*HEADER    UNKNOWN FUNCTION                        09-JAN-20   6VHJ              
*TITLE     SOLUTION NMR OF PROCHLOROSIN 1.1 PRODUCED BY PROCHLOROCOCCUS MIT 9313 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROCHLOROSIN 1.1;                                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PROCHLOROCOCCUS MARINUS STR. MIT 9313;          
*SOURCE   3 ORGANISM_TAXID: 74547;                                               
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    LANTHIPEPTIDE, CYCLIC PEPTIDE, POSTTRANSLATIONAL MODIFICATION, RIPP,  
*KEYWDS   2 UNKNOWN FUNCTION                                                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    S.C.BOBEICA,W.A.VAN DER DONK,W.TANG                                   
*REVDAT   1   08-JUL-20 6VHJ    0                                                
# Restraints file 1: ProcA11_noe_20200109.tbl
assign (residue 4 and name HA) (residue 2 and name HE#) 3.5 1.7 1.0
assign (residue 13 and name HD#) (residue 13 and name HA) 4.5 2.7 1.0 
assign (residue 2 and name HB#) (residue 2 and name HD#) 3.5 1.7 1.0
assign (residue 2 and name HB#) (residue 2 and name HE#) 3.5 1.7 1.0
assign (residue 2 and name HD#) (residue 2 and name HB2) 3.5 1.7 1.0
assign (residue 2 and name HE#) (residue 2 and name HB2) 3.5 1.7 1.0
assign (residue 4 and name HG1#) (residue 4 and name HB) 3.5 1.7 1.0
assign (residue 4 and name HG1#) (residue 11 and name HE#) 4.0 2.2 1.0
assign (residue 4 and name HG2#) (residue 9 and name HB2) 3.5 1.7 1.0
assign (residue 4 and name HG2#) (residue 11 and name HE#) 4.0 2.2 1.0
assign (residue 5 and name HB#) (residue 5 and name HG1) 3.5 1.7 1.0
assign (residue 5 and name HG#) (residue 5 and name HA) 3.5 1.7 1.0
assign (residue 7 and name HG#) (residue 3 and name HB1) 3.5 1.7 1.0
assign (residue 7 and name HG#) (residue 7 and name HA) 3.5 1.7 1.0
assign (residue 7 and name HG#) (residue 7 and name HB#) 3.5 1.7 1.0
assign (residue 7 and name HG#) (residue 9 and name HA) 3.5 1.7 1.0
assign (residue 9 and name HB1) (residue 11 and name HD#) 4.5 2.7 1.0 
assign (residue 9 and name HB2) (residue 2 and name HE#) 4.5 2.7 1.0 
assign (residue 10 and name HB1) (residue 10 and name HD#) 3.5 1.7 1.0
assign (residue 10 and name HB2) (residue 10 and name HA) 3.5 1.7 1.0
assign (residue 10 and name HG#) (residue 10 and name HD#) 3.5 1.7 1.0
assign (residue 10 and name HD#) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 10 and name HD#) (residue 11 and name HE#) 4.5 2.7 1.0
assign (residue 12 and name HB2) (residue 12 and name HA) 3.5 1.7 1.0
assign (residue 12 and name HG#) (residue 12 and name HA) 3.5 1.7 1.0
assign (residue 12 and name HG#) (residue 12 and name HB2) 3.5 1.7 1.0
assign (residue 12 and name HG#) (residue 16 and name HB1) 3.5 1.7 1.0
assign (residue 13 and name HG2#) (residue 13 and name HB) 3.5 1.7 1.0
assign (residue 15 and name HG1#) (residue 15 and name HA) 3.5 1.7 1.0
assign (residue 15 and name HG1#) (residue 15 and name HB) 3.5 1.7 1.0
assign (residue 2 and name HA) (residue 2 and name HB1) 4.5 2.7 1.0
assign (residue 2 and name HA) (residue 2 and name HB2) 4.5 2.7 1.0
assign (residue 2 and name HB#) (residue 2 and name HZ) 4.5 2.7 1.0
assign (residue 2 and name HB1) (residue 2 and name HE#) 4.5 2.7 1.0
assign (residue 3 and name HB1) (residue 7 and name HB#) 4.5 2.7 1.0
assign (residue 3 and name HB2) (residue 7 and name HB#) 4.5 2.7 1.0
assign (residue 4 and name HB) (residue 4 and name HA) 4.5 2.7 1.0
assign (residue 4 and name HB) (residue 5 and name HG1) 4.5 2.7 1.0
assign (residue 4 and name HB) (residue 11 and name HZ) 5.5 3.7 1.0
assign (residue 4 and name HG1#) (residue 2 and name HB#) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 2 and name HD#) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 3 and name HB1) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 4 and name HA) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 5 and name HG#) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 7 and name HG#) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 8 and name HB#) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 9 and name HA) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 9 and name HB1) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 11 and name HD#) 5.0 3.2 1.0
assign (residue 4 and name HG2#) (residue 2 and name HB#) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 3 and name HB1) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 4 and name HA) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 4 and name HB) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 5 and name HA) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 5 and name HG#) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 8 and name HB#) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 9 and name HA) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 9 and name HB1) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 11 and name HD#) 5.0 3.2 1.0
assign (residue 5 and name HB#) (residue 5 and name HA) 4.5 2.7 1.0
assign (residue 5 and name HG2) (residue 8 and name HA) 5.5 3.7 1.0
assign (residue 7 and name HB#) (residue 9 and name HA) 4.5 2.7 1.0
assign (residue 7 and name HG#) (residue 3 and name HB2) 4.5 2.7 1.0
assign (residue 7 and name HG#) (residue 10 and name HD#) 4.5 2.7 1.0
assign (residue 7 and name HG#) (residue 11 and name HE#) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 5 and name HA) 5.5 3.7 1.0
assign (residue 8 and name HB#) (residue 5 and name HB#) 5.5 3.7 1.0
assign (residue 8 and name HB#) (residue 5 and name HG1) 5.5 3.7 1.0
assign (residue 8 and name HB#) (residue 5 and name HG2) 5.5 3.7 1.0
