.108  12.216
  594    HG   SER  74           HG       SER  74 101.045  -5.013  10.682
  595    H    LEU  75           HN       LEU  75  97.207  -3.099  12.270
  596    HA   LEU  75           HA       LEU  75  97.487  -0.609  10.937
  597    HB2  LEU  75           HB2      LEU  75  95.748  -1.640  12.766
  598    HB3  LEU  75           HB1      LEU  75  96.709  -0.581  13.793
  599    HG   LEU  75           HG       LEU  75  96.290   1.288  12.204
  600   HD11  LEU  75          HD11      LEU  75  94.898  -0.912  10.735
  601   HD12  LEU  75          HD12      LEU  75  95.821   0.449  10.098
  602   HD13  LEU  75          HD13      LEU  75  94.175   0.694  10.675
  603   HD21  LEU  75          HD21      LEU  75  93.671   0.027  13.015
  604   HD22  LEU  75          HD22      LEU  75  94.086   1.740  12.974
  605   HD23  LEU  75          HD23      LEU  75  94.791   0.692  14.204
  606    H    ALA  76           HN       ALA  76  99.138   0.727  10.935
  607    HA   ALA  76           HA       ALA  76 101.079   0.597  13.130
  608    HB1  ALA  76           HB1      ALA  76 102.062   0.334  10.918
  609    HB2  ALA  76           HB2      ALA  76 102.586   1.864  11.613
  610    HB3  ALA  76           HB3      ALA  76 101.322   1.838  10.382
  611    H    TRP  77           HN       TRP  77  99.030   2.813  11.350
  612    HA   TRP  77           HA       TRP  77  98.580   4.507  13.616
  613    HB2  TRP  77           HB2      TRP  77  99.690   6.538  12.792
  614    HB3  TRP  77           HB1      TRP  77 100.885   5.253  13.005
  615    HD1  TRP  77           HD1      TRP  77 102.016   4.244  10.861
  616    HE1  TRP  77           HE1      TRP  77 101.893   4.790   8.359
  617    HE3  TRP  77           HE3      TRP  77  98.259   7.706  10.882
  618    HZ2  TRP  77           HZ2      TRP  77 100.587   6.625   6.633
  619    HZ3  TRP  77           HZ3      TRP  77  97.608   8.853   8.782
  620    HH2  TRP  77           HH2      TRP  77  98.750   8.307   6.650
  621    H    ALA  78           HN       ALA  78  97.330   6.546  12.884
  622    HA   ALA  78           HA       ALA  78  96.037   6.310  10.254
  623    HB1  ALA  78           HB1      ALA  78  94.508   6.124  12.854
  624    HB2  ALA  78           HB2      ALA  78  94.684   4.845  11.651
  625    HB3  ALA  78           HB3      ALA  78  93.786   6.310  11.256
  626    H    ARG  79           HN       ARG  79  95.899   8.396   9.476
  627    HA   ARG  79           HA       ARG  79  95.050  10.498  11.288
  628    HB2  ARG  79           HB2      ARG  79  97.620  10.250  11.401
  629    HB3  ARG  79           HB1      ARG  79  97.620  10.942   9.780
  630    HG2  ARG  79           HG2      ARG  79  96.501  12.946  10.577
  631    HG3  ARG  79           HG1      ARG  79  96.317  12.247  12.186
  632    HD2  ARG  79           HD2      ARG  79  98.328  13.100  12.738
  633    HD3  ARG  79           HD1      ARG  79  99.074  12.055  11.532
  634    HE   ARG  79           HE       ARG  79  98.257  14.090   9.996
  635   HH11  ARG  79          HH21      ARG  79  99.823  14.015  13.082
  636   HH12  ARG  79          HH22      ARG  79 100.651  15.519  12.852
  637   HH21  ARG  79          HH11      ARG  79  99.341  16.060   9.687
  638   HH22  ARG  79          HH12      ARG  79 100.379  16.677  10.930
  639    H    ASP  80           HN       ASP  80  93.852  12.035  10.347
  640    HA   ASP  80           HA       ASP  80  92.733  13.209   8.745
  641    HB2  ASP  80           HB2      ASP  80  95.419  12.874   7.427
  642    HB3  ASP  80           HB1      ASP  80  94.138  13.884   6.758
  643    H    GLY  81           HN       GLY  81  91.881  10.561   8.631
  644    HA2  GLY  81           HA2      GLY  81  90.479   9.453   7.173
  645    HA3  GLY  81           HA1      GLY  81  91.062  10.470   5.868
  646    H    LEU  82           HN       LEU  82  93.933   9.725   6.455
  647    HA   LEU  82           HA       LEU  82  93.867   7.259   4.909
  648    HB2  LEU  82           HB2      LEU  82  96.372   8.675   5.782
  649    HB3  LEU  82           HB1      LEU  82  96.075   7.736   4.318
  650    HG   LEU  82           HG       LEU  82  94.910  10.455   4.979
  651   HD11  LEU  82          HD11      LEU  82  96.209  11.159   2.994
  652   HD12  LEU  82          HD12      LEU  82  96.838   9.521   2.829
  653   HD13  LEU  82          HD13      LEU  82  97.263  10.490   4.239
  654   HD21  LEU  82          HD21      LEU  82  94.431   8.540   2.678
  655   HD22  LEU  82          HD22      LEU  82  94.015  10.252   2.606
  656   HD23  LEU  82          HD23      LEU  82  93.232   9.204   3.788
  657    H    LEU  83           HN       LEU  83  95.206   5.443   5.460
  658    HA   LEU  83           HA       LEU  83  95.602   5.079   8.394
  659    HB2  LEU  83           HB2      LEU  83  94.678   3.001   6.425
  660    HB3  LEU  83           HB1      LEU  83  94.801   2.849   8.175
  661    HG   LEU  83           HG       LEU  83  93.003   4.843   6.776
  662   HD11  LEU  83          HD11      LEU  83  91.210   3.195   7.664
  663   HD12  LEU  83          HD12      LEU  83  92.531   2.034   7.781
  664   HD13  LEU  83          HD13      LEU  83  92.102   2.725   6.216
  665   HD21  LEU  83          HD21      LEU  83  93.417   3.971   9.644
  666   HD22  LEU  83          HD22      LEU  83  91.914   4.732   9.123
  667   HD23  LEU  83          HD23      LEU  83  93.437   5.610   8.987
  668    H    GLY  84           HN       GLY  84  97.635   4.253   8.916
  669    HA2  GLY  84           HA2      GLY  84  99.389   3.489   6.708
  670    HA3  GLY  84           HA1      GLY  84  99.869   3.823   8.369
  671    H    PHE  85           HN       PHE  85 100.518   1.499   6.737
  672    HA   PHE  85           HA       PHE  85  99.588  -0.545   8.626
  673    HB2  PHE  85           HB2      PHE  85  99.064  -0.474   5.681
  674    HB3  PHE  85           HB1      PHE  85  99.341  -2.025   6.460
  675    HD1  PHE  85           HD2      PHE  85  97.939  -2.634   8.495
  676    HD2  PHE  85           HD1      PHE  85  96.989   0.634   5.882
  677    HE1  PHE  85           HE2      PHE  85  95.612  -2.635   9.347
  678    HE2  PHE  85           HE1      PHE  85  94.657   0.633   6.729
  679    HZ   PHE  85           HZ       PHE  85  93.973  -0.999   8.464
  680    H    GLU  86           HN       GLU  86 101.207  -1.904   9.200
  681    HA   GLU  86           HA       GLU  86 103.705  -1.708   7.658
  682    HB2  GLU  86           HB2      GLU  86 104.830  -2.372   9.663
  683    HB3  GLU  86           HB1      GLU  86 103.627  -1.178  10.151
  684    HG2  GLU  86           HG2      GLU  86 102.064  -3.221  10.517
  685    HG3  GLU  86           HG1      GLU  86 103.553  -4.165  10.509
  686    H    CYS  87           HN       CYS  87 104.342  -3.451   6.476
  687    HA   CYS  87           HA       CYS  87 102.676  -5.778   6.363
  688    HB2  CYS  87           HB2      CYS  87 104.171  -4.604   4.516
  689    HB3  CYS  87           HB1      CYS  87 105.375  -5.755   5.098
  690    HG   CYS  87           HG       CYS  87 102.734  -6.500   3.655
  691    H    GLN  88           HN       GLN  88 102.797  -7.578   7.477
  692    HA   GLN  88           HA       GLN  88 105.187  -8.095   9.118
  693    HB2  GLN  88           HB2      GLN  88 103.701  -9.710  10.310
  694    HB3  GLN  88           HB1      GLN  88 103.125  -8.046  10.379
  695    HG2  GLN  88           HG2      GLN  88 101.942  -9.000   8.059
  696    HG3  GLN  88           HG1      GLN  88 101.892 -10.402   9.122
  697   HE21  GLN  88          HE21      GLN  88 101.285  -6.842   9.386
  698   HE22  GLN  88          HE22      GLN  88  99.889  -7.014  10.335
  699    H    HIS  89           HN       HIS  89 103.242  -9.369   6.499
  700    HA   HIS  89           HA       HIS  89 105.340 -11.217   5.791
  701    HB2  HIS  89           HB2      HIS  89 104.514 -12.950   6.998
  702    HB3  HIS  89           HB1      HIS  89 102.974 -12.137   7.272
  703    HD2  HIS  89           HD2      HIS  89 101.109 -13.873   6.217
  704    HE1  HIS  89           HE1      HIS  89 103.070 -14.710   2.569
  705    HE2  HIS  89           HE2      HIS  89 100.951 -15.104   3.917
  706    H    ILE  90           HN       ILE  90 105.275 -11.729   3.659
  707    HA   ILE  90           HA       ILE  90 102.882 -11.190   2.028
  708    HB   ILE  90           HB       ILE  90 104.000  -9.039   2.055
  709   HG12  ILE  90          HG12      ILE  90 104.710 -10.559  -0.478
  710   HG13  ILE  90          HG11      ILE  90 103.135  -9.855  -0.125
  711   HG21  ILE  90          HG21      ILE  90 106.173  -9.591   2.844
  712   HG22  ILE  90          HG22      ILE  90 106.416  -8.965   1.215
  713   HG23  ILE  90          HG23      ILE  90 106.461 -10.703   1.509
  714   HD11  ILE  90          HD11      ILE  90 104.569  -7.663   0.282
  715   HD12  ILE  90          HD12      ILE  90 104.096  -8.133  -1.351
  716   HD13  ILE  90          HD13      ILE  90 105.719  -8.489  -0.768
  717    H    ASP  91           HN       ASP  91 102.695 -12.373   0.284
  718    HA   ASP  91           HA       ASP  91 103.979 -14.840   0.147
  719    HB2  ASP  91           HB2      ASP  91 101.943 -13.448  -1.297
  720    HB3  ASP  91           HB1      ASP  91 103.031 -14.196  -2.461
  721    H    LEU  92           HN       LEU  92 105.618 -15.694  -0.938
  722    HA   LEU  92           HA       LEU  92 107.878 -14.202  -1.632
  723    HB2  LEU  92           HB2      LEU  92 107.653 -16.743  -1.205
  724    HB3  LEU  92           HB1      LEU  92 107.268 -16.854  -2.922
  725    HG   LEU  92           HG       LEU  92 109.445 -15.359  -3.185
  726   HD11  LEU  92          HD11      LEU  92 109.834 -15.044  -0.786
  727   HD12  LEU  92          HD12      LEU  92 111.145 -15.996  -1.479
  728   HD13  LEU  92          HD13      LEU  92 109.880 -16.790  -0.543
  729   HD21  LEU  92          HD21      LEU  92 109.309 -18.334  -2.656
  730   HD22  LEU  92          HD22      LEU  92 110.793 -17.549  -3.197
  731   HD23  LEU  92          HD23      LEU  92 109.353 -17.505  -4.212
  732    H    ASP  93           HN       ASP  93 105.297 -15.460  -3.720
  733    HA   ASP  93           HA       ASP  93 106.435 -14.522  -6.158
  734    HB2  ASP  93           HB2      ASP  93 104.592 -16.299  -5.837
  735    HB3  ASP  93           HB1      ASP  93 103.484 -14.935  -5.690
  736    H    SER  94           HN       SER  94 104.190 -13.206  -3.790
  737    HA   SER  94           HA       SER  94 103.485 -10.866  -5.257
  738    HB2  SER  94           HB2      SER  94 101.972 -11.216  -3.558
  739    HB3  SER  94           HB1      SER  94 103.194 -11.847  -2.460
  740    HG   SER  94           HG       SER  94 103.275  -9.159  -3.278
  741    H    ILE  95           HN       ILE  95 106.037 -11.723  -3.009
  742    HA   ILE  95           HA       ILE  95 107.077  -9.171  -2.467
  743    HB   ILE  95           HB       ILE  95 108.302 -11.925  -2.541
  744   HG12  ILE  95          HG12      ILE  95 107.825  -9.906  -0.327
  745   HG13  ILE  95          HG11      ILE  95 106.799 -11.294  -0.673
  746   HG21  ILE  95          HG21      ILE  95 110.146 -10.541  -3.191
  747   HG22  ILE  95          HG22      ILE  95 110.324 -10.798  -1.459
  748   HG23  ILE  95          HG23      ILE  95 109.680  -9.272  -2.059
  749   HD11  ILE  95          HD11      ILE  95 109.199 -12.541  -0.474
  750   HD12  ILE  95          HD12      ILE  95 108.119 -12.304   0.899
  751   HD13  ILE  95          HD13      ILE  95 109.460 -11.193   0.633
  752    H    SER  96           HN       SER  96 107.539 -11.375  -5.166
  753    HA   SER  96           HA       SER  96 109.648  -9.843  -6.306
  754    HB2  SER  96           HB2      SER  96 108.602 -12.362  -6.803
  755    HB3  SER  96           HB1      SER  96 108.056 -11.445  -8.209
  756    HG   SER  96           HG       SER  96 110.160 -10.950  -8.687
  757    H    HIS  97           HN       HIS  97 106.139  -9.893  -6.826
  758    HA   HIS  97           HA       HIS  97 106.193  -8.123  -9.031
  759    HB2  HIS  97           HB2      HIS  97 104.094  -8.797  -6.970
  760    HB3  HIS  97           HB1      HIS  97 103.826  -7.523  -8.145
  761    HD2  HIS  97           HD2      HIS  97 103.881 -11.401  -8.000
  762    HE1  HIS  97           HE1      HIS  97 103.145 -10.276 -12.001
  763    HE2  HIS  97           HE2      HIS  97 103.205 -12.232 -10.383
  764    H    LEU  98           HN       LEU  98 106.276  -7.622  -5.561
  765    HA   LEU  98           HA       LEU  98 106.032  -4.751  -5.643
  766    HB2  LEU  98           HB2      LEU  98 106.666  -6.829  -3.623
  767    HB3  LEU  98           HB1      LEU  98 107.428  -5.265  -3.348
  768    HG   LEU  98           HG       LEU  98 105.172  -5.521  -2.256
  769   HD11  LEU  98          HD11      LEU  98 104.866  -3.374  -4.320
  770   HD12  LEU  98          HD12      LEU  98 106.277  -3.310  -3.266
  771   HD13  LEU  98          HD13      LEU  98 104.658  -3.291  -2.573
  772   HD21  LEU  98          HD21      LEU  98 103.234  -5.859  -3.477
  773   HD22  LEU  98          HD22      LEU  98 104.367  -6.774  -4.472
  774   HD23  LEU  98          HD23      LEU  98 103.898  -5.139  -4.940
  775    H    ARG  99           HN       ARG  99 108.730  -6.994  -5.935
  776    HA   ARG  99           HA       ARG  99 110.754  -5.000  -5.698
  777    HB2  ARG  99           HB2      ARG  99 110.600  -7.829  -6.502
  778    HB3  ARG  99           HB1      ARG  99 111.869  -6.922  -7.317