assign (residue 8 and name HB#) (residue 11 and name HE#) 6.0 4.2 1.0
assign (residue 9 and name HA) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 10 and name HB1) (residue 11 and name HE#) 5.5 3.7 1.0 
assign (residue 10 and name HG#) (residue 10 and name HA) 4.5 2.7 1.0
assign (residue 10 and name HD#) (residue 10 and name HA) 4.5 2.7 1.0
assign (residue 10 and name HD#) (residue 13 and name HA) 4.5 2.7 1.0
assign (residue 11 and name HB1) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 11 and name HE#) (residue 10 and name HD#) 4.5 2.7 1.0
assign (residue 12 and name HA) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 12 and name HB2) (residue 2 and name HD#) 4.5 2.7 1.0
assign (residue 12 and name HB2) (residue 2 and name HE#) 4.5 2.7 1.0
assign (residue 12 and name HB2) (residue 13 and name HA) 6.0 4.2 1.0
assign (residue 12 and name HG#) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 12 and name HG#) (residue 16 and name HB2) 4.5 2.7 1.0
assign (residue 13 and name HA) (residue 2 and name HD#) 6.0 4.2 1.0
assign (residue 13 and name HA) (residue 11 and name HD#) 5.5 3.7 1.0
assign (residue 13 and name HA) (residue 11 and name HE#) 5.5 3.7 1.0
assign (residue 13 and name HB) (residue 13 and name HA) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 7 and name HG#) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 10 and name HA) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 10 and name HD#) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 13 and name HB) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 13 and name HG11) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 13 and name HG12) 4.5 2.7 1.0
assign (residue 13 and name HG11) (residue 10 and name HD#) 4.5 2.7 1.0
assign (residue 13 and name HG11) (residue 13 and name HA) 4.5 2.7 1.0
assign (residue 13 and name HG11) (residue 13 and name HB) 4.5 2.7 1.0
assign (residue 13 and name HG12) (residue 10 and name HD#) 4.5 2.7 1.0
assign (residue 13 and name HG12) (residue 13 and name HA) 4.5 2.7 1.0
assign (residue 13 and name HG12) (residue 13 and name HB) 4.5 2.7 1.0
assign (residue 13 and name HG2#) (residue 7 and name HA) 6.0 4.2 1.0
assign (residue 13 and name HG2#) (residue 7 and name HG#) 4.5 2.7 1.0
assign (residue 13 and name HG2#) (residue 10 and name HD#) 4.5 2.7 1.0
assign (residue 13 and name HG2#) (residue 13 and name HA) 4.5 2.7 1.0
assign (residue 13 and name HG2#) (residue 13 and name HG11) 4.5 2.7 1.0
assign (residue 2 and name HA) (residue 2 and name HD#) 4.5 2.7 1.0
assign (residue 11 and name HA) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 15 and name HB) (residue 2 and name HA) 6.0 4.2 1.0
assign (residue 15 and name HB) (residue 15 and name HA) 4.5 2.7 1.0
assign (residue 15 and name HG1#) (residue 2 and name HA) 6.0 4.2 1.0
assign (residue 15 and name HG2#) (residue 2 and name HD#) 6.0 4.2 1.0
assign (residue 16 and name HA) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 16 and name HA) (residue 11 and name HE#) 4.5 2.7 1.0
assign (residue 16 and name HB1) (residue 12 and name HB2) 4.5 2.7 1.0
assign (residue 2 and name HB#) (residue 12 and name HB2) 5.0 3.2 1.0
assign (residue 2 and name HE#) (residue 9 and name HB1) 5.0 3.2 1.0
assign (residue 4 and name HA) (residue 2 and name HD#) 5.0 3.2 1.0
assign (residue 4 and name HA) (residue 2 and name HZ) 5.0 3.2 1.0
assign (residue 4 and name HB) (residue 2 and name HE#) 5.0 3.2 1.0
assign (residue 4 and name HB) (residue 5 and name HA) 5.0 3.2 1.0
assign (residue 4 and name HG1#) (residue 5 and name HA) 5.0 3.2 1.0
assign (residue 4 and name HG1#) (residue 5 and name HB#) 5.0 3.2 1.0
assign (residue 4 and name HG1#) (residue 5 and name HG1) 5.0 3.2 1.0
assign (residue 4 and name HG1#) (residue 12 and name HA) 5.0 3.2 1.0
assign (residue 4 and name HG2#) (residue 5 and name HB#) 5.0 3.2 1.0
assign (residue 4 and name HG2#) (residue 5 and name HG1) 5.0 3.2 1.0
assign (residue 5 and name HA) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 5 and name HB#) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 5 and name HB#) (residue 4 and name HB) 5.0 3.2 1.0
assign (residue 5 and name HB#) (residue 8 and name HA) 5.5 3.7 1.0
assign (residue 5 and name HG#) (residue 2 and name HE#) 5.0 3.2 1.0
assign (residue 5 and name HG#) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 2 and name HB#) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 2 and name HD#) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 9 and name HA) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 10 and name HA) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 11 and name HZ) 5.0 3.2 1.0
assign (residue 7 and name HG#) (residue 13 and name HB) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 3 and name HB1) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 7 and name HB#) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 9 and name HA) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 9 and name HB1) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 10 and name HD#) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 11 and name HD#) 6.0 4.2 1.0
assign (residue 8 and name HB#) (residue 11 and name HZ) 5.0 3.2 1.0
assign (residue 10 and name HA) (residue 11 and name HD#) 5.0 3.2 1.0
assign (residue 10 and name HA) (residue 11 and name HE#) 5.0 3.2 1.0
assign (residue 10 and name HB1) (residue 11 and name HD#) 5.5 3.7 1.0
assign (residue 13 and name HB) (residue 12 and name HA) 5.0 3.2 1.0
assign (residue 13 and name HB) (residue 14 and name HA) 5.0 3.2 1.0
assign (residue 10 and name HD#) (residue 11 and name HZ) 5.5 3.7 1.0
assign (residue 11 and name HB1) (residue 11 and name HZ) 5.0 3.2 1.0