  779    HG2  ARG  99           HG2      ARG  99 112.715  -7.904  -5.223
  780    HG3  ARG  99           HG1      ARG  99 112.721  -6.146  -5.132
  781    HD2  ARG  99           HD2      ARG  99 110.276  -6.569  -4.110
  782    HD3  ARG  99           HD1      ARG  99 111.000  -8.113  -3.683
  783    HE   ARG  99           HE       ARG  99 111.726  -5.493  -2.623
  784   HH11  ARG  99          HH21      ARG  99 112.471  -8.848  -3.015
  785   HH12  ARG  99          HH22      ARG  99 113.578  -8.901  -1.684
  786   HH21  ARG  99          HH11      ARG  99 113.179  -5.552  -0.878
  787   HH22  ARG  99          HH12      ARG  99 113.980  -7.034  -0.476
  788    H    ARG 100           HN       ARG 100 108.859  -6.278  -8.370
  789    HA   ARG 100           HA       ARG 100 110.156  -5.093 -10.564
  790    HB2  ARG 100           HB2      ARG 100 107.239  -5.689 -10.079
  791    HB3  ARG 100           HB1      ARG 100 107.895  -5.158 -11.625
  792    HG2  ARG 100           HG2      ARG 100 109.518  -7.113 -11.474
  793    HG3  ARG 100           HG1      ARG 100 108.558  -7.693 -10.115
  794    HD2  ARG 100           HD2      ARG 100 106.530  -7.558 -11.637
  795    HD3  ARG 100           HD1      ARG 100 107.648  -7.277 -12.969
  796    HE   ARG 100           HE       ARG 100 108.181  -9.648 -11.357
  797   HH11  ARG 100          HH21      ARG 100 106.678  -8.237 -14.138
  798   HH12  ARG 100          HH22      ARG 100 106.576  -9.729 -15.011
  799   HH21  ARG 100          HH11      ARG 100 108.049 -11.609 -12.496
  800   HH22  ARG 100          HH12      ARG 100 107.351 -11.638 -14.082
  801    H    LEU 101           HN       LEU 101 107.790  -3.820  -8.272
  802    HA   LEU 101           HA       LEU 101 107.382  -1.357  -9.642
  803    HB2  LEU 101           HB2      LEU 101 106.629  -2.506  -7.004
  804    HB3  LEU 101           HB1      LEU 101 106.694  -0.748  -7.073
  805    HG   LEU 101           HG       LEU 101 105.225  -2.298  -9.200
  806   HD11  LEU 101          HD11      LEU 101 103.165  -1.732  -7.701
  807   HD12  LEU 101          HD12      LEU 101 104.341  -1.667  -6.390
  808   HD13  LEU 101          HD13      LEU 101 104.127  -3.157  -7.307
  809   HD21  LEU 101          HD21      LEU 101 104.957   0.479  -8.001
  810   HD22  LEU 101          HD22      LEU 101 103.908  -0.174  -9.257
  811   HD23  LEU 101          HD23      LEU 101 105.618   0.090  -9.587
  812    H    VAL 102           HN       VAL 102 109.375  -2.282  -6.848
  813    HA   VAL 102           HA       VAL 102 110.465   0.255  -6.327
  814    HB   VAL 102           HB       VAL 102 111.517  -2.532  -5.834
  815   HG11  VAL 102          HG11      VAL 102 113.489  -1.207  -5.892
  816   HG12  VAL 102          HG12      VAL 102 113.047  -1.273  -4.185
  817   HG13  VAL 102          HG13      VAL 102 112.684   0.168  -5.136
  818   HG21  VAL 102          HG21      VAL 102 109.439  -1.595  -4.648
  819   HG22  VAL 102          HG22      VAL 102 110.534  -0.450  -3.872
  820   HG23  VAL 102          HG23      VAL 102 110.737  -2.182  -3.607
  821    H    GLU 103           HN       GLU 103 111.536  -2.345  -8.481
  822    HA   GLU 103           HA       GLU 103 113.993  -1.183  -9.242
  823    HB2  GLU 103           HB2      GLU 103 113.465  -3.533  -9.675
  824    HB3  GLU 103           HB1      GLU 103 112.192  -3.052 -10.797
  825    HG2  GLU 103           HG2      GLU 103 113.753  -2.118 -12.332
  826    HG3  GLU 103           HG1      GLU 103 115.056  -2.158 -11.145
  827    H    LEU 104           HN       LEU 104 110.783  -1.071 -10.796
  828    HA   LEU 104           HA       LEU 104 111.585   0.580 -12.950
  829    HB2  LEU 104           HB2      LEU 104 108.877   0.103 -11.693
  830    HB3  LEU 104           HB1      LEU 104 109.115   1.031 -13.172
  831    HG   LEU 104           HG       LEU 104 110.225  -1.762 -12.896
  832   HD11  LEU 104          HD11      LEU 104 107.453  -0.973 -13.845
  833   HD12  LEU 104          HD12      LEU 104 107.828  -1.935 -12.415
  834   HD13  LEU 104          HD13      LEU 104 108.166  -2.576 -14.022
  835   HD21  LEU 104          HD21      LEU 104 111.094  -0.630 -14.798
  836   HD22  LEU 104          HD22      LEU 104 109.537   0.112 -15.171
  837   HD23  LEU 104          HD23      LEU 104 109.778  -1.614 -15.435
  838    H    ASN 105           HN       ASN 105 110.197   1.324  -9.771
  839    HA   ASN 105           HA       ASN 105 109.840   4.086 -10.183
  840    HB2  ASN 105           HB2      ASN 105 109.822   2.248  -7.915
  841    HB3  ASN 105           HB1      ASN 105 110.492   3.818  -7.482
  842   HD21  ASN 105          HD21      ASN 105 107.977   3.236  -9.963
  843   HD22  ASN 105          HD22      ASN 105 106.764   4.110  -9.159
  844    H    LEU 106           HN       LEU 106 112.666   2.183  -9.370
  845    HA   LEU 106           HA       LEU 106 114.367   4.189  -8.433
  846    HB2  LEU 106           HB2      LEU 106 114.614   1.492  -9.060
  847    HB3  LEU 106           HB1      LEU 106 115.700   2.272 -10.208
  848    HG   LEU 106           HG       LEU 106 116.561   3.608  -8.142
  849   HD11  LEU 106          HD11      LEU 106 116.359   2.300  -6.022
  850   HD12  LEU 106          HD12      LEU 106 115.203   1.237  -6.822
  851   HD13  LEU 106          HD13      LEU 106 114.810   2.937  -6.573
  852   HD21  LEU 106          HD21      LEU 106 118.158   1.800  -7.615
  853   HD22  LEU 106          HD22      LEU 106 117.870   1.895  -9.353
  854   HD23  LEU 106          HD23      LEU 106 117.095   0.631  -8.397
  855    H    GLY 107           HN       GLY 107 113.014   3.705 -11.539
  856    HA2  GLY 107           HA2      GLY 107 114.919   5.629 -12.747
  857    HA3  GLY 107           HA1      GLY 107 114.017   4.417 -13.654
  858    H    ASP 108           HN       ASP 108 111.486   4.743 -12.470
  859    HA   ASP 108           HA       ASP 108 110.407   6.832 -13.998
  860    HB2  ASP 108           HB2      ASP 108 109.044   5.799 -11.525
  861    HB3  ASP 108           HB1      ASP 108 108.334   6.268 -13.069
  862    H    GLU 109           HN       GLU 109 108.626   7.762 -11.707
  863    HA   GLU 109           HA       GLU 109 108.459   9.656 -10.415
  864    HB2  GLU 109           HB2      GLU 109 110.025   8.184  -9.030
  865    HB3  GLU 109           HB1      GLU 109 111.343   9.165  -9.670
  866    HG2  GLU 109           HG2      GLU 109 110.039  11.204  -8.863
  867    HG3  GLU 109           HG1      GLU 109 109.006  10.078  -7.983
  868    H    GLU 110           HN       GLU 110 108.252  11.406 -11.699
  869    HA   GLU 110           HA       GLU 110 110.533  12.437 -13.195
  870    HB2  GLU 110           HB2      GLU 110 108.763  14.180 -13.888
  871    HB3  GLU 110           HB1      GLU 110 108.531  12.518 -14.431
  872    HG2  GLU 110           HG2      GLU 110 106.921  12.088 -12.703
  873    HG3  GLU 110           HG1      GLU 110 107.297  13.610 -11.895
  874    H    LEU 111           HN       LEU 111 110.978  12.556 -10.446
  875    HA   LEU 111           HA       LEU 111 111.145  15.468 -10.064
  876    HB2  LEU 111           HB2      LEU 111 110.033  13.505  -8.047
  877    HB3  LEU 111           HB1      LEU 111 110.574  15.129  -7.628
  878    HG   LEU 111           HG       LEU 111 108.933  15.711  -9.723
  879   HD11  LEU 111          HD11      LEU 111 106.990  14.328  -9.722
  880   HD12  LEU 111          HD12      LEU 111 107.522  13.453  -8.288
  881   HD13  LEU 111          HD13      LEU 111 108.354  13.216  -9.823
  882   HD21  LEU 111          HD21      LEU 111 108.870  16.718  -7.461
  883   HD22  LEU 111          HD22      LEU 111 108.059  15.277  -6.847
  884   HD23  LEU 111          HD23      LEU 111 107.249  16.311  -8.023
  885    H    LEU 112           HN       LEU 112 113.057  13.371 -10.837
  886    HA   LEU 112           HA       LEU 112 114.706  12.437  -8.839
  887    HB2  LEU 112           HB2      LEU 112 115.214  13.382 -11.638
  888    HB3  LEU 112           HB1      LEU 112 116.591  13.000 -10.605
  889    HG   LEU 112           HG       LEU 112 115.639  10.757 -10.171
  890   HD11  LEU 112          HD11      LEU 112 113.505  11.693 -12.113
  891   HD12  LEU 112          HD12      LEU 112 113.270  11.263 -10.419
  892   HD13  LEU 112          HD13      LEU 112 113.711  10.021 -11.591
  893   HD21  LEU 112          HD21      LEU 112 117.199  11.062 -12.052
  894   HD22  LEU 112          HD22      LEU 112 115.853  11.482 -13.112
  895   HD23  LEU 112          HD23      LEU 112 115.982   9.851 -12.455
  896    H    GLU 113           HN       GLU 113 115.103  13.669  -7.071
  897    HA   GLU 113           HA       GLU 113 116.769  16.062  -7.470
  898    HB2  GLU 113           HB2      GLU 113 114.201  15.912  -5.898
  899    HB3  GLU 113           HB1      GLU 113 115.449  17.095  -5.508
  900    HG2  GLU 113           HG2      GLU 113 114.363  16.768  -8.309
  901    HG3  GLU 113           HG1      GLU 113 113.631  17.865  -7.140
  902    H    ARG 114           HN       ARG 114 115.414  13.735  -5.135
  903    HA   ARG 114           HA       ARG 114 116.977  14.129  -2.939
  904    HB2  ARG 114           HB2      ARG 114 115.822  11.690  -4.205
  905    HB3  ARG 114           HB1      ARG 114 117.033  11.439  -2.951
  906    HG2  ARG 114           HG2      ARG 114 114.864  11.485  -1.887
  907    HG3  ARG 114           HG1      ARG 114 115.705  12.973  -1.459
  908    HD2  ARG 114           HD2      ARG 114 114.510  14.052  -3.445
  909    HD3  ARG 114           HD1      ARG 114 113.512  12.602  -3.507
  910    HE   ARG 114           HE       ARG 114 112.438  13.312  -1.559
  911   HH11  ARG 114          HH21      ARG 114 115.299  15.140  -2.195
  912   HH12  ARG 114          HH22      ARG 114 114.966  16.345  -0.997
  913   HH21  ARG 114          HH11      ARG 114 111.984  14.891   0.017
  914   HH22  ARG 114          HH12      ARG 114 113.087  16.204   0.256
  915    H    GLU 115           HN       GLU 115 119.039  13.645  -2.269
  916    HA   GLU 115           HA       GLU 115 121.034  13.500  -4.340
  917    HB2  GLU 115           HB2      GLU 115 120.927  14.157  -1.498
  918    HB3  GLU 115           HB1      GLU 115 122.348  13.198  -1.903
  919    HG2  GLU 115           HG2      GLU 115 121.526  15.610  -3.526
  920    HG3  GLU 115           HG1      GLU 115 122.575  15.746  -2.116
  921    H    LEU 116           HN       LEU 116 122.556  11.923  -4.666
  922    HA   LEU 116           HA       LEU 116 121.730   9.203  -4.443
  923    HB2  LEU 116           HB2      LEU 116 124.427  10.396  -5.116
  924    HB3  LEU 116           HB1      LEU 116 123.967   8.715  -5.354
  925    HG   LEU 116           HG       LEU 116 123.720   9.862  -7.466
  926   HD11  LEU 116          HD11      LEU 116 121.560   9.191  -8.016
  927   HD12  LEU 116          HD12      LEU 116 120.880   9.758  -6.491
  928   HD13  LEU 116          HD13      LEU 116 121.844   8.280  -6.533
  929   HD21  LEU 116          HD21      LEU 116 122.669  11.918  -7.777
  930   HD22  LEU 116          HD22      LEU 116 123.399  12.144  -6.190
  931   HD23  LEU 116          HD23      LEU 116 121.684  11.756  -6.325
  932    H    ALA 117           HN       ALA 117 124.048  11.202  -2.660
  933    HA   ALA 117           HA       ALA 117 125.097   9.052  -1.147
  934    HB1  ALA 117           HB1      ALA 117 125.192  11.904  -0.179
  935    HB2  ALA 117           HB2      ALA 117 126.144  11.408  -1.579
  936    HB3  ALA 117           HB3      ALA 117 126.414  10.642  -0.014
  937    H    LEU 118           HN       LEU 118 122.206  10.866  -0.791
  938    HA   LEU 118           HA       LEU 118 121.801  10.825   1.948
  939    HB2  LEU 118           HB2      LEU 118 119.924  10.520  -0.381
  940    HB3  LEU 118           HB1      LEU 118 119.321  10.466   1.273
  941    HG   LEU 118           HG       LEU 118 121.046  12.713   0.210
  942   HD11  LEU 118          HD11      LEU 118 119.042  13.983  -0.183
  943   HD12  LEU 118          HD12      LEU 118 118.037  12.740   0.559
  944   HD13  LEU 118          HD13      LEU 118 118.816  12.433  -0.992
  945   HD21  LEU 118          HD21      LEU 118 121.145  12.901   2.524
  946   HD22  LEU 118          HD22      LEU 118 119.577  12.129   2.762
  947   HD23  LEU 118          HD23      LEU 118 119.663  13.803   2.219
  948    H    LEU 119           HN       LEU 119 121.634   8.145  -0.339
  949    HA   LEU 119           HA       LEU 119 120.250   6.289   1.274
  950    HB2  LEU 119           HB2      LEU 119 122.410   5.920  -0.813
  951    HB3  LEU 119           HB1      LEU 119 121.580   4.568  -0.046
  952    HG   LEU 119           HG       LEU 119 119.934   6.771  -1.251
  953   HD11  LEU 119          HD11      LEU 119 119.960   5.506  -3.415
  954   HD12  LEU 119          HD12      LEU 119 121.289   4.533  -2.784
  955   HD13  LEU 119          HD13      LEU 119 121.506   6.265  -3.034
  956   HD21  LEU 119          HD21      LEU 119 119.514   3.773  -1.270
  957   HD22  LEU 119          HD22      LEU 119 118.306   5.041  -1.476
  958   HD23  LEU 119          HD23      LEU 119 119.042   4.776   0.102
  959    H    VAL 120           HN       VAL 120 123.479   7.530   1.349
  960    HA   VAL 120           HA       VAL 120 124.900   5.647   2.872
  961    HB   VAL 120           HB       VAL 120 125.115   8.649   2.975
  962   HG11  VAL 120          HG11      VAL 120 126.347   7.444   4.746
  963   HG12  VAL 120          HG12      VAL 120 127.455   8.148   3.570
  964   HG13  VAL 120          HG13      VAL 120 127.101   6.422   3.524
  965   HG21  VAL 120          HG21      VAL 120 126.457   8.547   1.051
  966   HG22  VAL 120          HG22      VAL 120 125.191   7.382   0.663
  967   HG23  VAL 120          HG23      VAL 120 126.761   6.819   1.234
  968    H    SER 121           HN       SER 121 122.947   8.439   3.945
  969    HA   SER 121           HA       SER 121 123.471   8.010   6.714
  970    HB2  SER 121           HB2      SER 121 122.758  10.174   5.478
  971    HB3  SER 121           HB1      SER 121 121.118   9.567   5.689
  972    HG   SER 121           HG       SER 121 122.962  10.482   7.557
  973    H    ALA 122           HN       ALA 122 121.310   6.406   4.592
  974    HA   ALA 122           HA       ALA 122 119.540   5.718   6.847
  975    HB1  ALA 122           HB1      ALA 122 118.091   4.717   5.000
  976    HB2  ALA 122           HB2      ALA 122 119.185   5.501   3.858
  977    HB3  ALA 122           HB3      ALA 122 118.256   6.474   5.000
  978    H    HIS 123           HN       HIS 123 122.233   4.492   5.315
  979    HA   HIS 123           HA       HIS 123 122.032   1.992   6.647
  980    HB2  HIS 123           HB2      HIS 123 121.537   0.468   4.965
  981    HB3  HIS 123           HB1      HIS 123 120.453   1.797   4.563
  982    HD2  HIS 123           HD2      HIS 123 121.140   3.210   2.191
  983    HE1  HIS 123           HE1      HIS 123 124.367   0.721   1.106
  984    HE2  HIS 123           HE2      HIS 123 122.862   2.611   0.325
  985    H    ASP 124           HN       ASP 124 123.892   4.247   6.107
  986    HA   ASP 124           HA       ASP 124 125.940   4.139   4.513
  987    HB2  ASP 124           HB2      ASP 124 125.829   5.330   6.771
  988    HB3  ASP 124           HB1      ASP 124 126.559   3.880   7.454
  989    H    ASP 125           HN       ASP 125 125.984   2.048   3.476
  990    HA   ASP 125           HA       ASP 125 127.732   0.135   4.904
  991    HB2  ASP 125           HB2      ASP 125 125.196  -0.395   3.391
  992    HB3  ASP 125           HB1      ASP 125 126.456  -1.625   3.450
  993   H5'1  C2E 501          H5'1      C2E 501 104.563   0.697  11.358
  994   H5'2  C2E 501          H5'2      C2E 501 106.139   0.888  12.156
  995    H4'  C2E 501           H4'      C2E 501 106.884  -0.306  10.356
  996    H3'  C2E 501           H3'      C2E 501 106.670   2.526   9.366
  997    H2'  C2E 501           H2'      C2E 501 107.051   1.883   7.130
  998   HO2'  C2E 501          HO2'      C2E 501 107.464  -0.508   6.780
  999    H1'  C2E 501           H1'      C2E 501 105.346  -0.192   7.069
 1000    H8   C2E 501           H8       C2E 501 103.881   2.174   9.626
 1001    HN1  C2E 501           HN1      C2E 501 102.899   4.138   3.620
 1002   HN21  C2E 501          HN21      C2E 501 104.091   2.909   2.207
 1003   HN22  C2E 501          HN22      C2E 501 105.126   1.603   2.744
 1004   H511  C2E 501          H511      C2E 501 108.242   4.117   9.746
 1005   H512  C2E 501          H512      C2E 501 109.773   5.011   9.805
 1006    H4A  C2E 501           H4A      C2E 501 108.970   4.874  12.478
 1007    H3A  C2E 501           H3A      C2E 501 106.478   5.228  10.768
 1008    H2A  C2E 501           H2A      C2E 501 105.789   6.987  12.142
 1009   HO2A  C2E 501          HO2A      C2E 501 107.389   5.731  13.966
 1010    H1A  C2E 501           H1A      C2E 501 108.093   8.338  12.173
 1011    H81  C2E 501           H81      C2E 501 108.374   6.484   8.939
 1012   HN11  C2E 501          HN11      C2E 501 104.429  11.485   8.440
 1013   HN24  C2E 501          HN24      C2E 501 104.560  11.575  11.920
 1014   HN23  C2E 501          HN23      C2E 501 103.918  12.265  10.444
 1015   H5'1  C2E 502          H5'1      C2E 502 101.169  10.721   4.390
 1016   H5'2  C2E 502          H5'2      C2E 502 100.188  12.188   4.191
 1017    H4'  C2E 502           H4'      C2E 502  99.857  12.367   6.421
 1018    H3'  C2E 502           H3'      C2E 502 102.810  11.806   6.655
 1019    H2'  C2E 502           H2'      C2E 502 102.480  11.387   8.994
 1020   HO2'  C2E 502          HO2'      C2E 502  99.799  11.730   9.180
 1021    H1'  C2E 502           H1'      C2E 502 100.306   9.823   8.677
 1022    H8   C2E 502           H8       C2E 502 102.489   9.024   5.665
 1023    HN1  C2E 502           HN1      C2E 502 104.178   6.047  11.066
 1024   HN21  C2E 502          HN21      C2E 502 103.081   6.907  12.796
 1025   HN22  C2E 502          HN22      C2E 502 101.938   8.221  12.619
 1026   H511  C2E 502          H511      C2E 502 105.424  15.571   6.698
 1027   H512  C2E 502          H512      C2E 502 104.594  17.007   6.066
 1028    H4A  C2E 502           H4A      C2E 502 104.862  16.373   3.891
 1029    H3A  C2E 502           H3A      C2E 502 104.538  13.494   4.841
 1030    H2A  C2E 502           H2A      C2E 502 105.789  12.733   3.016
 1031   HO2A  C2E 502          HO2A      C2E 502 105.594  13.673   1.132
 1032    H1A  C2E 502           H1A      C2E 502 107.694  14.724   2.969
 1033    H81  C2E 502           H81      C2E 502 107.048  14.006   6.573
 1034   HN11  C2E 502          HN11      C2E 502 110.765   9.625   3.770
 1035   HN24  C2E 502          HN24      C2E 502 110.673   9.857   1.557
 1036   HN23  C2E 502          HN23      C2E 502 109.706  11.093   0.783
  Start of MODEL   20
    1    H    MET   1           H        MET   1 110.774  23.942  13.176
    2    HA   MET   1           HA       MET   1 110.112  21.753  13.812
    3    HB2  MET   1           HB2      MET   1 108.934  23.668  15.836
    4    HB3  MET   1           HB1      MET   1 109.762  22.141  16.143
    5    HG2  MET   1           HG2      MET   1 110.994  24.690  15.060
    6    HG3  MET   1           HG1      MET   1 111.308  23.945  16.627
    7    HE1  MET   1           HE1      MET   1 112.093  21.780  17.027
    8    HE2  MET   1           HE2      MET   1 113.268  20.882  16.070
    9    HE3  MET   1           HE3      MET   1 111.547  20.678  15.755
   10    H    SER   2           HN       SER   2 108.154  20.954  15.493
   11    HA   SER   2           HA       SER   2 105.949  20.314  15.678
   12    HB2  SER   2           HB2      SER   2 105.591  22.834  15.058
   13    HB3  SER   2           HB1      SER   2 105.129  22.193  13.485
   14    HG   SER   2           HG       SER   2 103.551  20.959  14.499
   15    H    ASP   3           HN       ASP   3 104.370  20.719  12.975
   16    HA   ASP   3           HA       ASP   3 105.357  18.191  11.821
   17    HB2  ASP   3           HB2      ASP   3 102.608  19.461  11.743
   18    HB3  ASP   3           HB1      ASP   3 103.063  18.175  10.624
   19    H    GLN   4           HN       GLN   4 107.031  19.764  11.081
   20    HA   GLN   4           HA       GLN   4 106.380  21.416   8.801
   21    HB2  GLN   4           HB2      GLN   4 108.738  21.903   8.713
   22    HB3  GLN   4           HB1      GLN   4 108.190  21.976  10.384
   23    HG2  GLN   4           HG2      GLN   4 109.629  19.648   9.080
   24    HG3  GLN   4           HG1      GLN   4 110.314  20.762  10.259
   25   HE21  GLN   4          HE21      GLN   4 108.648  20.924  12.324
   26   HE22  GLN   4          HE22      GLN   4 108.207  19.404  12.939
   27    H    HIS   5           HN       HIS   5 106.237  18.259   8.927
   28    HA   HIS   5           HA       HIS   5 106.175  16.688   7.241
   29    HB2  HIS   5           HB2      HIS   5 107.572  18.741   5.509
   30    HB3  HIS   5           HB1      HIS   5 106.812  17.253   4.968
   31    HD2  HIS   5           HD2      HIS   5 104.736  19.040   7.650
   32    HE1  HIS   5           HE1      HIS   5 103.019  20.071   3.937
   33    HE2  HIS   5           HE2      HIS   5 102.695  20.146   6.454
   34    H    ASP   6           HN       ASP   6 108.623  17.474   9.049
   35    HA   ASP   6           HA       ASP   6 110.991  16.767   7.813
   36    HB2  ASP   6           HB2      ASP   6 109.983  16.203  10.604
   37    HB3  ASP   6           HB1      ASP   6 111.604  15.739  10.090
   38    H    GLU   7           HN       GLU   7 111.914  14.820   7.139
   39    HA   GLU   7           HA       GLU   7 110.051  12.664   6.748
   40    HB2  GLU   7           HB2      GLU   7 111.483  11.869   5.146
   41    HB3  GLU   7           HB1      GLU   7 112.019  13.543   5.195
   42    HG2  GLU   7           HG2      GLU   7 114.017  12.282   5.321
   43    HG3  GLU   7           HG1      GLU   7 113.707  12.760   6.988
   44    H    ARG   8           HN       ARG   8 109.868  10.797   7.794
   45    HA   ARG   8           HA       ARG   8 111.824  10.208   9.938
   46    HB2  ARG   8           HB2      ARG   8 108.822  10.117   9.953
   47    HB3  ARG   8           HB1      ARG   8 109.760   9.092  11.029
   48    HG2  ARG   8           HG2      ARG   8 109.383  11.005  12.334
   49    HG3  ARG   8           HG1      ARG   8 111.002  11.272  11.697
   50    HD2  ARG   8           HD2      ARG   8 109.477  13.272  11.545
   51    HD3  ARG   8           HD1      ARG   8 110.173  12.773  10.016
   52    HE   ARG   8           HE       ARG   8 107.850  11.479   9.913
   53   HH11  ARG   8          HH21      ARG   8 108.617  14.683  10.980
   54   HH12  ARG   8          HH22      ARG   8 107.098  15.357  10.496
   55   HH21  ARG   8          HH11      ARG   8 105.863  12.367   9.261
   56   HH22  ARG   8          HH12      ARG   8 105.538  14.045   9.525
   57    H    ARG   9           HN       ARG   9 110.479   9.141   7.056
   58    HA   ARG   9           HA       ARG   9 110.963   6.299   7.754
   59    HB2  ARG   9           HB2      ARG   9 109.715   6.081   5.370
   60    HB3  ARG   9           HB1      ARG   9 108.854   6.102   6.901
   61    HG2  ARG   9           HG2      ARG   9 108.688   8.624   6.639
   62    HG3  ARG   9           HG1      ARG   9 109.273   8.399   4.993
   63    HD2  ARG   9           HD2      ARG   9 107.378   7.066   4.407
   64    HD3  ARG   9           HD1      ARG   9 106.875   6.921   6.085
   65    HE   ARG   9           HE       ARG   9 106.208   9.251   6.029
   66   HH11  ARG   9          HH21      ARG   9 107.122   7.851   2.986
   67   HH12  ARG   9          HH22      ARG   9 106.316   9.057   2.042
   68   HH21  ARG   9          HH11      ARG   9 105.155  10.822   4.786
   69   HH22  ARG   9          HH12      ARG   9 105.207  10.735   3.058
   70    H    ARG  10           HN       ARG  10 113.111   6.194   7.444
   71    HA   ARG  10           HA       ARG  10 115.156   6.691   6.319
   72    HB2  ARG  10           HB2      ARG  10 115.005   4.867   4.310
   73    HB3  ARG  10           HB1      ARG  10 115.276   4.449   5.997
   74    HG2  ARG  10           HG2      ARG  10 112.437   4.734   5.083
   75    HG3  ARG  10           HG1      ARG  10 113.327   3.304   4.571
   76    HD2  ARG  10           HD2      ARG  10 113.861   2.759   6.890
   77    HD3  ARG  10           HD1      ARG  10 113.071   4.230   7.445
   78    HE   ARG  10           HE       ARG  10 111.047   3.124   7.261
   79   HH11  ARG  10          HH21      ARG  10 113.463   1.573   5.328
   80   HH12  ARG  10          HH22      ARG  10 112.448   0.241   4.885
   81   HH21  ARG  10          HH11      ARG  10 109.712   1.380   6.682
   82   HH22  ARG  10          HH12      ARG  10 110.327   0.132   5.650
   83    H    PHE  11           HN       PHE  11 113.282   5.842   3.442
   84    HA   PHE  11           HA       PHE  11 113.699   8.552   2.371
   85    HB2  PHE  11           HB2      PHE  11 115.215   6.254   1.616
   86    HB3  PHE  11           HB1      PHE  11 114.154   6.654   0.267
   87    HD1  PHE  11           HD2      PHE  11 113.975   9.283  -0.224
   88    HD2  PHE  11           HD1      PHE  11 117.276   7.352   1.732
   89    HE1  PHE  11           HE2      PHE  11 115.447  11.180  -0.832
   90    HE2  PHE  11           HE1      PHE  11 118.749   9.256   1.119
   91    HZ   PHE  11           HZ       PHE  11 117.831  11.169  -0.161
   92    H    HIS  12           HN       HIS  12 112.380   8.970   0.439
   93    HA   HIS  12           HA       HIS  12 109.724   8.560   0.703
   94    HB2  HIS  12           HB2      HIS  12 109.440   9.290  -1.497
   95    HB3  HIS  12           HB1      HIS  12 111.039   9.909  -1.093
   96    HD2  HIS  12           HD2      HIS  12 113.221   8.338  -2.241
   97    HE1  HIS  12           HE1      HIS  12 110.743   6.414  -5.067
   98    HE2  HIS  12           HE2      HIS  12 113.150   6.868  -4.399
   99    H    ARG  13           HN       ARG  13 108.147   7.170  -0.210
  100    HA   ARG  13           HA       ARG  13 109.132   4.412  -0.635
  101    HB2  ARG  13           HB2      ARG  13 106.263   4.949  -0.014
  102    HB3  ARG  13           HB1      ARG  13 107.302   3.624   0.510
  103    HG2  ARG  13           HG2      ARG  13 108.502   5.183   2.027
  104    HG3  ARG  13           HG1      ARG  13 107.416   6.480   1.529
  105    HD2  ARG  13           HD2      ARG  13 105.941   4.104   2.360
  106    HD3  ARG  13           HD1      ARG  13 106.991   4.701   3.640
  107    HE   ARG  13           HE       ARG  13 105.350   6.707   2.296
  108   HH11  ARG  13          HH21      ARG  13 105.773   4.515   4.948
  109   HH12  ARG  13          HH22      ARG  13 104.664   5.346   5.986
  110   HH21  ARG  13          HH11      ARG  13 103.895   7.793   3.655
  111   HH22  ARG  13          HH12      ARG  13 103.602   7.199   5.255