assign (residue 11 and name HB2) (residue 12 and name HA) 5.0 3.2 1.0
assign (residue 12 and name HA) (residue 2 and name HD#) 5.0 3.2 1.0
assign (residue 12 and name HA) (residue 11 and name HZ) 5.0 3.2 1.0
assign (residue 12 and name HB2) (residue 11 and name HD#) 5.0 3.2 1.0
assign (residue 12 and name HB2) (residue 11 and name HE#) 5.0 3.2 1.0
assign (residue 12 and name HG#) (residue 11 and name HA) 5.0 3.2 1.0
assign (residue 12 and name HG#) (residue 2 and name HD#) 5.0 3.2 1.0
assign (residue 13 and name HA) (residue 2 and name HE#) 6.0 4.2 1.0
assign (residue 13 and name HA) (residue 11 and name HZ) 6.0 4.2 1.0
assign (residue 13 and name HD#) (residue 9 and name HD21) 5.0 3.2 1.0
assign (residue 13 and name HD#) (residue 9 and name HA) 5.0 3.2 1.0
assign (residue 13 and name HD#) (residue 10 and name HB2) 5.0 3.2 1.0
assign (residue 13 and name HD#) (residue 14 and name HB#) 5.0 3.2 1.0
assign (residue 13 and name HD#) (residue 16 and name HA) 6.0 4.2 1.0
assign (residue 13 and name HG11) (residue 10 and name HA) 5.0 3.2 1.0
assign (residue 13 and name HG2#) (residue 10 and name HA) 5.0 3.2 1.0
assign (residue 13 and name HG2#) (residue 10 and name HB2) 5.5 3.7 1.0
assign (residue 13 and name HG2#) (residue 14 and name HB#) 5.0 3.2 1.0
assign (residue 13 and name HG2#) (residue 14 and name HB#) 5.0 3.2 1.0
assign (residue 15 and name HA) (residue 2 and name HD#) 6.0 4.2 1.0
assign (residue 16 and name HB2) (residue 11 and name HD#) 6.0 4.2 1.0
assign (residue 16 and name HB2) (residue 11 and name HE#) 6.0 4.2 1.0
assign (residue 16 and name HB2) (residue 12 and name HB2) 5.0 3.2 1.0
assign (residue 2 and name HA) (residue 2 and name HN) 2.5 0.7 0.8
assign (residue 5 and name HE22) (residue 5 and name HE21) 2.5 0.7 0.8
assign (residue 9 and name HD22) (residue 9 and name HD21) 2.5 0.7 0.8
assign (residue 2 and name HB#) (residue 2 and name HN) 3.5 1.7 1.0
assign (residue 3 and name HB1) (residue 3 and name HN) 3.5 1.7 1.0
assign (residue 3 and name HB2) (residue 3 and name HN) 3.5 1.7 1.0
assign (residue 4 and name HA) (residue 5 and name HN) 3.5 1.7 1.0
assign (residue 4 and name HG2#) (residue 4 and name HN) 3.5 1.7 1.0
assign (residue 4 and name HG2#) (residue 9 and name HN) 3.5 1.7 1.0
assign (residue 5 and name HA) (residue 5 and name HN) 3.5 1.7 1.0
assign (residue 5 and name HA) (residue 6 and name HN) 3.5 1.7 1.0
assign (residue 6 and name HA1) (residue 6 and name HN) 3.5 1.7 1.0
assign (residue 6 and name HA1) (residue 7 and name HN) 3.5 1.7 1.0
assign (residue 6 and name HA2) (residue 6 and name HN) 3.5 1.7 1.0
assign (residue 7 and name HB#) (residue 4 and name HN) 3.5 1.7 1.0
assign (residue 7 and name HB#) (residue 7 and name HN) 3.5 1.7 1.0
assign (residue 7 and name HG#) (residue 7 and name HN) 3.5 1.7 1.0
assign (residue 7 and name HN) (residue 8 and name HN) 3.5 1.7 1.0
assign (residue 8 and name HA) (residue 9 and name HN) 3.5 1.7 1.0
assign (residue 8 and name HB#) (residue 8 and name HN) 3.5 1.7 1.0
assign (residue 8 and name HB#) (residue 9 and name HN) 3.5 1.7 1.0
assign (residue 8 and name HN) (residue 9 and name HN) 3.5 1.7 1.0
assign (residue 7 and name HN) (residue 6 and name HN) 3.5 1.7 1.0
assign (residue 9 and name HN) (residue 8 and name HN) 3.5 1.7 1.0
assign (residue 10 and name HA) (residue 11 and name HN) 3.5 1.7 1.0
assign (residue 10 and name HB2) (residue 10 and name HN) 3.5 1.7 1.0
assign (residue 11 and name HB1) (residue 11 and name HD#) 3.5 1.7 1.0
assign (residue 11 and name HB1) (residue 11 and name HN) 3.5 1.7 1.0
assign (residue 11 and name HB2) (residue 11 and name HD#) 3.5 1.7 1.0
assign (residue 11 and name HB2) (residue 11 and name HE#) 3.5 1.7 1.0
assign (residue 11 and name HB2) (residue 11 and name HN) 3.5 1.7 1.0
assign (residue 11 and name HD#) (residue 11 and name HE#) 3.5 1.7 1.0
assign (residue 11 and name HN) (residue 10 and name HN) 3.5 1.7 1.0
assign (residue 12 and name HG#) (residue 12 and name HN) 3.5 1.7 1.0
assign (residue 13 and name HB) (residue 13 and name HN) 3.5 1.7 1.0
assign (residue 13 and name HB) (residue 14 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HG2#) (residue 14 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HN) (residue 12 and name HN) 3.5 1.7 1.0
assign (residue 13 and name HN) (residue 14 and name HN) 3.5 1.7 1.0
assign (residue 14 and name HB#) (residue 15 and name HN) 3.5 1.7 1.0
assign (residue 15 and name HA) (residue 15 and name HN) 3.5 1.7 1.0
assign (residue 15 and name HA) (residue 16 and name HN) 3.5 1.7 1.0
assign (residue 4 and name HG1#) (residue 5 and name HN) 3.5 1.7 1.0
assign (residue 15 and name HG1#) (residue 11 and name HE#) 6.0 4.2 1.0
assign (residue 15 and name HN) (residue 14 and name HN) 3.5 1.7 1.0
assign (residue 16 and name HB2) (residue 16 and name HN) 3.5 1.7 1.0
assign (residue 4 and name HA) (residue 4 and name HN) 4.5 2.7 1.0
assign (residue 4 and name HB) (residue 4 and name HN) 4.5 2.7 1.0
assign (residue 4 and name HB) (residue 5 and name HN) 4.5 2.7 1.0
assign (residue 4 and name HG1#) (residue 4 and name HN) 4.5 2.7 1.0
assign (residue 4 and name HG2#) (residue 9 and name HD21) 4.5 2.7 1.0
assign (residue 5 and name HB#) (residue 5 and name HN) 4.5 2.7 1.0
assign (residue 5 and name HB#) (residue 6 and name HN) 4.5 2.7 1.0
assign (residue 5 and name HG#) (residue 6 and name HN) 4.5 2.7 1.0
assign (residue 5 and name HG#) (residue 8 and name HN) 5.5 3.7 1.0
assign (residue 5 and name HN) (residue 4 and name HN) 4.5 2.7 1.0
assign (residue 5 and name HN) (residue 6 and name HN) 4.5 2.7 1.0
assign (residue 7 and name HA) (residue 7 and name HN) 4.5 2.7 1.0
assign (residue 7 and name HA) (residue 8 and name HN) 4.5 2.7 1.0