  112    H    ILE  14           HN       ILE  14 108.242   3.160  -2.318
  113    HA   ILE  14           HA       ILE  14 107.786   4.445  -4.747
  114    HB   ILE  14           HB       ILE  14 107.115   1.674  -3.792
  115   HG12  ILE  14          HG12      ILE  14 108.963   1.111  -5.393
  116   HG13  ILE  14          HG11      ILE  14 109.187   2.836  -5.679
  117   HG21  ILE  14          HG21      ILE  14 105.501   1.949  -5.486
  118   HG22  ILE  14          HG22      ILE  14 106.870   1.251  -6.347
  119   HG23  ILE  14          HG23      ILE  14 106.557   2.983  -6.449
  120   HD11  ILE  14          HD11      ILE  14 110.679   1.650  -3.888
  121   HD12  ILE  14          HD12      ILE  14 109.245   1.759  -2.869
  122   HD13  ILE  14          HD13      ILE  14 109.984   3.226  -3.509
  123    H    ALA  15           HN       ALA  15 106.257   6.022  -4.704
  124    HA   ALA  15           HA       ALA  15 103.538   5.353  -3.831
  125    HB1  ALA  15           HB1      ALA  15 104.783   7.961  -4.711
  126    HB2  ALA  15           HB2      ALA  15 104.421   7.474  -3.055
  127    HB3  ALA  15           HB3      ALA  15 103.108   7.768  -4.197
  128    H    PHE  16           HN       PHE  16 102.125   4.635  -5.192
  129    HA   PHE  16           HA       PHE  16 101.903   5.741  -7.864
  130    HB2  PHE  16           HB2      PHE  16 102.033   3.684  -9.048
  131    HB3  PHE  16           HB1      PHE  16 103.460   3.735  -8.021
  132    HD1  PHE  16           HD2      PHE  16 102.561   2.904  -5.398
  133    HD2  PHE  16           HD1      PHE  16 101.306   1.489  -9.256
  134    HE1  PHE  16           HE2      PHE  16 101.914   0.735  -4.395
  135    HE2  PHE  16           HE1      PHE  16 100.673  -0.681  -8.248
  136    HZ   PHE  16           HZ       PHE  16 100.976  -1.063  -5.826
  137    H    ASP  17           HN       ASP  17  99.761   5.343  -8.766
  138    HA   ASP  17           HA       ASP  17  97.833   4.885  -6.616
  139    HB2  ASP  17           HB2      ASP  17  97.598   6.929  -7.931
  140    HB3  ASP  17           HB1      ASP  17  97.464   5.980  -9.410
  141    H    ALA  18           HN       ALA  18  96.081   3.468  -6.802
  142    HA   ALA  18           HA       ALA  18  95.453   1.851  -8.979
  143    HB1  ALA  18           HB1      ALA  18  97.532   0.722  -8.869
  144    HB2  ALA  18           HB2      ALA  18  96.409  -0.343  -8.024
  145    HB3  ALA  18           HB3      ALA  18  97.511   0.684  -7.107
  146    H    ASP  19           HN       ASP  19  94.341  -0.292  -8.096
  147    HA   ASP  19           HA       ASP  19  92.535   0.641  -5.953
  148    HB2  ASP  19           HB2      ASP  19  91.724  -0.222  -8.239
  149    HB3  ASP  19           HB1      ASP  19  92.163  -1.825  -7.651
  150    H    SER  20           HN       SER  20  92.396  -0.311  -4.008
  151    HA   SER  20           HA       SER  20  93.760  -2.895  -3.583
  152    HB2  SER  20           HB2      SER  20  94.505  -1.892  -1.338
  153    HB3  SER  20           HB1      SER  20  95.386  -1.400  -2.783
  154    HG   SER  20           HG       SER  20  94.556   0.553  -2.632
  155    H    GLU  21           HN       GLU  21  93.015  -3.998  -1.636
  156    HA   GLU  21           HA       GLU  21  90.597  -2.961  -0.352
  157    HB2  GLU  21           HB2      GLU  21  89.330  -5.039  -0.761
  158    HB3  GLU  21           HB1      GLU  21  89.684  -4.191  -2.265
  159    HG2  GLU  21           HG2      GLU  21  90.359  -6.282  -2.912
  160    HG3  GLU  21           HG1      GLU  21  91.864  -5.762  -2.156
  161    H    ILE  22           HN       ILE  22  90.250  -3.835   1.689
  162    HA   ILE  22           HA       ILE  22  92.447  -5.587   2.638
  163    HB   ILE  22           HB       ILE  22  91.052  -3.305   4.038
  164   HG12  ILE  22          HG12      ILE  22  93.217  -3.292   2.259
  165   HG13  ILE  22          HG11      ILE  22  92.783  -2.005   3.377
  166   HG21  ILE  22          HG21      ILE  22  93.131  -5.276   5.032
  167   HG22  ILE  22          HG22      ILE  22  91.496  -5.056   5.649
  168   HG23  ILE  22          HG23      ILE  22  92.700  -3.790   5.877
  169   HD11  ILE  22          HD11      ILE  22  94.629  -4.317   4.056
  170   HD12  ILE  22          HD12      ILE  22  94.262  -2.932   5.086
  171   HD13  ILE  22          HD13      ILE  22  95.166  -2.703   3.592
  172    H    LEU  23           HN       LEU  23  91.988  -7.315   3.820
  173    HA   LEU  23           HA       LEU  23  89.159  -7.802   4.572
  174    HB2  LEU  23           HB2      LEU  23  91.021 -10.070   4.015
  175    HB3  LEU  23           HB1      LEU  23  89.277  -9.955   3.777
  176    HG   LEU  23           HG       LEU  23  90.019  -8.082   2.024
  177   HD11  LEU  23          HD11      LEU  23  92.483  -8.706   2.773
  178   HD12  LEU  23          HD12      LEU  23  92.128  -8.344   1.086
  179   HD13  LEU  23          HD13      LEU  23  92.274 -10.019   1.618
  180   HD21  LEU  23          HD21      LEU  23  88.709 -10.163   1.560
  181   HD22  LEU  23          HD22      LEU  23  90.226 -11.053   1.432
  182   HD23  LEU  23          HD23      LEU  23  89.848  -9.781   0.269
  183    H    GLN  24           HN       GLN  24  88.847  -8.001   6.625
  184    HA   GLN  24           HA       GLN  24  90.998  -9.132   8.340
  185    HB2  GLN  24           HB2      GLN  24  91.041  -6.790   8.814
  186    HB3  GLN  24           HB1      GLN  24  89.281  -6.702   8.883
  187    HG2  GLN  24           HG2      GLN  24  89.183  -7.878  10.929
  188    HG3  GLN  24           HG1      GLN  24  90.823  -8.499  10.752
  189   HE21  GLN  24          HE21      GLN  24  88.926  -5.863  11.994
  190   HE22  GLN  24          HE22      GLN  24  90.227  -4.913  12.530
  191    H    GLY  25           HN       GLY  25  90.112 -11.140   8.699
  192    HA2  GLY  25           HA2      GLY  25  88.765 -12.621   9.873
  193    HA3  GLY  25           HA1      GLY  25  87.735 -11.271  10.347
  194    H    GLU  26           HN       GLU  26  85.728 -11.595   9.620
  195    HA   GLU  26           HA       GLU  26  85.315 -12.923   7.017
  196    HB2  GLU  26           HB2      GLU  26  82.946 -13.083   7.789
  197    HB3  GLU  26           HB1      GLU  26  84.086 -13.922   8.839
  198    HG2  GLU  26           HG2      GLU  26  83.708 -11.110   9.602
  199    HG3  GLU  26           HG1      GLU  26  82.213 -12.039   9.666
  200    H    ARG  27           HN       ARG  27  85.938  -9.929   7.893
  201    HA   ARG  27           HA       ARG  27  83.753  -8.671   6.345
  202    HB2  ARG  27           HB2      ARG  27  85.626  -7.536   8.403
  203    HB3  ARG  27           HB1      ARG  27  84.486  -6.592   7.446
  204    HG2  ARG  27           HG2      ARG  27  82.772  -7.165   8.799
  205    HG3  ARG  27           HG1      ARG  27  83.135  -8.880   8.600
  206    HD2  ARG  27           HD2      ARG  27  84.800  -8.785  10.346
  207    HD3  ARG  27           HD1      ARG  27  84.627  -7.037  10.472
  208    HE   ARG  27           HE       ARG  27  82.110  -8.247  10.919
  209   HH11  ARG  27          HH21      ARG  27  85.250  -7.907  12.333
  210   HH12  ARG  27          HH22      ARG  27  84.683  -8.056  13.963
  211   HH21  ARG  27          HH11      ARG  27  81.362  -8.442  13.055
  212   HH22  ARG  27          HH12      ARG  27  82.484  -8.359  14.371
  213    H    ARG  28           HN       ARG  28  84.205  -7.654   4.496
  214    HA   ARG  28           HA       ARG  28  87.028  -7.040   3.820
  215    HB2  ARG  28           HB2      ARG  28  86.264  -9.056   2.592
  216    HB3  ARG  28           HB1      ARG  28  84.907  -8.134   1.946
  217    HG2  ARG  28           HG2      ARG  28  86.496  -6.560   0.877
  218    HG3  ARG  28           HG1      ARG  28  87.844  -7.514   1.497
  219    HD2  ARG  28           HD2      ARG  28  86.891  -9.502   0.273
  220    HD3  ARG  28           HD1      ARG  28  85.718  -8.415  -0.463
  221    HE   ARG  28           HE       ARG  28  88.328  -7.395  -0.889
  222   HH11  ARG  28          HH21      ARG  28  86.220  -9.990  -1.792
  223   HH12  ARG  28          HH22      ARG  28  86.937 -10.212  -3.353
  224   HH21  ARG  28          HH11      ARG  28  89.270  -7.683  -2.935
  225   HH22  ARG  28          HH12      ARG  28  88.662  -8.906  -4.001
  226    H    TRP  29           HN       TRP  29  87.379  -5.238   2.567
  227    HA   TRP  29           HA       TRP  29  85.114  -3.511   1.903
  228    HB2  TRP  29           HB2      TRP  29  87.431  -2.681   3.654
  229    HB3  TRP  29           HB1      TRP  29  86.135  -1.623   3.094
  230    HD1  TRP  29           HD1      TRP  29  83.571  -2.536   3.888
  231    HE1  TRP  29           HE1      TRP  29  82.901  -3.398   6.229
  232    HE3  TRP  29           HE3      TRP  29  88.163  -3.812   5.696
  233    HZ2  TRP  29           HZ2      TRP  29  84.163  -4.487   8.560
  234    HZ3  TRP  29           HZ3      TRP  29  88.410  -4.751   7.976
  235    HH2  TRP  29           HH2      TRP  29  86.415  -5.097   9.410
  236    H    GLU  30           HN       GLU  30  85.697  -1.809   0.446
  237    HA   GLU  30           HA       GLU  30  88.101  -2.459  -1.111
  238    HB2  GLU  30           HB2      GLU  30  86.015  -0.527  -2.063
  239    HB3  GLU  30           HB1      GLU  30  87.026  -1.640  -2.988
  240    HG2  GLU  30           HG2      GLU  30  84.865  -2.617  -3.034
  241    HG3  GLU  30           HG1      GLU  30  85.740  -3.527  -1.805
  242    H    VAL  31           HN       VAL  31  89.742  -0.917  -1.381
  243    HA   VAL  31           HA       VAL  31  89.291   1.844  -0.479
  244    HB   VAL  31           HB       VAL  31  91.386   1.753   0.883
  245   HG11  VAL  31          HG11      VAL  31  89.181  -0.126   1.780
  246   HG12  VAL  31          HG12      VAL  31  89.132   1.633   1.911
  247   HG13  VAL  31          HG13      VAL  31  90.326   0.711   2.827
  248   HG21  VAL  31          HG21      VAL  31  91.983  -0.543  -0.324
  249   HG22  VAL  31          HG22      VAL  31  91.076  -1.226   1.025
  250   HG23  VAL  31          HG23      VAL  31  92.500  -0.235   1.332
  251    H    LEU  32           HN       LEU  32  90.952   3.299  -1.122
  252    HA   LEU  32           HA       LEU  32  92.323   2.420  -3.576
  253    HB2  LEU  32           HB2      LEU  32  92.611   4.815  -4.044
  254    HB3  LEU  32           HB1      LEU  32  90.916   4.444  -3.754
  255    HG   LEU  32           HG       LEU  32  92.798   5.554  -1.647
  256   HD11  LEU  32          HD11      LEU  32  92.551   7.269  -3.276
  257   HD12  LEU  32          HD12      LEU  32  91.376   7.646  -2.016
  258   HD13  LEU  32          HD13      LEU  32  90.845   6.893  -3.519
  259   HD21  LEU  32          HD21      LEU  32  89.965   4.651  -1.683
  260   HD22  LEU  32          HD22      LEU  32  90.267   6.182  -0.863
  261   HD23  LEU  32          HD23      LEU  32  91.107   4.725  -0.341
  262    H    LEU  33           HN       LEU  33  94.486   2.176  -3.617
  263    HA   LEU  33           HA       LEU  33  95.927   2.667  -1.120
  264    HB2  LEU  33           HB2      LEU  33  96.314   0.499  -2.011
  265    HB3  LEU  33           HB1      LEU  33  96.590   1.121  -3.634
  266    HG   LEU  33           HG       LEU  33  98.421   2.240  -1.588
  267   HD11  LEU  33          HD11      LEU  33  98.261  -0.716  -2.146
  268   HD12  LEU  33          HD12      LEU  33  98.475   0.107  -0.602
  269   HD13  LEU  33          HD13      LEU  33  99.800   0.046  -1.760
  270   HD21  LEU  33          HD21      LEU  33 100.063   1.795  -3.358
  271   HD22  LEU  33          HD22      LEU  33  98.644   2.582  -4.047
  272   HD23  LEU  33          HD23      LEU  33  98.873   0.846  -4.250
  273    H    HIS  34           HN       HIS  34  97.179   4.323  -0.815
  274    HA   HIS  34           HA       HIS  34  97.716   6.142  -3.040
  275    HB2  HIS  34           HB2      HIS  34  97.848   6.352  -0.034
  276    HB3  HIS  34           HB1      HIS  34  98.520   7.614  -1.076
  277    HD2  HIS  34           HD2      HIS  34  95.002   6.131  -0.101
  278    HE1  HIS  34           HE1      HIS  34  94.362   9.578  -2.450
  279    HE2  HIS  34           HE2      HIS  34  93.230   7.808  -1.027
  280    H    ASP  35           HN       ASP  35  99.520   3.951  -0.964
  281    HA   ASP  35           HA       ASP  35 101.648   4.007  -2.783
  282    HB2  ASP  35           HB2      ASP  35 103.407   5.192  -1.607
  283    HB3  ASP  35           HB1      ASP  35 102.009   6.267  -1.692
  284    H    VAL  36           HN       VAL  36 103.572   2.766  -2.072
  285    HA   VAL  36           HA       VAL  36 103.125   1.032   0.250
  286    HB   VAL  36           HB       VAL  36 102.014   0.036  -1.832
  287   HG11  VAL  36          HG11      VAL  36 103.951   0.816  -3.311
  288   HG12  VAL  36          HG12      VAL  36 103.399  -0.841  -3.562
  289   HG13  VAL  36          HG13      VAL  36 104.870  -0.532  -2.640
  290   HG21  VAL  36          HG21      VAL  36 102.698  -2.181  -1.278
  291   HG22  VAL  36          HG22      VAL  36 102.854  -1.254   0.210
  292   HG23  VAL  36          HG23      VAL  36 104.285  -1.636  -0.744
  293    H    SER  37           HN       SER  37 104.963  -0.485   0.549
  294    HA   SER  37           HA       SER  37 107.522   0.456  -0.517
  295    HB2  SER  37           HB2      SER  37 106.937   1.607   1.729
  296    HB3  SER  37           HB1      SER  37 107.150   0.014   2.449