assign (residue 7 and name HB#) (residue 8 and name HN) 4.5 2.7 1.0
assign (residue 7 and name HB#) (residue 9 and name HN) 4.5 2.7 1.0
assign (residue 7 and name HG#) (residue 2 and name HN) 4.5 2.7 1.0
assign (residue 7 and name HG#) (residue 4 and name HN) 4.5 2.7 1.0
assign (residue 8 and name HA) (residue 8 and name HN) 4.5 2.7 1.0
assign (residue 9 and name HA) (residue 9 and name HN) 4.5 2.7 1.0
assign (residue 9 and name HB1) (residue 9 and name HD21) 4.5 2.7 1.0
assign (residue 9 and name HB1) (residue 9 and name HD22) 4.5 2.7 1.0
assign (residue 9 and name HB1) (residue 9 and name HN) 4.5 2.7 1.0
assign (residue 9 and name HB2) (residue 9 and name HD21) 4.5 2.7 1.0
assign (residue 9 and name HB2) (residue 9 and name HN) 4.5 2.7 1.0
assign (residue 10 and name HA) (residue 10 and name HN) 4.5 2.7 1.0
assign (residue 10 and name HB1) (residue 10 and name HN) 4.5 2.7 1.0
assign (residue 10 and name HB1) (residue 11 and name HN) 4.5 2.7 1.0
assign (residue 10 and name HG#) (residue 10 and name HN) 4.5 2.7 1.0
assign (residue 10 and name HG#) (residue 11 and name HN) 4.5 2.7 1.0
assign (residue 12 and name HA) (residue 12 and name HN) 4.5 2.7 1.0
assign (residue 12 and name HA) (residue 13 and name HN) 4.5 2.7 1.0
assign (residue 12 and name HB2) (residue 12 and name HN) 4.5 2.7 1.0
assign (residue 12 and name HG#) (residue 11 and name HE#) 4.5 2.7 1.0
assign (residue 13 and name HA) (residue 13 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HA) (residue 14 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HB) (residue 13 and name HA) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 11 and name HD#) 4.5 2.7 1.0
assign (residue 13 and name HD#) (residue 13 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HG11) (residue 13 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HG12) (residue 13 and name HN) 4.5 2.7 1.0
assign (residue 13 and name HG2#) (residue 13 and name HN) 4.5 2.7 1.0
assign (residue 14 and name HB#) (residue 14 and name HD21) 4.5 2.7 1.0
assign (residue 14 and name HB#) (residue 14 and name HN) 4.5 2.7 1.0
assign (residue 15 and name HB) (residue 15 and name HN) 4.5 2.7 1.0
assign (residue 15 and name HG1#) (residue 16 and name HN) 4.5 2.7 1.0
assign (residue 15 and name HG2#) (residue 9 and name HD22) 4.5 2.7 1.0
assign (residue 15 and name HG2#) (residue 15 and name HN) 4.5 2.7 1.0
assign (residue 16 and name HA) (residue 11 and name HE#) 4.5 2.7 1.0
assign (residue 16 and name HA) (residue 16 and name HN) 4.5 2.7 1.0
assign (residue 16 and name HB1) (residue 16 and name HN) 4.5 2.7 1.0
assign (residue 4 and name HA) (residue 6 and name HN) 5.0 3.2 1.0
assign (residue 5 and name HB#) (residue 8 and name HN) 5.5 3.7 1.0
assign (residue 11 and name HD#) (residue 11 and name HN) 5.0 3.2 1.0
assign (residue 13 and name HB) (residue 15 and name HN) 5.5 3.7 1.0
assign (residue 14 and name HB#) (residue 9 and name HD22) 5.0 3.2 1.0
assign (residue 15 and name HG1#) (residue 9 and name HD22) 5.0 3.2 1.0
assign (residue 15 and name HG1#) (residue 15 and name HN) 5.0 3.2 1.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   PHE   1           HT1      PHE   1  14.204  -2.529   6.208
    2    H2   PHE   1           HT2      PHE   1  13.324  -2.101   4.819
    3    H3   PHE   1           HT3      PHE   1  13.831  -3.708   5.048
    4    HA   PHE   1           HA       PHE   1  12.155  -4.209   6.432
    5    HB2  PHE   1           HB2      PHE   1  13.000  -2.727   8.194
    6    HB3  PHE   1           HB1      PHE   1  12.299  -1.329   7.377
    7    HD1  PHE   1           HD1      PHE   1  11.447  -4.576   9.001
    8    HD2  PHE   1           HD2      PHE   1  10.020  -0.749   7.671
    9    HE1  PHE   1           HE1      PHE   1   9.284  -4.986  10.142
   10    HE2  PHE   1           HE2      PHE   1   7.857  -1.160   8.812
   11    HZ   PHE   1           HZ       PHE   1   7.488  -3.278  10.047
   12    H    PHE   2           HN       PHE   2  11.926  -0.975   4.964
   13    HA   PHE   2           HA       PHE   2   9.124  -1.439   4.268
   14    HB2  PHE   2           HB2      PHE   2   9.454   0.767   4.996
   15    HB3  PHE   2           HB1      PHE   2  10.970   0.928   4.109
   16    HD1  PHE   2           HD1      PHE   2   7.549  -0.259   3.104
   17    HD2  PHE   2           HD2      PHE   2  10.744   2.537   2.453
   18    HE1  PHE   2           HE1      PHE   2   6.330   0.684   1.158
   19    HE2  PHE   2           HE2      PHE   2   9.527   3.479   0.511
   20    HZ   PHE   2           HZ       PHE   2   7.319   2.554  -0.137
   21    H    CYS   3           HN       CYS   3   9.417  -3.144   2.751
   22    HA   CYS   3           HA       CYS   3  10.907  -2.490   0.319
   23    HB2  CYS   3           HB2      CYS   3   9.901  -4.970   1.577
   24    HB3  CYS   3           HB1      CYS   3   9.850  -4.924  -0.185
   25    H    VAL   4           HN       VAL   4   9.851  -1.325  -1.142
   26    HA   VAL   4           HA       VAL   4   7.040  -1.058  -1.280
   27    HB   VAL   4           HB       VAL   4   7.680  -0.149  -3.658
   28   HG11  VAL   4          HG11      VAL   4   9.017   1.338  -1.439
   29   HG12  VAL   4          HG12      VAL   4   7.294   0.999  -1.279
   30   HG13  VAL   4          HG13      VAL   4   7.887   1.925  -2.659
   31   HG21  VAL   4          HG21      VAL   4   9.966  -1.350  -3.421
   32   HG22  VAL   4          HG22      VAL   4  10.384  -0.040  -2.314
   33   HG23  VAL   4          HG23      VAL   4   9.979   0.317  -3.995
   34    H    GLN   5           HN       GLN   5   9.337  -3.029  -3.126
   35    HA   GLN   5           HA       GLN   5   7.345  -4.999  -3.705
   36    HB2  GLN   5           HB2      GLN   5   7.873  -4.544  -6.311
   37    HB3  GLN   5           HB1      GLN   5   6.469  -3.870  -5.485
   38    HG2  GLN   5           HG2      GLN   5   7.724  -1.808  -5.005
   39    HG3  GLN   5           HG1      GLN   5   9.146  -2.480  -5.803
   40   HE21  GLN   5          HE21      GLN   5   7.386  -0.083  -6.538
   41   HE22  GLN   5          HE22      GLN   5   6.932  -0.379  -8.149
   42    H    GLY   6           HN       GLY   6   8.798  -6.509  -2.981
   43    HA2  GLY   6           HA2      GLY   6  10.477  -8.075  -3.200
   44    HA3  GLY   6           HA1      GLY   6  10.738  -7.470  -4.834
   45    H    DBB   7           HN       DBB   7  10.854  -5.243  -2.191
   46    HA   DBB   7           HA       DBB   7  13.638  -5.438  -1.604
   47    HB2  DBB   7           HB2      DBB   7  11.572  -3.290  -1.140
   48    HG1  DBB   7           HG1      DBB   7  14.419  -3.019  -1.163
   49    HG2  DBB   7           HG2      DBB   7  13.876  -2.951   0.513
   50    HG3  DBB   7           HG3      DBB   7  13.216  -1.826  -0.674
   51    H    ALA   8           HN       ALA   8  11.718  -3.270  -3.664
   52    HA   ALA   8           HA       ALA   8  14.189  -2.600  -5.132
   53    HB1  ALA   8           HB1      ALA   8  12.760  -3.487  -6.724
   54    HB2  ALA   8           HB2      ALA   8  12.359  -1.773  -6.836
   55    HB3  ALA   8           HB3      ALA   8  11.315  -2.864  -5.925
   56    H    ASN   9           HN       ASN   9  13.208  -1.332  -2.614
   57    HA   ASN   9           HA       ASN   9  12.013   1.150  -3.034
   58    HB2  ASN   9           HB2      ASN   9  12.673  -0.037  -0.830
   59    HB3  ASN   9           HB1      ASN   9  14.227   0.764  -1.032
   60   HD21  ASN   9          HD21      ASN   9  11.538   1.168   0.700
   61   HD22  ASN   9          HD22      ASN   9  11.381   2.861   0.672
   62    H    ARG  10           HN       ARG  10  15.416   1.125  -2.116
   63    HA   ARG  10           HA       ARG  10  17.218   2.306  -2.890
   64    HB2  ARG  10           HB2      ARG  10  16.117   2.659  -5.610
   65    HB3  ARG  10           HB1      ARG  10  17.687   2.044  -5.101
   66    HG2  ARG  10           HG2      ARG  10  15.054   0.538  -5.083
   67    HG3  ARG  10           HG1      ARG  10  16.448   0.226  -6.113
   68    HD2  ARG  10           HD2      ARG  10  16.548   0.068  -3.094
   69    HD3  ARG  10           HD1      ARG  10  16.248  -1.321  -4.133
   70    HE   ARG  10           HE       ARG  10  18.586  -0.044  -5.032
   71   HH11  ARG  10          HH11      ARG  10  17.362  -1.761  -2.290
   72   HH12  ARG  10          HH12      ARG  10  18.902  -2.412  -1.839
   73   HH21  ARG  10          HH21      ARG  10  20.605  -0.895  -4.451
   74   HH22  ARG  10          HH22      ARG  10  20.739  -1.922  -3.064
   75    H    PHE  11           HN       PHE  11  15.436   3.836  -1.567
   76    HA   PHE  11           HA       PHE  11  16.043   6.436  -2.284
   77    HB2  PHE  11           HB2      PHE  11  13.911   7.265  -3.228
   78    HB3  PHE  11           HB1      PHE  11  14.692   6.101  -4.301
   79    HD1  PHE  11           HD1      PHE  11  12.350   6.051  -1.351
   80    HD2  PHE  11           HD2      PHE  11  13.342   4.476  -5.219
   81    HE1  PHE  11           HE1      PHE  11  10.354   4.584  -1.258
   82    HE2  PHE  11           HE2      PHE  11  11.350   3.006  -5.133
   83    HZ   PHE  11           HZ       PHE  11   9.861   3.054  -3.157
   84    H    DBB  12           HN       DBB  12  14.175   4.129  -0.641
   85    HA   DBB  12           HA       DBB  12  12.332   5.396   0.881
   86    HB2  DBB  12           HB2      DBB  12  13.908   5.823   2.996
   87    HG1  DBB  12           HG1      DBB  12  15.798   5.323   1.033
   88    HG2  DBB  12           HG2      DBB  12  16.100   6.183   2.544
   89    HG3  DBB  12           HG3      DBB  12  15.731   7.084   1.074
   90    H    ILE  13           HN       ILE  13  15.034   3.249   0.728
   91    HA   ILE  13           HA       ILE  13  13.908   0.892   1.303
   92    HB   ILE  13           HB       ILE  13  16.488   1.457   2.710
   93   HG12  ILE  13          HG12      ILE  13  17.399   1.081   0.226
   94   HG13  ILE  13          HG11      ILE  13  15.876   1.867  -0.189
   95   HG21  ILE  13          HG21      ILE  13  17.014  -0.735   2.032
   96   HG22  ILE  13          HG22      ILE  13  15.852  -0.700   0.705
   97   HG23  ILE  13          HG23      ILE  13  15.285  -0.833   2.370
   98   HD11  ILE  13          HD11      ILE  13  16.758   3.471   1.844
   99   HD12  ILE  13          HD12      ILE  13  17.042   3.794   0.134
  100   HD13  ILE  13          HD13      ILE  13  18.283   2.993   1.097
  101    H    ASN  14           HN       ASN  14  15.083   3.137   3.808
  102    HA   ASN  14           HA       ASN  14  14.400   1.541   6.026
  103    HB2  ASN  14           HB2      ASN  14  14.763   4.506   5.649
  104    HB3  ASN  14           HB1      ASN  14  14.312   3.825   7.212
  105   HD21  ASN  14          HD21      ASN  14  16.838   5.146   6.786
  106   HD22  ASN  14          HD22      ASN  14  18.066   3.985   6.949
  107    H    VAL  15           HN       VAL  15  12.571   3.956   4.206
  108    HA   VAL  15           HA       VAL  15  10.078   2.928   4.347
  109    HB   VAL  15           HB       VAL  15  10.089   2.723   6.721
  110   HG11  VAL  15          HG11      VAL  15  12.015   4.407   6.947
  111   HG12  VAL  15          HG12      VAL  15  10.799   4.429   8.224
  112   HG13  VAL  15          HG13      VAL  15  10.772   5.658   6.959
  113   HG21  VAL  15          HG21      VAL  15   8.667   5.331   6.584