  297    HG   SER  37           HG       SER  37 109.018   1.710   1.993
  298    H    LEU  38           HN       LEU  38 109.280  -1.191   0.272
  299    HA   LEU  38           HA       LEU  38 108.321  -3.741  -0.472
  300    HB2  LEU  38           HB2      LEU  38 110.835  -2.555  -0.277
  301    HB3  LEU  38           HB1      LEU  38 110.890  -3.807   0.959
  302    HG   LEU  38           HG       LEU  38 109.900  -5.358  -0.894
  303   HD11  LEU  38          HD11      LEU  38 110.695  -4.635  -3.177
  304   HD12  LEU  38          HD12      LEU  38 111.004  -3.038  -2.504
  305   HD13  LEU  38          HD13      LEU  38 109.361  -3.676  -2.544
  306   HD21  LEU  38          HD21      LEU  38 112.183  -5.554   0.032
  307   HD22  LEU  38          HD22      LEU  38 112.742  -4.304  -1.079
  308   HD23  LEU  38          HD23      LEU  38 112.183  -5.854  -1.706
  309    H    HIS  39           HN       HIS  39 107.812  -2.190   2.354
  310    HA   HIS  39           HA       HIS  39 107.006  -4.617   3.674
  311    HB2  HIS  39           HB2      HIS  39 109.588  -4.143   4.108
  312    HB3  HIS  39           HB1      HIS  39 108.939  -3.036   5.315
  313    HD2  HIS  39           HD2      HIS  39 107.449  -4.324   7.426
  314    HE1  HIS  39           HE1      HIS  39 108.658  -8.236   6.389
  315    HE2  HIS  39           HE2      HIS  39 107.520  -6.827   8.170
  316    H    GLY  40           HN       GLY  40 105.621  -2.296   2.811
  317    HA2  GLY  40           HA2      GLY  40 104.139  -1.676   5.154
  318    HA3  GLY  40           HA1      GLY  40 105.193  -0.327   4.743
  319    H    ILE  41           HN       ILE  41 102.289  -0.315   4.709
  320    HA   ILE  41           HA       ILE  41 101.892   0.570   1.940
  321    HB   ILE  41           HB       ILE  41 100.871  -1.370   1.400
  322   HG12  ILE  41          HG12      ILE  41  98.735  -0.510   3.378
  323   HG13  ILE  41          HG11      ILE  41  98.944   0.226   1.788
  324   HG21  ILE  41          HG21      ILE  41 100.094  -3.009   3.125
  325   HG22  ILE  41          HG22      ILE  41 100.602  -1.870   4.373
  326   HG23  ILE  41          HG23      ILE  41 101.794  -2.571   3.280
  327   HD11  ILE  41          HD11      ILE  41  98.533  -2.745   2.201
  328   HD12  ILE  41          HD12      ILE  41  98.490  -1.860   0.677
  329   HD13  ILE  41          HD13      ILE  41  97.217  -1.619   1.873
  330    H    LEU  42           HN       LEU  42 100.284   2.040   1.643
  331    HA   LEU  42           HA       LEU  42  99.010   3.141   4.084
  332    HB2  LEU  42           HB2      LEU  42 100.914   4.419   2.525
  333    HB3  LEU  42           HB1      LEU  42  99.404   5.012   1.841
  334    HG   LEU  42           HG       LEU  42  99.886   5.007   4.819
  335   HD11  LEU  42          HD11      LEU  42 100.547   7.395   4.559
  336   HD12  LEU  42          HD12      LEU  42 100.561   7.171   2.810
  337   HD13  LEU  42          HD13      LEU  42 101.707   6.292   3.820
  338   HD21  LEU  42          HD21      LEU  42  97.569   5.300   4.023
  339   HD22  LEU  42          HD22      LEU  42  98.094   6.625   2.983
  340   HD23  LEU  42          HD23      LEU  42  98.178   6.794   4.738
  341    H    VAL  43           HN       VAL  43  96.818   3.521   3.912
  342    HA   VAL  43           HA       VAL  43  95.604   3.362   1.234
  343    HB   VAL  43           HB       VAL  43  93.942   1.740   1.982
  344   HG11  VAL  43          HG11      VAL  43  96.696   0.714   2.705
  345   HG12  VAL  43          HG12      VAL  43  96.202   1.031   1.042
  346   HG13  VAL  43          HG13      VAL  43  95.360  -0.192   1.995
  347   HG21  VAL  43          HG21      VAL  43  94.320   0.603   4.198
  348   HG22  VAL  43          HG22      VAL  43  93.828   2.290   4.343
  349   HG23  VAL  43          HG23      VAL  43  95.518   1.842   4.571
  350    H    GLY  44           HN       GLY  44  93.144   3.671   1.456
  351    HA2  GLY  44           HA2      GLY  44  92.713   6.107   3.090
  352    HA3  GLY  44           HA1      GLY  44  91.740   5.613   1.705
  353    H    GLN  45           HN       GLN  45  90.949   6.230   4.625
  354    HA   GLN  45           HA       GLN  45  90.130   3.667   5.650
  355    HB2  GLN  45           HB2      GLN  45  90.887   5.485   7.118
  356    HB3  GLN  45           HB1      GLN  45  89.522   6.468   6.596
  357    HG2  GLN  45           HG2      GLN  45  88.515   3.903   7.415
  358    HG3  GLN  45           HG1      GLN  45  89.580   4.505   8.680
  359   HE21  GLN  45          HE21      GLN  45  86.560   4.308   8.648
  360   HE22  GLN  45          HE22      GLN  45  86.017   5.884   8.968
  361    HA   PRO  46           HA       PRO  46  86.183   4.396   3.548
  362    HB2  PRO  46           HB2      PRO  46  85.272   1.838   3.440
  363    HB3  PRO  46           HB1      PRO  46  86.598   2.394   2.396
  364    HG2  PRO  46           HG2      PRO  46  86.711   0.785   4.901
  365    HG3  PRO  46           HG1      PRO  46  87.687   0.649   3.430
  366    HD2  PRO  46           HD2      PRO  46  88.493   1.961   5.785
  367    HD3  PRO  46           HD1      PRO  46  89.231   2.176   4.185
  368    H    GLN  47           HN       GLN  47  83.872   4.151   4.144
  369    HA   GLN  47           HA       GLN  47  83.407   4.648   6.890
  370    HB2  GLN  47           HB2      GLN  47  81.009   4.596   6.253
  371    HB3  GLN  47           HB1      GLN  47  81.983   5.609   5.188
  372    HG2  GLN  47           HG2      GLN  47  82.115   3.056   4.029
  373    HG3  GLN  47           HG1      GLN  47  80.439   3.213   4.548
  374   HE21  GLN  47          HE21      GLN  47  82.917   4.581   2.416
  375   HE22  GLN  47          HE22      GLN  47  81.850   5.532   1.502
  376    H    ASP  48           HN       ASP  48  82.852   1.747   4.907
  377    HA   ASP  48           HA       ASP  48  81.485   0.314   6.971
  378    HB2  ASP  48           HB2      ASP  48  82.714  -0.460   4.339
  379    HB3  ASP  48           HB1      ASP  48  82.062  -1.678   5.434
  380    H    TRP  49           HN       TRP  49  84.505   1.349   7.108
  381    HA   TRP  49           HA       TRP  49  86.129  -0.890   7.604
  382    HB2  TRP  49           HB2      TRP  49  86.901   1.476   7.344
  383    HB3  TRP  49           HB1      TRP  49  86.310   1.792   8.973
  384    HD1  TRP  49           HD1      TRP  49  87.633   0.823  10.963
  385    HE1  TRP  49           HE1      TRP  49  90.034  -0.201  11.181
  386    HE3  TRP  49           HE3      TRP  49  88.517  -0.157   6.094
  387    HZ2  TRP  49           HZ2      TRP  49  92.074  -1.322   9.358
  388    HZ3  TRP  49           HZ3      TRP  49  90.627  -1.202   5.339
  389    HH2  TRP  49           HH2      TRP  49  92.376  -1.792   6.977
  390    H    ASN  50           HN       ASN  50  84.283  -2.131   8.772
  391    HA   ASN  50           HA       ASN  50  84.163  -1.427  11.620
  392    HB2  ASN  50           HB2      ASN  50  82.043  -2.071  10.540
  393    HB3  ASN  50           HB1      ASN  50  82.738  -3.627  10.093
  394   HD21  ASN  50          HD21      ASN  50  83.681  -4.887  12.108
  395   HD22  ASN  50          HD22      ASN  50  82.732  -4.833  13.515
  396    H    GLY  51           HN       GLY  51  86.448  -1.856  11.918
  397    HA2  GLY  51           HA2      GLY  51  86.940  -4.710  12.461
  398    HA3  GLY  51           HA1      GLY  51  88.108  -3.811  11.500
  399    H    ASP  52           HN       ASP  52  88.704  -5.075  13.940
  400    HA   ASP  52           HA       ASP  52  88.908  -2.943  15.943
  401    HB2  ASP  52           HB2      ASP  52  88.223  -5.244  16.612
  402    HB3  ASP  52           HB1      ASP  52  89.810  -5.822  16.107
  403    HA   PRO  53           HA       PRO  53  92.874  -1.820  14.077
  404    HB2  PRO  53           HB2      PRO  53  93.066  -0.508  16.770
  405    HB3  PRO  53           HB1      PRO  53  93.443   0.158  15.173
  406    HG2  PRO  53           HG2      PRO  53  91.194   0.796  16.422
  407    HG3  PRO  53           HG1      PRO  53  91.233   0.558  14.666
  408    HD2  PRO  53           HD2      PRO  53  90.089  -1.211  16.777
  409    HD3  PRO  53           HD1      PRO  53  89.598  -1.009  15.080
  410    H    GLN  54           HN       GLN  54  92.281  -3.394  17.112
  411    HA   GLN  54           HA       GLN  54  95.050  -3.926  17.669
  412    HB2  GLN  54           HB2      GLN  54  92.607  -5.234  18.877
  413    HB3  GLN  54           HB1      GLN  54  94.238  -5.212  19.549
  414    HG2  GLN  54           HG2      GLN  54  94.143  -2.783  19.790
  415    HG3  GLN  54           HG1      GLN  54  92.555  -2.746  19.024
  416   HE21  GLN  54          HE21      GLN  54  92.218  -5.494  20.651
  417   HE22  GLN  54          HE22      GLN  54  91.696  -4.927  22.164
  418    H    ARG  55           HN       ARG  55  92.542  -5.508  15.849
  419    HA   ARG  55           HA       ARG  55  94.058  -8.018  15.788
  420    HB2  ARG  55           HB2      ARG  55  91.301  -7.193  14.937
  421    HB3  ARG  55           HB1      ARG  55  92.032  -8.616  14.199
  422    HG2  ARG  55           HG2      ARG  55  90.683  -9.190  16.210
  423    HG3  ARG  55           HG1      ARG  55  92.382  -9.619  16.403
  424    HD2  ARG  55           HD2      ARG  55  91.508  -6.904  17.308
  425    HD3  ARG  55           HD1      ARG  55  91.075  -8.290  18.304
  426    HE   ARG  55           HE       ARG  55  93.872  -8.180  17.524
  427   HH11  ARG  55          HH21      ARG  55  91.427  -7.331  19.819
  428   HH12  ARG  55          HH22      ARG  55  92.535  -7.146  21.137
  429   HH21  ARG  55          HH11      ARG  55  95.329  -7.944  19.248
  430   HH22  ARG  55          HH12      ARG  55  94.743  -7.494  20.814
  431    HA   PRO  56           HA       PRO  56  96.157  -7.146  12.079
  432    HB2  PRO  56           HB2      PRO  56  96.210  -9.633  10.880
  433    HB3  PRO  56           HB1      PRO  56  97.247  -9.159  12.239
  434    HG2  PRO  56           HG2      PRO  56  94.721 -10.740  12.249
  435    HG3  PRO  56           HG1      PRO  56  96.205 -10.975  13.189
  436    HD2  PRO  56           HD2      PRO  56  93.985  -9.826  14.262
  437    HD3  PRO  56           HD1      PRO  56  95.627  -9.368  14.764
  438    H    PHE  57           HN       PHE  57  96.046  -7.064   9.777
  439    HA   PHE  57           HA       PHE  57  93.341  -7.408   8.617
  440    HB2  PHE  57           HB2      PHE  57  95.204  -5.051   8.209
  441    HB3  PHE  57           HB1      PHE  57  93.643  -5.285   7.428
  442    HD1  PHE  57           HD2      PHE  57  95.281  -4.877  10.759
  443    HD2  PHE  57           HD1      PHE  57  91.632  -4.631   8.509
  444    HE1  PHE  57           HE2      PHE  57  94.155  -3.801  12.691
  445    HE2  PHE  57           HE1      PHE  57  90.509  -3.561  10.436
  446    HZ   PHE  57           HZ       PHE  57  91.767  -3.147  12.529
  447    H    GLU  58           HN       GLU  58  93.439  -7.702   6.223
  448    HA   GLU  58           HA       GLU  58  96.138  -8.443   5.280
  449    HB2  GLU  58           HB2      GLU  58  93.509  -9.866   4.834
  450    HB3  GLU  58           HB1      GLU  58  94.894 -10.123   3.771
  451    HG2  GLU  58           HG2      GLU  58  96.251 -10.897   5.610
  452    HG3  GLU  58           HG1      GLU  58  95.013 -10.445   6.780
  453    H    ALA  59           HN       ALA  59  96.732  -7.617   3.254
  454    HA   ALA  59           HA       ALA  59  94.692  -5.922   1.929
  455    HB1  ALA  59           HB1      ALA  59  96.203  -4.313   2.367
  456    HB2  ALA  59           HB2      ALA  59  97.151  -5.031   1.071
  457    HB3  ALA  59           HB3      ALA  59  97.470  -5.479   2.745
  458    H    ARG  60           HN       ARG  60  94.297  -6.195  -0.159
  459    HA   ARG  60           HA       ARG  60  96.072  -7.978  -1.726
  460    HB2  ARG  60           HB2      ARG  60  93.067  -7.675  -2.006
  461    HB3  ARG  60           HB1      ARG  60  94.100  -8.748  -2.945
  462    HG2  ARG  60           HG2      ARG  60  94.192  -8.996   0.038
  463    HG3  ARG  60           HG1      ARG  60  92.766  -9.618  -0.791
  464    HD2  ARG  60           HD2      ARG  60  94.198 -10.990  -2.247
  465    HD3  ARG  60           HD1      ARG  60  95.629 -10.358  -1.443
  466    HE   ARG  60           HE       ARG  60  93.936 -12.450  -0.479
  467   HH11  ARG  60          HH21      ARG  60  95.858  -9.731   0.466
  468   HH12  ARG  60          HH22      ARG  60  96.228 -10.364   2.034
  469   HH21  ARG  60          HH11      ARG  60  94.417 -13.285   1.578
  470   HH22  ARG  60          HH12      ARG  60  95.413 -12.375   2.664
  471    H    LEU  61           HN       LEU  61  96.938  -6.941  -3.468
  472    HA   LEU  61           HA       LEU  61  95.696  -4.379  -4.270
  473    HB2  LEU  61           HB2      LEU  61  98.549  -5.359  -4.294
  474    HB3  LEU  61           HB1      LEU  61  98.036  -3.965  -5.242
  475    HG   LEU  61           HG       LEU  61  97.129  -2.937  -3.142
  476   HD11  LEU  61          HD11      LEU  61  96.760  -4.524  -1.524
  477   HD12  LEU  61          HD12      LEU  61  98.412  -4.113  -1.070
  478   HD13  LEU  61          HD13      LEU  61  98.099  -5.540  -2.058
  479   HD21  LEU  61          HD21      LEU  61  99.249  -2.127  -3.810
  480   HD22  LEU  61          HD22      LEU  61 100.051  -3.647  -3.416
  481   HD23  LEU  61          HD23      LEU  61  99.491  -2.589  -2.125