  114   HG22  VAL  15          HG22      VAL  15   8.089   3.763   7.149
  115   HG23  VAL  15          HG23      VAL  15   8.164   4.105   5.421
  116    H    CYS  16           HN       CYS  16  12.149   5.330   3.710
  117    HA   CYS  16           HA       CYS  16  10.218   7.499   3.496
  118    HB2  CYS  16           HB2      CYS  16  12.015   8.880   3.374
  119    HB3  CYS  16           HB1      CYS  16  12.873   7.491   4.038
  Start of MODEL    2
    1    H1   PHE   1           HT1      PHE   1  13.025  -1.623   6.918
    2    H2   PHE   1           HT2      PHE   1  13.254  -2.973   5.911
    3    H3   PHE   1           HT3      PHE   1  13.737  -3.032   7.538
    4    HA   PHE   1           HA       PHE   1  11.713  -4.253   7.327
    5    HB2  PHE   1           HB2      PHE   1  11.289  -1.513   8.560
    6    HB3  PHE   1           HB1      PHE   1  10.288  -2.931   8.875
    7    HD1  PHE   1           HD1      PHE   1  13.495  -1.296   9.516
    8    HD2  PHE   1           HD2      PHE   1  11.229  -4.906  10.045
    9    HE1  PHE   1           HE1      PHE   1  15.103  -2.051  11.247
   10    HE2  PHE   1           HE2      PHE   1  12.837  -5.662  11.776
   11    HZ   PHE   1           HZ       PHE   1  14.774  -4.234  12.377
   12    H    PHE   2           HN       PHE   2  12.000  -1.548   5.339
   13    HA   PHE   2           HA       PHE   2   9.207  -1.810   4.402
   14    HB2  PHE   2           HB2      PHE   2   9.704   0.449   5.152
   15    HB3  PHE   2           HB1      PHE   2  11.141   0.503   4.131
   16    HD1  PHE   2           HD1      PHE   2   7.978  -1.119   3.125
   17    HD2  PHE   2           HD2      PHE   2  10.448   2.376   2.762
   18    HE1  PHE   2           HE1      PHE   2   6.597  -0.342   1.216
   19    HE2  PHE   2           HE2      PHE   2   9.067   3.154   0.855
   20    HZ   PHE   2           HZ       PHE   2   7.141   1.795   0.083
   21    H    CYS   3           HN       CYS   3   9.057  -3.053   2.655
   22    HA   CYS   3           HA       CYS   3  11.131  -2.792   0.573
   23    HB2  CYS   3           HB2      CYS   3  10.430  -5.126   2.068
   24    HB3  CYS   3           HB1      CYS   3   9.918  -5.362   0.396
   25    H    VAL   4           HN       VAL   4  10.356  -2.305  -1.407
   26    HA   VAL   4           HA       VAL   4   7.450  -2.624  -1.858
   27    HB   VAL   4           HB       VAL   4   7.711  -0.710  -3.464
   28   HG11  VAL   4          HG11      VAL   4   7.815  -0.676  -0.556
   29   HG12  VAL   4          HG12      VAL   4   6.869   0.333  -1.650
   30   HG13  VAL   4          HG13      VAL   4   8.524   0.786  -1.243
   31   HG21  VAL   4          HG21      VAL   4  10.051  -0.770  -3.956
   32   HG22  VAL   4          HG22      VAL   4  10.483  -0.731  -2.246
   33   HG23  VAL   4          HG23      VAL   4   9.801   0.701  -3.016
   34    H    GLN   5           HN       GLN   5   6.840  -3.874  -3.512
   35    HA   GLN   5           HA       GLN   5   7.125  -5.506  -5.143
   36    HB2  GLN   5           HB2      GLN   5   8.288  -4.291  -7.215
   37    HB3  GLN   5           HB1      GLN   5   6.646  -3.893  -6.707
   38    HG2  GLN   5           HG2      GLN   5   7.544  -2.049  -5.307
   39    HG3  GLN   5           HG1      GLN   5   9.167  -2.427  -5.881
   40   HE21  GLN   5          HE21      GLN   5   8.002   0.136  -6.369
   41   HE22  GLN   5          HE22      GLN   5   7.717   0.285  -8.043
   42    H    GLY   6           HN       GLY   6   8.691  -6.701  -3.785
   43    HA2  GLY   6           HA2      GLY   6  10.647  -7.888  -3.547
   44    HA3  GLY   6           HA1      GLY   6  10.947  -7.516  -5.243
   45    H    DBB   7           HN       DBB   7  11.148  -6.085  -1.991
   46    HA   DBB   7           HA       DBB   7  13.710  -5.398  -1.773
   47    HB2  DBB   7           HB2      DBB   7  11.295  -3.725  -1.126
   48    HG1  DBB   7           HG1      DBB   7  12.576  -1.925  -0.697
   49    HG2  DBB   7           HG2      DBB   7  13.958  -2.766  -1.396
   50    HG3  DBB   7           HG3      DBB   7  13.631  -2.899   0.328
   51    H    ALA   8           HN       ALA   8  11.491  -2.975  -3.170
   52    HA   ALA   8           HA       ALA   8  13.689  -2.151  -4.971
   53    HB1  ALA   8           HB1      ALA   8  12.188  -1.806  -6.705
   54    HB2  ALA   8           HB2      ALA   8  10.816  -1.610  -5.615
   55    HB3  ALA   8           HB3      ALA   8  11.479  -3.216  -5.916
   56    H    ASN   9           HN       ASN   9  13.041  -1.210  -2.238
   57    HA   ASN   9           HA       ASN   9  12.094   1.523  -2.739
   58    HB2  ASN   9           HB2      ASN   9  11.115   0.305  -0.836
   59    HB3  ASN   9           HB1      ASN   9  12.721   0.118  -0.139
   60   HD21  ASN   9          HD21      ASN   9  11.967   1.397   1.756
   61   HD22  ASN   9          HD22      ASN   9  11.849   3.093   1.633
   62    H    ARG  10           HN       ARG  10  14.203   1.745  -4.005
   63    HA   ARG  10           HA       ARG  10  16.678   1.889  -2.606
   64    HB2  ARG  10           HB2      ARG  10  15.728   3.013  -5.238
   65    HB3  ARG  10           HB1      ARG  10  17.364   3.277  -4.635
   66    HG2  ARG  10           HG2      ARG  10  17.554   1.341  -5.981
   67    HG3  ARG  10           HG1      ARG  10  17.462   0.713  -4.335
   68    HD2  ARG  10           HD2      ARG  10  15.062   0.296  -4.604
   69    HD3  ARG  10           HD1      ARG  10  15.111   0.975  -6.229
   70    HE   ARG  10           HE       ARG  10  16.183  -0.981  -6.979
   71   HH11  ARG  10          HH11      ARG  10  15.787  -0.901  -3.542
   72   HH12  ARG  10          HH12      ARG  10  16.171  -2.576  -3.321