  482    H    TYR  62           HN       TYR  62  95.570  -3.842  -6.461
  483    HA   TYR  62           HA       TYR  62  95.955  -6.066  -8.367
  484    HB2  TYR  62           HB2      TYR  62  93.603  -4.185  -8.517
  485    HB3  TYR  62           HB1      TYR  62  93.839  -5.716  -9.359
  486    HD1  TYR  62           HD2      TYR  62  93.629  -7.865  -8.161
  487    HD2  TYR  62           HD1      TYR  62  92.886  -4.112  -6.208
  488    HE1  TYR  62           HE2      TYR  62  92.508  -9.056  -6.296
  489    HE2  TYR  62           HE1      TYR  62  91.764  -5.302  -4.348
  490    HH   TYR  62           HH       TYR  62  90.917  -8.633  -4.542
  491    H    LEU  63           HN       LEU  63  97.548  -5.371  -9.620
  492    HA   LEU  63           HA       LEU  63  97.614  -2.558 -10.499
  493    HB2  LEU  63           HB2      LEU  63  99.623  -3.681  -9.361
  494    HB3  LEU  63           HB1      LEU  63  99.810  -4.596 -10.850
  495    HG   LEU  63           HG       LEU  63 101.221  -2.515 -10.727
  496   HD11  LEU  63          HD11      LEU  63 100.966  -2.014 -13.002
  497   HD12  LEU  63          HD12      LEU  63  99.216  -2.206 -12.954
  498   HD13  LEU  63          HD13      LEU  63 100.261  -3.624 -12.882
  499   HD21  LEU  63          HD21      LEU  63 100.330  -0.400 -10.557
  500   HD22  LEU  63          HD22      LEU  63  99.099  -1.272  -9.648
  501   HD23  LEU  63          HD23      LEU  63  98.815  -0.849 -11.337
  502    H    GLY  64           HN       GLY  64  99.013  -5.372 -12.102
  503    HA2  GLY  64           HA2      GLY  64  97.872  -4.594 -14.640
  504    HA3  GLY  64           HA1      GLY  64  98.870  -6.018 -14.332
  505    H    LEU  65           HN       LEU  65  96.789  -6.560 -15.935
  506    HA   LEU  65           HA       LEU  65  94.407  -7.125 -14.477
  507    HB2  LEU  65           HB2      LEU  65  95.157  -8.471 -17.074
  508    HB3  LEU  65           HB1      LEU  65  93.549  -8.051 -16.485
  509    HG   LEU  65           HG       LEU  65  95.712  -6.123 -17.379
  510   HD11  LEU  65          HD11      LEU  65  94.225  -5.603 -19.185
  511   HD12  LEU  65          HD12      LEU  65  92.912  -6.529 -18.457
  512   HD13  LEU  65          HD13      LEU  65  94.320  -7.363 -19.116
  513   HD21  LEU  65          HD21      LEU  65  94.615  -5.058 -15.552
  514   HD22  LEU  65          HD22      LEU  65  93.040  -5.698 -16.026
  515   HD23  LEU  65          HD23      LEU  65  93.808  -4.436 -16.992
  516    H    ASP  66           HN       ASP  66  97.335  -8.925 -15.270
  517    HA   ASP  66           HA       ASP  66  96.314 -11.413 -14.064
  518    HB2  ASP  66           HB2      ASP  66  98.707 -10.698 -15.747
  519    HB3  ASP  66           HB1      ASP  66  98.462 -12.278 -15.002
  520    H    VAL  67           HN       VAL  67  97.558  -8.663 -12.880
  521    HA   VAL  67           HA       VAL  67  99.583  -9.996 -11.180
  522    HB   VAL  67           HB       VAL  67  99.229  -7.140 -12.056
  523   HG11  VAL  67          HG11      VAL  67 100.497  -8.165  -9.524
  524   HG12  VAL  67          HG12      VAL  67  99.546  -6.702  -9.778
  525   HG13  VAL  67          HG13      VAL  67 101.208  -6.782 -10.353
  526   HG21  VAL  67          HG21      VAL  67 101.454  -7.386 -12.830
  527   HG22  VAL  67          HG22      VAL  67 100.712  -8.944 -13.195
  528   HG23  VAL  67          HG23      VAL  67 101.758  -8.774 -11.783
  529    H    LEU  68           HN       LEU  68  98.413 -10.904  -9.620
  530    HA   LEU  68           HA       LEU  68  96.761  -9.124  -7.927
  531    HB2  LEU  68           HB2      LEU  68  95.313 -10.842  -8.587
  532    HB3  LEU  68           HB1      LEU  68  96.595 -12.049  -8.612
  533    HG   LEU  68           HG       LEU  68  96.712 -12.011  -6.163
  534   HD11  LEU  68          HD11      LEU  68  94.702 -10.738  -5.050
  535   HD12  LEU  68          HD12      LEU  68  94.724  -9.777  -6.528
  536   HD13  LEU  68          HD13      LEU  68  96.148  -9.833  -5.492
  537   HD21  LEU  68          HD21      LEU  68  93.859 -12.284  -7.162
  538   HD22  LEU  68          HD22      LEU  68  94.522 -13.024  -5.705
  539   HD23  LEU  68          HD23      LEU  68  95.102 -13.528  -7.293
  540    H    ILE  69           HN       ILE  69  97.838  -8.500  -6.149
  541    HA   ILE  69           HA       ILE  69  99.933 -10.303  -5.087
  542    HB   ILE  69           HB       ILE  69  99.671  -7.294  -5.070
  543   HG12  ILE  69          HG12      ILE  69 102.173  -8.629  -5.908
  544   HG13  ILE  69          HG11      ILE  69 100.782  -9.031  -6.912
  545   HG21  ILE  69          HG21      ILE  69 101.170  -9.099  -3.261
  546   HG22  ILE  69          HG22      ILE  69 100.665  -7.430  -3.016
  547   HG23  ILE  69          HG23      ILE  69 102.116  -7.784  -3.956
  548   HD11  ILE  69          HD11      ILE  69 101.906  -7.058  -7.814
  549   HD12  ILE  69          HD12      ILE  69 101.765  -6.239  -6.257
  550   HD13  ILE  69          HD13      ILE  69 100.317  -6.604  -7.196
  551    H    ARG  70           HN       ARG  70 100.039 -10.765  -2.919
  552    HA   ARG  70           HA       ARG  70  97.818  -9.780  -1.233
  553    HB2  ARG  70           HB2      ARG  70  98.835 -12.594  -0.955
  554    HB3  ARG  70           HB1      ARG  70  97.283 -11.917  -0.460
  555    HG2  ARG  70           HG2      ARG  70  96.878 -11.527  -2.990
  556    HG3  ARG  70           HG1      ARG  70  98.213 -12.654  -3.231
  557    HD2  ARG  70           HD2      ARG  70  95.645 -13.193  -1.722
  558    HD3  ARG  70           HD1      ARG  70  96.121 -13.896  -3.264
  559    HE   ARG  70           HE       ARG  70  98.086 -14.851  -1.901
  560   HH11  ARG  70          HH21      ARG  70  94.918 -14.211  -0.635
  561   HH12  ARG  70          HH22      ARG  70  95.025 -15.422   0.598
  562   HH21  ARG  70          HH11      ARG  70  98.216 -16.433  -0.287
  563   HH22  ARG  70          HH12      ARG  70  96.886 -16.676   0.794
  564    H    MET  71           HN       MET  71  98.367  -9.036   0.681
  565    HA   MET  71           HA       MET  71 100.908  -9.855   1.922
  566    HB2  MET  71           HB2      MET  71 100.170  -6.951   2.008
  567    HB3  MET  71           HB1      MET  71 101.756  -7.706   2.136
  568    HG2  MET  71           HG2      MET  71 101.943  -7.985  -0.198
  569    HG3  MET  71           HG1      MET  71 100.210  -7.813  -0.454
  570    HE1  MET  71           HE1      MET  71 101.847  -5.350   2.143
  571    HE2  MET  71           HE2      MET  71 102.846  -4.370   1.073
  572    HE3  MET  71           HE3      MET  71 103.171  -6.093   1.237
  573    H    GLU  72           HN       GLU  72 100.907  -9.669   4.183
  574    HA   GLU  72           HA       GLU  72  98.248  -9.219   5.373
  575    HB2  GLU  72           HB2      GLU  72  99.088 -11.474   5.798
  576    HB3  GLU  72           HB1      GLU  72 100.608 -10.820   6.411
  577    HG2  GLU  72           HG2      GLU  72  99.576  -9.911   8.337
  578    HG3  GLU  72           HG1      GLU  72  97.962 -10.045   7.640
  579    H    ILE  73           HN       ILE  73  98.047  -7.397   6.620
  580    HA   ILE  73           HA       ILE  73 100.547  -6.194   7.654
  581    HB   ILE  73           HB       ILE  73  99.750  -4.014   6.982
  582   HG12  ILE  73          HG12      ILE  73  97.342  -5.591   6.021
  583   HG13  ILE  73          HG11      ILE  73  97.360  -4.311   7.226
  584   HG21  ILE  73          HG21      ILE  73  99.263  -5.371   4.419
  585   HG22  ILE  73          HG22      ILE  73 100.661  -6.015   5.274
  586   HG23  ILE  73          HG23      ILE  73 100.583  -4.302   4.888
  587   HD11  ILE  73          HD11      ILE  73  97.039  -4.084   4.388
  588   HD12  ILE  73          HD12      ILE  73  98.499  -3.221   4.852
  589   HD13  ILE  73          HD13      ILE  73  96.956  -2.816   5.599
  590    H    SER  74           HN       SER  74 100.305  -4.663   9.326
  591    HA   SER  74           HA       SER  74  97.872  -5.004  10.988
  592    HB2  SER  74           HB2      SER  74 100.781  -4.877  11.799
  593    HB3  SER  74           HB1      SER  74  99.463  -4.616  12.940
  594    HG   SER  74           HG       SER  74  99.423  -6.865  11.260
  595    H    LEU  75           HN       LEU  75  97.233  -3.151  12.200
  596    HA   LEU  75           HA       LEU  75  97.637  -0.680  10.828
  597    HB2  LEU  75           HB2      LEU  75  95.657  -1.577  12.425
  598    HB3  LEU  75           HB1      LEU  75  96.564  -0.642  13.610
  599    HG   LEU  75           HG       LEU  75  96.510   1.296  11.994
  600   HD11  LEU  75          HD11      LEU  75  94.818  -0.686  10.496
  601   HD12  LEU  75          HD12      LEU  75  96.060   0.401   9.875
  602   HD13  LEU  75          HD13      LEU  75  94.486   1.038  10.343
  603   HD21  LEU  75          HD21      LEU  75  94.114   1.831  12.459
  604   HD22  LEU  75          HD22      LEU  75  94.969   1.216  13.874
  605   HD23  LEU  75          HD23      LEU  75  93.880   0.160  12.971
  606    H    ALA  76           HN       ALA  76  99.139   0.735  10.969
  607    HA   ALA  76           HA       ALA  76 101.051   0.601  13.194
  608    HB1  ALA  76           HB1      ALA  76 101.291   1.871  10.463
  609    HB2  ALA  76           HB2      ALA  76 102.085   0.399  11.017
  610    HB3  ALA  76           HB3      ALA  76 102.531   1.952  11.718
  611    H    TRP  77           HN       TRP  77  99.011   2.813  11.399
  612    HA   TRP  77           HA       TRP  77  98.482   4.479  13.681
  613    HB2  TRP  77           HB2      TRP  77  99.589   6.529  12.887
  614    HB3  TRP  77           HB1      TRP  77 100.792   5.255  13.121
  615    HD1  TRP  77           HD1      TRP  77 101.986   4.277  11.004
  616    HE1  TRP  77           HE1      TRP  77 101.866   4.781   8.489
  617    HE3  TRP  77           HE3      TRP  77  98.156   7.652  10.942
  618    HZ2  TRP  77           HZ2      TRP  77 100.537   6.556   6.728
  619    HZ3  TRP  77           HZ3      TRP  77  97.496   8.752   8.820
  620    HH2  TRP  77           HH2      TRP  77  98.669   8.200   6.706
  621    H    ALA  78           HN       ALA  78  97.190   6.469  12.995
  622    HA   ALA  78           HA       ALA  78  95.946   6.277  10.330
  623    HB1  ALA  78           HB1      ALA  78  94.444   6.032  12.938
  624    HB2  ALA  78           HB2      ALA  78  94.527   4.843  11.639
  625    HB3  ALA  78           HB3      ALA  78  93.682   6.369  11.383
  626    H    ARG  79           HN       ARG  79  95.854   8.367   9.554
  627    HA   ARG  79           HA       ARG  79  95.023  10.487  11.359
  628    HB2  ARG  79           HB2      ARG  79  97.558  10.239  11.559
  629    HB3  ARG  79           HB1      ARG  79  97.648  10.809   9.895
  630    HG2  ARG  79           HG2      ARG  79  96.617  12.910  10.481
  631    HG3  ARG  79           HG1      ARG  79  96.251  12.334  12.110
  632    HD2  ARG  79           HD2      ARG  79  98.480  12.444  12.792
  633    HD3  ARG  79           HD1      ARG  79  99.096  12.344  11.145
  634    HE   ARG  79           HE       ARG  79  97.574  14.735  11.544
  635   HH11  ARG  79          HH21      ARG  79 100.615  13.198  12.157
  636   HH12  ARG  79          HH22      ARG  79 101.504  14.682  12.239
  637   HH21  ARG  79          HH11      ARG  79  98.736  16.683  11.647
  638   HH22  ARG  79          HH12      ARG  79 100.441  16.655  11.950
  639    H    ASP  80           HN       ASP  80  93.856  12.034  10.396
  640    HA   ASP  80           HA       ASP  80  92.768  13.209   8.769
  641    HB2  ASP  80           HB2      ASP  80  95.179  13.920   8.472
  642    HB3  ASP  80           HB1      ASP  80  95.244  12.805   7.109
  643    H    GLY  81           HN       GLY  81  91.899  10.561   8.672
  644    HA2  GLY  81           HA2      GLY  81  90.525   9.415   7.221
  645    HA3  GLY  81           HA1      GLY  81  91.074  10.454   5.919
  646    H    LEU  82           HN       LEU  82  93.971   9.744   6.506
  647    HA   LEU  82           HA       LEU  82  93.940   7.303   4.916
  648    HB2  LEU  82           HB2      LEU  82  96.421   8.742   5.820
  649    HB3  LEU  82           HB1      LEU  82  96.147   7.816   4.342
  650    HG   LEU  82           HG       LEU  82  94.923  10.502   5.032
  651   HD11  LEU  82          HD11      LEU  82  97.313  10.533   4.313
  652   HD12  LEU  82          HD12      LEU  82  96.249  11.313   3.143
  653   HD13  LEU  82          HD13      LEU  82  96.853   9.685   2.837
  654   HD21  LEU  82          HD21      LEU  82  94.521   8.619   2.690
  655   HD22  LEU  82          HD22      LEU  82  94.062  10.321   2.644
  656   HD23  LEU  82          HD23      LEU  82  93.290   9.231   3.796
  657    H    LEU  83           HN       LEU  83  95.266   5.476   5.452
  658    HA   LEU  83           HA       LEU  83  95.675   5.093   8.383
  659    HB2  LEU  83           HB2      LEU  83  94.728   3.025   6.414
  660    HB3  LEU  83           HB1      LEU  83  94.851   2.873   8.164
  661    HG   LEU  83           HG       LEU  83  93.069   4.885   6.763
  662   HD11  LEU  83          HD11      LEU  83  91.255   3.271   7.635
  663   HD12  LEU  83          HD12      LEU  83  92.553   2.090   7.795
  664   HD13  LEU  83          HD13      LEU  83  92.161   2.760   6.212
  665   HD21  LEU  83          HD21      LEU  83  93.493   4.021   9.631
  666   HD22  LEU  83          HD22      LEU  83  91.984   4.775   9.119
  667   HD23  LEU  83          HD23      LEU  83  93.505   5.655   8.968
  668    H    GLY  84           HN       GLY  84  97.699   4.243   8.900
  669    HA2  GLY  84           HA2      GLY  84  99.437   3.471   6.678
  670    HA3  GLY  84           HA1      GLY  84  99.933   3.818   8.330
  671    H    PHE  85           HN       PHE  85 100.589   1.501   6.736
  672    HA   PHE  85           HA       PHE  85  99.654  -0.544   8.620
  673    HB2  PHE  85           HB2      PHE  85  99.197  -0.506   5.657
  674    HB3  PHE  85           HB1      PHE  85  99.444  -2.039   6.479
  675    HD1  PHE  85           HD2      PHE  85  97.998  -2.543   8.540
  676    HD2  PHE  85           HD1      PHE  85  97.097   0.550   5.707
  677    HE1  PHE  85           HE2      PHE  85  95.644  -2.522   9.314
  678    HE2  PHE  85           HE1      PHE  85  94.739   0.569   6.480
  679    HZ   PHE  85           HZ       PHE  85  94.019  -0.963   8.284
  680    H    GLU  86           HN       GLU  86 101.290  -1.889   9.219
  681    HA   GLU  86           HA       GLU  86 103.785  -1.696   7.672
  682    HB2  GLU  86           HB2      GLU  86 104.948  -2.192   9.653
  683    HB3  GLU  86           HB1      GLU  86 103.623  -1.179  10.221
  684    HG2  GLU  86           HG2      GLU  86 102.330  -3.372  10.596
  685    HG3  GLU  86           HG1      GLU  86 103.886  -4.179  10.407
  686    H    CYS  87           HN       CYS  87 104.385  -3.425   6.484
  687    HA   CYS  87           HA       CYS  87 102.711  -5.668   6.198
  688    HB2  CYS  87           HB2      CYS  87 104.376  -4.673   4.520
  689    HB3  CYS  87           HB1      CYS  87 105.602  -5.615   5.367
  690    HG   CYS  87           HG       CYS  87 103.153  -7.257   4.499
  691    H    GLN  88           HN       GLN  88 102.463  -7.362   7.464
  692    HA   GLN  88           HA       GLN  88 104.494  -8.063   9.444
  693    HB2  GLN  88           HB2      GLN  88 101.820  -9.382   8.913
  694    HB3  GLN  88           HB1      GLN  88 102.820  -9.554  10.353
  695    HG2  GLN  88           HG2      GLN  88 101.856  -6.832   9.502
  696    HG3  GLN  88           HG1      GLN  88 100.793  -7.907  10.405
  697   HE21  GLN  88          HE21      GLN  88 102.717  -5.359  10.979
  698   HE22  GLN  88          HE22      GLN  88 103.340  -5.768  12.504
  699    H    HIS  89           HN       HIS  89 102.947  -9.361   6.557
  700    HA   HIS  89           HA       HIS  89 105.193 -11.047   5.970
  701    HB2  HIS  89           HB2      HIS  89 104.510 -12.989   6.886
  702    HB3  HIS  89           HB1      HIS  89 103.122 -12.161   7.589
  703    HD2  HIS  89           HD2      HIS  89 100.735 -13.118   6.594
  704    HE1  HIS  89           HE1      HIS  89 102.175 -14.661   2.929
  705    HE2  HIS  89           HE2      HIS  89 100.116 -14.396   4.398
  706    H    ILE  90           HN       ILE  90 105.173 -11.705   3.831
  707    HA   ILE  90           HA       ILE  90 102.763 -11.282   2.189
  708    HB   ILE  90           HB       ILE  90 103.845  -9.114   2.092
  709   HG12  ILE  90          HG12      ILE  90 104.529 -10.758  -0.369
  710   HG13  ILE  90          HG11      ILE  90 102.949 -10.068  -0.017
  711   HG21  ILE  90          HG21      ILE  90 106.041  -9.501   2.845
  712   HG22  ILE  90          HG22      ILE  90 106.256  -9.098   1.144
  713   HG23  ILE  90          HG23      ILE  90 106.320 -10.781   1.667
  714   HD11  ILE  90          HD11      ILE  90 103.914  -8.455  -1.424
  715   HD12  ILE  90          HD12      ILE  90 105.512  -8.652  -0.705
  716   HD13  ILE  90          HD13      ILE  90 104.241  -7.814   0.185
  717    H    ASP  91           HN       ASP  91 102.575 -12.533   0.503
  718    HA   ASP  91           HA       ASP  91 103.908 -14.981   0.473
  719    HB2  ASP  91           HB2      ASP  91 101.809 -13.704  -0.996
  720    HB3  ASP  91           HB1      ASP  91 102.882 -14.504  -2.137
  721    H    LEU  92           HN       LEU  92 105.526 -15.863  -0.655
  722    HA   LEU  92           HA       LEU  92 107.733 -14.343  -1.428
  723    HB2  LEU  92           HB2      LEU  92 107.524 -16.900  -0.954
  724    HB3  LEU  92           HB1      LEU  92 107.197 -17.023  -2.682
  725    HG   LEU  92           HG       LEU  92 109.361 -15.456  -2.831
  726   HD11  LEU  92          HD11      LEU  92 110.948 -15.821  -1.104
  727   HD12  LEU  92          HD12      LEU  92 110.005 -17.135  -0.403
  728   HD13  LEU  92          HD13      LEU  92 109.443 -15.470  -0.255
  729   HD21  LEU  92          HD21      LEU  92 109.377 -18.455  -2.361
  730   HD22  LEU  92          HD22      LEU  92 110.722 -17.550  -3.054
  731   HD23  LEU  92          HD23      LEU  92 109.183 -17.633  -3.910
  732    H    ASP  93           HN       ASP  93 105.130 -15.690  -3.426
  733    HA   ASP  93           HA       ASP  93 106.175 -14.864  -5.925
  734    HB2  ASP  93           HB2      ASP  93 103.231 -15.099  -5.312
  735    HB3  ASP  93           HB1      ASP  93 104.067 -15.435  -6.827
  736    H    SER  94           HN       SER  94 103.954 -13.383  -3.607
  737    HA   SER  94           HA       SER  94 103.405 -11.045  -5.133
  738    HB2  SER  94           HB2      SER  94 102.951 -10.180  -2.653
  739    HB3  SER  94           HB1      SER  94 101.852 -11.308  -3.444
  740    HG   SER  94           HG       SER  94 102.802 -11.767  -1.216
  741    H    ILE  95           HN       ILE  95 105.884 -11.952  -2.811
  742    HA   ILE  95           HA       ILE  95 107.005  -9.425  -2.326
  743    HB   ILE  95           HB       ILE  95 108.142 -12.218  -2.305
  744   HG12  ILE  95          HG12      ILE  95 107.838 -10.162  -0.104
  745   HG13  ILE  95          HG11      ILE  95 106.599 -11.350  -0.496
  746   HG21  ILE  95          HG21      ILE  95 110.064 -10.980  -2.925
  747   HG22  ILE  95          HG22      ILE  95 110.156 -11.058  -1.166
  748   HG23  ILE  95          HG23      ILE  95 109.584  -9.588  -1.955
  749   HD11  ILE  95          HD11      ILE  95 108.639 -11.760   1.299
  750   HD12  ILE  95          HD12      ILE  95 109.290 -12.506  -0.161
  751   HD13  ILE  95          HD13      ILE  95 107.742 -13.045   0.491
  752    H    SER  96           HN       SER  96 107.517 -11.738  -4.968
  753    HA   SER  96           HA       SER  96 109.688 -10.286  -6.023
  754    HB2  SER  96           HB2      SER  96 108.679 -12.770  -6.514
  755    HB3  SER  96           HB1      SER  96 108.073 -11.897  -7.924
  756    HG   SER  96           HG       SER  96 110.688 -12.511  -7.158
  757    H    HIS  97           HN       HIS  97 106.219 -10.146  -6.667
  758    HA   HIS  97           HA       HIS  97 106.432  -8.498  -8.952
  759    HB2  HIS  97           HB2      HIS  97 104.255  -8.934  -6.912
  760    HB3  HIS  97           HB1      HIS  97 104.092  -7.710  -8.156
  761    HD2  HIS  97           HD2      HIS  97 103.991 -11.586  -7.826
  762    HE1  HIS  97           HE1      HIS  97 103.226 -10.602 -11.856
  763    HE2  HIS  97           HE2      HIS  97 103.258 -12.494 -10.163
  764    H    LEU  98           HN       LEU  98 106.492  -7.794  -5.510
  765    HA   LEU  98           HA       LEU  98 106.351  -4.938  -5.721
  766    HB2  LEU  98           HB2      LEU  98 107.152  -6.919  -3.647
  767    HB3  LEU  98           HB1      LEU  98 107.866  -5.313  -3.505
  768    HG   LEU  98           HG       LEU  98 105.609  -4.305  -3.594
  769   HD11  LEU  98          HD11      LEU  98 104.376  -5.878  -4.903
  770   HD12  LEU  98          HD12      LEU  98 103.667  -5.942  -3.291
  771   HD13  LEU  98          HD13      LEU  98 104.779  -7.205  -3.815
  772   HD21  LEU  98          HD21      LEU  98 105.569  -6.498  -1.519
  773   HD22  LEU  98          HD22      LEU  98 105.016  -4.832  -1.362
  774   HD23  LEU  98          HD23      LEU  98 106.742  -5.184  -1.435
  775    H    ARG  99           HN       ARG  99 109.022  -7.233  -6.050
  776    HA   ARG  99           HA       ARG  99 111.044  -5.210  -6.115
  777    HB2  ARG  99           HB2      ARG  99 111.418  -7.680  -7.746
  778    HB3  ARG  99           HB1      ARG  99 112.533  -6.889  -6.633
  779    HG2  ARG  99           HG2      ARG  99 110.061  -8.388  -5.761
  780    HG3  ARG  99           HG1      ARG  99 111.669  -9.099  -5.812
  781    HD2  ARG  99           HD2      ARG  99 110.940  -6.628  -4.229
  782    HD3  ARG  99           HD1      ARG  99 111.033  -8.247  -3.552
  783    HE   ARG  99           HE       ARG  99 113.411  -8.234  -3.985
  784   HH11  ARG  99          HH21      ARG  99 111.766  -5.220  -4.511
  785   HH12  ARG  99          HH22      ARG  99 113.210  -4.270  -4.420
  786   HH21  ARG  99          HH11      ARG  99 115.290  -6.983  -3.862
  787   HH22  ARG  99          HH12      ARG  99 115.200  -5.264  -4.053
  788    H    ARG 100           HN       ARG 100 109.006  -6.752  -8.533
  789    HA   ARG 100           HA       ARG 100 110.134  -5.634 -10.872
  790    HB2  ARG 100           HB2      ARG 100 107.317  -6.529 -10.251
  791    HB3  ARG 100           HB1      ARG 100 107.895  -6.106 -11.863
  792    HG2  ARG 100           HG2      ARG 100 109.633  -7.849 -11.703
  793    HG3  ARG 100           HG1      ARG 100 109.059  -8.276 -10.091
  794    HD2  ARG 100           HD2      ARG 100 108.045  -9.140 -12.657
  795    HD3  ARG 100           HD1      ARG 100 107.601  -9.704 -11.049
  796    HE   ARG 100           HE       ARG 100 106.201  -7.434 -11.168
  797   HH11  ARG 100          HH21      ARG 100 106.713  -9.921 -13.523
  798   HH12  ARG 100          HH22      ARG 100 105.182  -9.689 -14.299
  799   HH21  ARG 100          HH11      ARG 100 104.194  -7.130 -12.180
  800   HH22  ARG 100          HH12      ARG 100 103.757  -8.111 -13.538
  801    H    LEU 101           HN       LEU 101 107.428  -4.535  -8.829
  802    HA   LEU 101           HA       LEU 101 106.792  -2.231 -10.333
  803    HB2  LEU 101           HB2      LEU 101 106.251  -3.196  -7.561
  804    HB3  LEU 101           HB1      LEU 101 106.021  -1.478  -7.867
  805    HG   LEU 101           HG       LEU 101 103.931  -2.732  -8.215
  806   HD11  LEU 101          HD11      LEU 101 104.589  -2.077 -11.022
  807   HD12  LEU 101          HD12      LEU 101 104.971  -0.808  -9.859
  808   HD13  LEU 101          HD13      LEU 101 103.326  -1.430  -9.973
  809   HD21  LEU 101          HD21      LEU 101 104.809  -4.897  -8.857
  810   HD22  LEU 101          HD22      LEU 101 105.559  -4.216 -10.301
  811   HD23  LEU 101          HD23      LEU 101 103.805  -4.298 -10.174
  812    H    VAL 102           HN       VAL 102 109.013  -2.779  -7.652
  813    HA   VAL 102           HA       VAL 102 109.769  -0.071  -7.268
  814    HB   VAL 102           HB       VAL 102 111.185  -2.656  -6.598
  815   HG11  VAL 102          HG11      VAL 102 112.859  -0.967  -6.559
  816   HG12  VAL 102          HG12      VAL 102 112.324  -1.108  -4.885
  817   HG13  VAL 102          HG13      VAL 102 111.751   0.227  -5.884
  818   HG21  VAL 102          HG21      VAL 102 110.040  -2.625  -4.588
  819   HG22  VAL 102          HG22      VAL 102 108.822  -1.870  -5.613
  820   HG23  VAL 102          HG23      VAL 102 109.857  -0.873  -4.592
  821    H    GLU 103           HN       GLU 103 111.313  -2.744  -9.052
  822    HA   GLU 103           HA       GLU 103 113.574  -1.281  -9.904
  823    HB2  GLU 103           HB2      GLU 103 112.248  -3.828 -10.710
  824    HB3  GLU 103           HB1      GLU 103 113.422  -3.127 -11.824
  825    HG2  GLU 103           HG2      GLU 103 114.041  -3.475  -8.893
  826    HG3  GLU 103           HG1      GLU 103 114.315  -4.771 -10.056
  827    H    LEU 104           HN       LEU 104 110.437  -1.873 -11.459
  828    HA   LEU 104           HA       LEU 104 111.095  -0.606 -13.897
  829    HB2  LEU 104           HB2      LEU 104 108.465  -1.212 -12.550
  830    HB3  LEU 104           HB1      LEU 104 108.554  -0.433 -14.127
  831    HG   LEU 104           HG       LEU 104 109.956  -3.046 -13.509
  832   HD11  LEU 104          HD11      LEU 104 107.169  -2.515 -14.555
  833   HD12  LEU 104          HD12      LEU 104 107.642  -3.528 -13.192
  834   HD13  LEU 104          HD13      LEU 104 108.010  -4.040 -14.839
  835   HD21  LEU 104          HD21      LEU 104 110.910  -2.234 -15.474
  836   HD22  LEU 104          HD22      LEU 104 109.447  -1.376 -15.958
  837   HD23  LEU 104          HD23      LEU 104 109.541  -3.127 -16.132
  838    H    ASN 105           HN       ASN 105 110.048   0.633 -10.812
  839    HA   ASN 105           HA       ASN 105 109.024   3.123 -11.614
  840    HB2  ASN 105           HB2      ASN 105 110.375   2.183  -9.096
  841    HB3  ASN 105           HB1      ASN 105 109.848   3.853  -9.284
  842   HD21  ASN 105          HD21      ASN 105 107.422   3.541 -10.661
  843   HD22  ASN 105          HD22      ASN 105 106.335   2.658  -9.701
  844    H    LEU 106           HN       LEU 106 112.324   1.987 -11.263
  845    HA   LEU 106           HA       LEU 106 113.658   4.463 -11.223
  846    HB2  LEU 106           HB2      LEU 106 114.434   1.701 -12.124
  847    HB3  LEU 106           HB1      LEU 106 115.534   3.057 -12.359
  848    HG   LEU 106           HG       LEU 106 115.865   1.764 -10.199
  849   HD11  LEU 106          HD11      LEU 106 115.082   4.569  -9.480
  850   HD12  LEU 106          HD12      LEU 106 116.347   4.332 -10.684
  851   HD13  LEU 106          HD13      LEU 106 116.538   3.668  -9.062