   73   HH21  ARG  10          HH21      ARG  10  16.688  -3.177  -6.696
   74   HH22  ARG  10          HH22      ARG  10  16.681  -3.864  -5.106
   75    H    PHE  11           HN       PHE  11  14.167   4.249  -3.390
   76    HA   PHE  11           HA       PHE  11  15.558   6.558  -2.535
   77    HB2  PHE  11           HB2      PHE  11  13.269   7.555  -2.346
   78    HB3  PHE  11           HB1      PHE  11  13.572   6.772  -3.896
   79    HD1  PHE  11           HD1      PHE  11  11.604   6.728  -0.833
   80    HD2  PHE  11           HD2      PHE  11  12.663   4.474  -4.331
   81    HE1  PHE  11           HE1      PHE  11   9.659   5.235  -0.460
   82    HE2  PHE  11           HE2      PHE  11  10.720   2.983  -3.962
   83    HZ   PHE  11           HZ       PHE  11   9.218   3.361  -2.025
   84    H    DBB  12           HN       DBB  12  13.068   4.628  -0.850
   85    HA   DBB  12           HA       DBB  12  12.429   4.715   1.383
   86    HB2  DBB  12           HB2      DBB  12  13.148   6.390   2.797
   87    HG1  DBB  12           HG1      DBB  12  15.575   7.409   1.822
   88    HG2  DBB  12           HG2      DBB  12  15.746   5.657   1.774
   89    HG3  DBB  12           HG3      DBB  12  15.341   6.460   3.290
   90    H    ILE  13           HN       ILE  13  13.940   2.700   0.262
   91    HA   ILE  13           HA       ILE  13  15.026   0.796   0.971
   92    HB   ILE  13           HB       ILE  13  16.980   2.871   2.005
   93   HG12  ILE  13          HG12      ILE  13  17.133   1.373  -0.611
   94   HG13  ILE  13          HG11      ILE  13  16.224   2.880  -0.489
   95   HG21  ILE  13          HG21      ILE  13  18.489   0.771   1.276
   96   HG22  ILE  13          HG22      ILE  13  17.019  -0.100   1.713
   97   HG23  ILE  13          HG23      ILE  13  17.826   0.923   2.904
   98   HD11  ILE  13          HD11      ILE  13  18.652   3.130  -1.208
   99   HD12  ILE  13          HD12      ILE  13  19.097   2.628   0.423
  100   HD13  ILE  13          HD13      ILE  13  18.166   4.107   0.178
  101    H    ASN  14           HN       ASN  14  13.357   2.578   2.991
  102    HA   ASN  14           HA       ASN  14  13.214   0.750   5.077
  103    HB2  ASN  14           HB2      ASN  14  15.601   1.653   5.425
  104    HB3  ASN  14           HB1      ASN  14  14.823   3.138   5.963
  105   HD21  ASN  14          HD21      ASN  14  15.383   2.917   8.211
  106   HD22  ASN  14          HD22      ASN  14  14.761   1.672   9.183
  107    H    VAL  15           HN       VAL  15  13.123   4.184   4.238
  108    HA   VAL  15           HA       VAL  15  10.408   4.549   4.616
  109    HB   VAL  15           HB       VAL  15  10.651   4.008   6.949
  110   HG11  VAL  15          HG11      VAL  15  12.306   6.095   7.933
  111   HG12  VAL  15          HG12      VAL  15  13.179   5.338   6.602
  112   HG13  VAL  15          HG13      VAL  15  12.628   4.362   7.963
  113   HG21  VAL  15          HG21      VAL  15   9.674   5.945   7.898
  114   HG22  VAL  15          HG22      VAL  15   9.299   6.082   6.180
  115   HG23  VAL  15          HG23      VAL  15  10.618   7.027   6.873
  116    H    CYS  16           HN       CYS  16  10.531   5.995   2.963
  117    HA   CYS  16           HA       CYS  16  12.374   8.267   3.183
  118    HB2  CYS  16           HB2      CYS  16  10.971   6.886   0.991
  119    HB3  CYS  16           HB1      CYS  16  11.022   8.642   0.841
  Start of MODEL    3
    1    H1   PHE   1           HT1      PHE   1  13.022  -2.815   8.399
    2    H2   PHE   1           HT2      PHE   1  11.630  -1.856   8.229
    3    H3   PHE   1           HT3      PHE   1  12.751  -1.965   6.957
    4    HA   PHE   1           HA       PHE   1  12.259  -4.355   6.755
    5    HB2  PHE   1           HB2      PHE   1  10.088  -3.636   8.750
    6    HB3  PHE   1           HB1      PHE   1  10.232  -5.181   7.911
    7    HD1  PHE   1           HD1      PHE   1  11.559  -3.054  10.577
    8    HD2  PHE   1           HD2      PHE   1  12.137  -6.697   8.376
    9    HE1  PHE   1           HE1      PHE   1  13.146  -3.848  12.309
   10    HE2  PHE   1           HE2      PHE   1  13.724  -7.492  10.107
   11    HZ   PHE   1           HZ       PHE   1  14.228  -6.067  12.075
   12    H    PHE   2           HN       PHE   2  11.839  -1.700   5.590
   13    HA   PHE   2           HA       PHE   2   9.142  -1.987   4.431
   14    HB2  PHE   2           HB2      PHE   2   9.461   0.206   5.318
   15    HB3  PHE   2           HB1      PHE   2  11.055   0.347   4.577
   16    HD1  PHE   2           HD1      PHE   2   8.216  -1.216   2.830
   17    HD2  PHE   2           HD2      PHE   2  10.512   2.381   3.334
   18    HE1  PHE   2           HE1      PHE   2   7.181  -0.269   0.784
   19    HE2  PHE   2           HE2      PHE   2   9.476   3.327   1.290
   20    HZ   PHE   2           HZ       PHE   2   7.810   2.004   0.016
   21    H    CYS   3           HN       CYS   3   9.025  -2.966   2.524
   22    HA   CYS   3           HA       CYS   3  11.191  -2.529   0.572
   23    HB2  CYS   3           HB2      CYS   3  10.511  -5.007   1.848
   24    HB3  CYS   3           HB1      CYS   3  10.159  -5.116   0.119
   25    H    VAL   4           HN       VAL   4  10.479  -1.906  -1.366
   26    HA   VAL   4           HA       VAL   4   7.600  -2.198  -1.947
   27    HB   VAL   4           HB       VAL   4   8.203  -0.382  -3.708
   28   HG11  VAL   4          HG11      VAL   4   6.957   0.726  -2.191
   29   HG12  VAL   4          HG12      VAL   4   8.457   1.158  -1.370
   30   HG13  VAL   4          HG13      VAL   4   7.566  -0.283  -0.882