  852   HD21  LEU 106          HD21      LEU 106 113.337   1.526  -9.871
  853   HD22  LEU 106          HD22      LEU 106 113.355   3.198  -9.310
  854   HD23  LEU 106          HD23      LEU 106 114.270   1.966  -8.440
  855    H    GLY 107           HN       GLY 107 111.912   2.896 -13.718
  856    HA2  GLY 107           HA2      GLY 107 113.262   4.016 -15.971
  857    HA3  GLY 107           HA1      GLY 107 111.635   3.339 -15.966
  858    H    ASP 108           HN       ASP 108 111.722   5.528 -13.523
  859    HA   ASP 108           HA       ASP 108 110.198   7.471 -15.037
  860    HB2  ASP 108           HB2      ASP 108 109.866   8.552 -12.843
  861    HB3  ASP 108           HB1      ASP 108 109.467   6.836 -12.789
  862    H    GLU 109           HN       GLU 109 113.317   7.003 -15.079
  863    HA   GLU 109           HA       GLU 109 114.397   9.537 -14.270
  864    HB2  GLU 109           HB2      GLU 109 115.424   7.138 -15.743
  865    HB3  GLU 109           HB1      GLU 109 116.334   8.646 -15.834
  866    HG2  GLU 109           HG2      GLU 109 115.418   7.516 -13.188
  867    HG3  GLU 109           HG1      GLU 109 116.939   7.017 -13.927
  868    H    GLU 110           HN       GLU 110 112.110   9.430 -16.245
  869    HA   GLU 110           HA       GLU 110 113.077  10.272 -18.783
  870    HB2  GLU 110           HB2      GLU 110 110.413  10.723 -17.416
  871    HB3  GLU 110           HB1      GLU 110 110.746  11.116 -19.103
  872    HG2  GLU 110           HG2      GLU 110 111.135   8.828 -19.661
  873    HG3  GLU 110           HG1      GLU 110 111.201   8.353 -17.964
  874    H    LEU 111           HN       LEU 111 110.881  12.478 -17.303
  875    HA   LEU 111           HA       LEU 111 112.975  14.507 -16.905
  876    HB2  LEU 111           HB2      LEU 111 110.585  14.765 -18.738
  877    HB3  LEU 111           HB1      LEU 111 111.486  16.155 -18.136
  878    HG   LEU 111           HG       LEU 111 112.797  13.852 -19.601
  879   HD11  LEU 111          HD11      LEU 111 111.218  14.848 -21.137
  880   HD12  LEU 111          HD12      LEU 111 112.826  15.436 -21.556
  881   HD13  LEU 111          HD13      LEU 111 111.714  16.473 -20.664
  882   HD21  LEU 111          HD21      LEU 111 114.501  15.012 -18.499
  883   HD22  LEU 111          HD22      LEU 111 113.656  16.557 -18.598
  884   HD23  LEU 111          HD23      LEU 111 114.433  15.883 -20.029
  885    H    LEU 112           HN       LEU 112 112.392  13.995 -14.654
  886    HA   LEU 112           HA       LEU 112 110.554  15.888 -13.601
  887    HB2  LEU 112           HB2      LEU 112 108.939  14.171 -14.423
  888    HB3  LEU 112           HB1      LEU 112 109.699  12.994 -13.358
  889    HG   LEU 112           HG       LEU 112 109.223  14.636 -11.444
  890   HD11  LEU 112          HD11      LEU 112 107.661  15.887 -13.703
  891   HD12  LEU 112          HD12      LEU 112 108.710  16.671 -12.523
  892   HD13  LEU 112          HD13      LEU 112 107.132  16.062 -12.031
  893   HD21  LEU 112          HD21      LEU 112 107.941  12.574 -11.753
  894   HD22  LEU 112          HD22      LEU 112 106.927  13.361 -12.963
  895   HD23  LEU 112          HD23      LEU 112 106.855  13.880 -11.278
  896    H    GLU 113           HN       GLU 113 110.991  12.665 -12.251
  897    HA   GLU 113           HA       GLU 113 111.836  13.465  -9.747
  898    HB2  GLU 113           HB2      GLU 113 111.181  11.115 -10.605
  899    HB3  GLU 113           HB1      GLU 113 112.888  10.945 -11.016
  900    HG2  GLU 113           HG2      GLU 113 113.403  11.640  -8.618
  901    HG3  GLU 113           HG1      GLU 113 111.684  11.436  -8.285
  902    H    ARG 114           HN       ARG 114 113.866  13.545  -8.709
  903    HA   ARG 114           HA       ARG 114 116.334  13.352 -10.146
  904    HB2  ARG 114           HB2      ARG 114 116.926  15.799  -9.831
  905    HB3  ARG 114           HB1      ARG 114 115.758  15.458 -11.109
  906    HG2  ARG 114           HG2      ARG 114 113.910  15.997  -9.554
  907    HG3  ARG 114           HG1      ARG 114 115.088  16.373  -8.296
  908    HD2  ARG 114           HD2      ARG 114 116.091  18.065  -9.914
  909    HD3  ARG 114           HD1      ARG 114 114.667  17.812 -10.922
  910    HE   ARG 114           HE       ARG 114 113.803  18.387  -8.306
  911   HH11  ARG 114          HH21      ARG 114 115.454  19.852 -10.973
  912   HH12  ARG 114          HH22      ARG 114 114.911  21.455 -10.606
  913   HH21  ARG 114          HH11      ARG 114 113.087  20.487  -7.822
  914   HH22  ARG 114          HH12      ARG 114 113.571  21.814  -8.823
  915    H    GLU 115           HN       GLU 115 118.079  14.666  -8.681
  916    HA   GLU 115           HA       GLU 115 117.897  13.389  -6.096
  917    HB2  GLU 115           HB2      GLU 115 119.999  15.050  -7.481
  918    HB3  GLU 115           HB1      GLU 115 120.164  14.571  -5.792
  919    HG2  GLU 115           HG2      GLU 115 119.968  12.212  -6.408
  920    HG3  GLU 115           HG1      GLU 115 119.710  12.653  -8.095
  921    H    LEU 116           HN       LEU 116 117.535  16.626  -7.386
  922    HA   LEU 116           HA       LEU 116 117.823  18.157  -5.075
  923    HB2  LEU 116           HB2      LEU 116 116.315  18.452  -7.629
  924    HB3  LEU 116           HB1      LEU 116 115.865  19.524  -6.303
  925    HG   LEU 116           HG       LEU 116 118.221  20.227  -6.072
  926   HD11  LEU 116          HD11      LEU 116 119.773  19.538  -7.981
  927   HD12  LEU 116          HD12      LEU 116 118.597  18.279  -8.356
  928   HD13  LEU 116          HD13      LEU 116 119.415  18.286  -6.793
  929   HD21  LEU 116          HD21      LEU 116 117.587  20.486  -9.003
  930   HD22  LEU 116          HD22      LEU 116 118.188  21.707  -7.881
  931   HD23  LEU 116          HD23      LEU 116 116.499  21.205  -7.814
  932    H    ALA 117           HN       ALA 117 114.906  16.534  -6.324
  933    HA   ALA 117           HA       ALA 117 113.150  17.316  -4.217
  934    HB1  ALA 117           HB1      ALA 117 111.784  15.433  -5.076
  935    HB2  ALA 117           HB2      ALA 117 113.114  15.007  -6.154
  936    HB3  ALA 117           HB3      ALA 117 112.297  16.562  -6.330
  937    H    LEU 118           HN       LEU 118 114.834  14.246  -4.884
  938    HA   LEU 118           HA       LEU 118 113.977  12.856  -2.643
  939    HB2  LEU 118           HB2      LEU 118 116.566  12.593  -4.180
  940    HB3  LEU 118           HB1      LEU 118 115.968  11.406  -3.023
  941    HG   LEU 118           HG       LEU 118 114.421  12.331  -5.460
  942   HD11  LEU 118          HD11      LEU 118 115.909   9.722  -5.052
  943   HD12  LEU 118          HD12      LEU 118 116.544  11.078  -5.986
  944   HD13  LEU 118          HD13      LEU 118 115.077  10.254  -6.513
  945   HD21  LEU 118          HD21      LEU 118 113.308   9.999  -4.847
  946   HD22  LEU 118          HD22      LEU 118 112.811  11.468  -4.012
  947   HD23  LEU 118          HD23      LEU 118 113.944  10.358  -3.242
  948    H    LEU 119           HN       LEU 119 117.043  14.703  -2.962
  949    HA   LEU 119           HA       LEU 119 117.789  14.109  -0.264
  950    HB2  LEU 119           HB2      LEU 119 118.913  15.577  -2.530
  951    HB3  LEU 119           HB1      LEU 119 119.252  16.355  -0.985
  952    HG   LEU 119           HG       LEU 119 119.641  13.380  -1.281
  953   HD11  LEU 119          HD11      LEU 119 121.664  15.515  -2.011
  954   HD12  LEU 119          HD12      LEU 119 120.867  14.430  -3.150
  955   HD13  LEU 119          HD13      LEU 119 121.970  13.779  -1.937
  956   HD21  LEU 119          HD21      LEU 119 119.725  14.682   0.933
  957   HD22  LEU 119          HD22      LEU 119 121.209  15.413   0.320
  958   HD23  LEU 119          HD23      LEU 119 121.121  13.668   0.566
  959    H    VAL 120           HN       VAL 120 116.550  17.101  -1.804
  960    HA   VAL 120           HA       VAL 120 116.573  18.657   0.485
  961    HB   VAL 120           HB       VAL 120 114.628  18.754  -1.831
  962   HG11  VAL 120          HG11      VAL 120 115.180  20.661   0.449
  963   HG12  VAL 120          HG12      VAL 120 113.626  20.012  -0.075
  964   HG13  VAL 120          HG13      VAL 120 114.466  21.201  -1.071
  965   HG21  VAL 120          HG21      VAL 120 117.008  20.540  -1.314
  966   HG22  VAL 120          HG22      VAL 120 116.148  20.268  -2.829
  967   HG23  VAL 120          HG23      VAL 120 117.191  19.009  -2.170
  968    H    SER 121           HN       SER 121 114.588  15.962  -0.200
  969    HA   SER 121           HA       SER 121 112.313  16.682   1.366
  970    HB2  SER 121           HB2      SER 121 112.779  14.705  -0.406
  971    HB3  SER 121           HB1      SER 121 113.041  13.815   1.089
  972    HG   SER 121           HG       SER 121 110.934  13.721   1.091
  973    H    ALA 122           HN       ALA 122 115.109  16.931   2.531
  974    HA   ALA 122           HA       ALA 122 114.745  16.751   5.159
  975    HB1  ALA 122           HB1      ALA 122 114.060  14.574   5.441
  976    HB2  ALA 122           HB2      ALA 122 115.798  14.354   5.632
  977    HB3  ALA 122           HB3      ALA 122 115.026  13.979   4.092
  978    H    HIS 123           HN       HIS 123 116.720  16.987   2.597
  979    HA   HIS 123           HA       HIS 123 119.256  16.240   3.156
  980    HB2  HIS 123           HB2      HIS 123 120.037  18.199   1.963
  981    HB3  HIS 123           HB1      HIS 123 118.560  17.611   1.200
  982    HD2  HIS 123           HD2      HIS 123 116.802  19.157   3.861
  983    HE1  HIS 123           HE1      HIS 123 118.011  22.567   1.688
  984    HE2  HIS 123           HE2      HIS 123 116.423  21.710   3.474
  985    H    ASP 124           HN       ASP 124 120.133  19.252   3.458
  986    HA   ASP 124           HA       ASP 124 121.065  20.541   5.109
  987    HB2  ASP 124           HB2      ASP 124 118.719  20.774   5.859
  988    HB3  ASP 124           HB1      ASP 124 118.906  19.331   6.852
  989    H    ASP 125           HN       ASP 125 120.553  17.154   5.719
  990    HA   ASP 125           HA       ASP 125 121.836  16.507   7.984
  991    HB2  ASP 125           HB2      ASP 125 122.168  15.264   5.255
  992    HB3  ASP 125           HB1      ASP 125 122.858  14.552   6.711
  993   H5'1  C2E 501          H5'1      C2E 501 104.602   0.932  11.584
  994   H5'2  C2E 501          H5'2      C2E 501 106.169   1.129  12.395
  995    H4'  C2E 501           H4'      C2E 501 106.943  -0.085  10.629
  996    H3'  C2E 501           H3'      C2E 501 106.711   2.714   9.554
  997    H2'  C2E 501           H2'      C2E 501 107.089   2.006   7.337
  998   HO2'  C2E 501          HO2'      C2E 501 108.245   0.270   6.892
  999    H1'  C2E 501           H1'      C2E 501 105.422  -0.107   7.339
 1000    H8   C2E 501           H8       C2E 501 103.874   2.303   9.789
 1001    HN1  C2E 501           HN1      C2E 501 103.010   4.087   3.707
 1002   HN21  C2E 501          HN21      C2E 501 104.242   2.820   2.361
 1003   HN22  C2E 501          HN22      C2E 501 105.275   1.543   2.963
 1004   H511  C2E 501          H511      C2E 501 108.104   4.375   9.843
 1005   H512  C2E 501          H512      C2E 501 109.585   5.348   9.780
 1006    H4A  C2E 501           H4A      C2E 501 108.904   5.261  12.509
 1007    H3A  C2E 501           H3A      C2E 501 106.352   5.480  10.878
 1008    H2A  C2E 501           H2A      C2E 501 105.659   7.279  12.182
 1009   HO2A  C2E 501          HO2A      C2E 501 107.644   6.333  13.967
 1010    H1A  C2E 501           H1A      C2E 501 107.955   8.669  12.194
 1011    H81  C2E 501           H81      C2E 501 108.136   6.854   8.924
 1012   HN11  C2E 501          HN11      C2E 501 104.046  11.769   8.679
 1013   HN24  C2E 501          HN24      C2E 501 104.371  11.826  12.156
 1014   HN23  C2E 501          HN23      C2E 501 103.629  12.518  10.731
 1015   H5'1  C2E 502          H5'1      C2E 502 100.905  10.505   4.521
 1016   H5'2  C2E 502          H5'2      C2E 502  99.602  11.674   4.223
 1017    H4'  C2E 502           H4'      C2E 502  99.418  12.227   6.436
 1018    H3'  C2E 502           H3'      C2E 502 102.398  11.740   6.627
 1019    H2'  C2E 502           H2'      C2E 502 102.119  11.480   8.994
 1020   HO2'  C2E 502          HO2'      C2E 502  99.556  12.605   8.483
 1021    H1'  C2E 502           H1'      C2E 502  99.957   9.874   8.839
 1022    H8   C2E 502           H8       C2E 502 102.106   8.972   5.830
 1023    HN1  C2E 502           HN1      C2E 502 103.932   6.210  11.303
 1024   HN21  C2E 502          HN21      C2E 502 102.845   7.113  13.018
 1025   HN22  C2E 502          HN22      C2E 502 101.672   8.394  12.813
 1026   H511  C2E 502          H511      C2E 502 103.881  16.664   6.152
 1027   H512  C2E 502          H512      C2E 502 102.361  15.924   5.612
 1028    H4A  C2E 502           H4A      C2E 502 103.741  16.308   3.675
 1029    H3A  C2E 502           H3A      C2E 502 103.545  13.398   4.513
 1030    H2A  C2E 502           H2A      C2E 502 105.027  12.768   2.811
 1031   HO2A  C2E 502          HO2A      C2E 502 104.294  15.261   1.660
 1032    H1A  C2E 502           H1A      C2E 502 106.756  14.905   2.939
 1033    H81  C2E 502           H81      C2E 502 106.108  14.152   6.512
 1034   HN11  C2E 502          HN11      C2E 502 110.065   9.969   3.705
 1035   HN24  C2E 502          HN24      C2E 502 109.935  10.166   1.499
 1036   HN23  C2E 502          HN23      C2E 502 108.882  11.324   0.719