   31   HG21  VAL   4          HG21      VAL   4  10.657  -0.626  -3.441
   32   HG22  VAL   4          HG22      VAL   4  10.517  -0.119  -1.757
   33   HG23  VAL   4          HG23      VAL   4  10.126   1.011  -3.053
   34    H    GLN   5           HN       GLN   5   7.180  -3.864  -3.244
   35    HA   GLN   5           HA       GLN   5   7.185  -5.130  -5.182
   36    HB2  GLN   5           HB2      GLN   5   9.632  -3.553  -6.011
   37    HB3  GLN   5           HB1      GLN   5   8.582  -4.519  -7.044
   38    HG2  GLN   5           HG2      GLN   5   7.689  -2.077  -5.484
   39    HG3  GLN   5           HG1      GLN   5   8.087  -2.083  -7.204
   40   HE21  GLN   5          HE21      GLN   5   5.434  -1.910  -5.409
   41   HE22  GLN   5          HE22      GLN   5   4.364  -2.899  -6.294
   42    H    GLY   6           HN       GLY   6   8.703  -5.647  -2.677
   43    HA2  GLY   6           HA2      GLY   6   9.715  -7.750  -2.153
   44    HA3  GLY   6           HA1      GLY   6  10.449  -7.760  -3.754
   45    H    DBB   7           HN       DBB   7  11.068  -4.787  -3.247
   46    HA   DBB   7           HA       DBB   7  13.621  -5.295  -1.881
   47    HB2  DBB   7           HB2      DBB   7  11.549  -3.269  -1.110
   48    HG1  DBB   7           HG1      DBB   7  13.196  -1.691  -1.232
   49    HG2  DBB   7           HG2      DBB   7  14.484  -2.897  -1.261
   50    HG3  DBB   7           HG3      DBB   7  13.739  -2.438   0.270
   51    H    ALA   8           HN       ALA   8  11.654  -2.978  -3.729
   52    HA   ALA   8           HA       ALA   8  14.108  -2.206  -5.191
   53    HB1  ALA   8           HB1      ALA   8  11.361  -2.839  -6.053
   54    HB2  ALA   8           HB2      ALA   8  12.880  -2.952  -6.943
   55    HB3  ALA   8           HB3      ALA   8  12.057  -1.399  -6.798
   56    H    ASN   9           HN       ASN   9  13.473  -0.971  -2.747
   57    HA   ASN   9           HA       ASN   9  11.956   1.392  -2.998
   58    HB2  ASN   9           HB2      ASN   9  12.938   0.223  -0.882
   59    HB3  ASN   9           HB1      ASN   9  14.355   1.215  -1.205
   60   HD21  ASN   9          HD21      ASN   9  11.760   1.256   0.737
   61   HD22  ASN   9          HD22      ASN   9  11.421   2.926   0.776
   62    H    ARG  10           HN       ARG  10  15.449   1.511  -2.450
   63    HA   ARG  10           HA       ARG  10  17.077   2.856  -3.330
   64    HB2  ARG  10           HB2      ARG  10  15.298   2.508  -5.735
   65    HB3  ARG  10           HB1      ARG  10  16.811   3.411  -5.802
   66    HG2  ARG  10           HG2      ARG  10  17.560   1.292  -6.385
   67    HG3  ARG  10           HG1      ARG  10  17.782   1.243  -4.635
   68    HD2  ARG  10           HD2      ARG  10  15.575   0.163  -4.390
   69    HD3  ARG  10           HD1      ARG  10  15.361   0.204  -6.137
   70    HE   ARG  10           HE       ARG  10  16.964  -1.517  -6.338
   71   HH11  ARG  10          HH11      ARG  10  16.583  -0.381  -3.091
   72   HH12  ARG  10          HH12      ARG  10  17.428  -1.716  -2.379
   73   HH21  ARG  10          HH21      ARG  10  18.071  -3.270  -5.410
   74   HH22  ARG  10          HH22      ARG  10  18.270  -3.351  -3.692
   75    H    PHE  11           HN       PHE  11  15.181   4.133  -1.774
   76    HA   PHE  11           HA       PHE  11  15.615   6.823  -2.273
   77    HB2  PHE  11           HB2      PHE  11  13.454   7.599  -3.148
   78    HB3  PHE  11           HB1      PHE  11  14.235   6.511  -4.293
   79    HD1  PHE  11           HD1      PHE  11  12.026   6.205  -1.268
   80    HD2  PHE  11           HD2      PHE  11  12.843   4.944  -5.291
   81    HE1  PHE  11           HE1      PHE  11  10.055   4.713  -1.196
   82    HE2  PHE  11           HE2      PHE  11  10.873   3.447  -5.221
   83    HZ   PHE  11           HZ       PHE  11   9.471   3.328  -3.176
   84    H    DBB  12           HN       DBB  12  14.570   4.369  -0.457
   85    HA   DBB  12           HA       DBB  12  12.546   5.574   1.150
   86    HB2  DBB  12           HB2      DBB  12  14.110   5.702   3.200
   87    HG1  DBB  12           HG1      DBB  12  16.264   5.154   2.835
   88    HG2  DBB  12           HG2      DBB  12  16.403   6.562   1.782
   89    HG3  DBB  12           HG3      DBB  12  15.964   4.992   1.104
   90    H    ILE  13           HN       ILE  13  15.140   3.237   0.784
   91    HA   ILE  13           HA       ILE  13  13.857   0.919   0.943
   92    HB   ILE  13           HB       ILE  13  16.257   1.216   2.729
   93   HG12  ILE  13          HG12      ILE  13  17.415   0.878   0.325
   94   HG13  ILE  13          HG11      ILE  13  16.016   1.826  -0.183
   95   HG21  ILE  13          HG21      ILE  13  16.738  -0.973   2.022
   96   HG22  ILE  13          HG22      ILE  13  15.758  -0.818   0.562
   97   HG23  ILE  13          HG23      ILE  13  14.978  -0.982   2.136
   98   HD11  ILE  13          HD11      ILE  13  17.300   3.614   0.395
   99   HD12  ILE  13          HD12      ILE  13  18.362   2.642   1.413
  100   HD13  ILE  13          HD13      ILE  13  16.813   3.208   2.040
  101    H    ASN  14           HN       ASN  14  15.157   2.310   3.965
  102    HA   ASN  14           HA       ASN  14  13.600   0.662   5.659
  103    HB2  ASN  14           HB2      ASN  14  15.643   1.741   6.442
  104    HB3  ASN  14           HB1      ASN  14  14.915   3.329   6.213
  105   HD21  ASN  14          HD21      ASN  14  15.811   2.635   8.785
  106   HD22  ASN  14          HD22      ASN  14  14.474   2.381   9.799
  107    H    VAL  15           HN       VAL  15  13.125   3.942   4.413
  108    HA   VAL  15           HA       VAL  15  10.422   3.962   4.175
  109    HB   VAL  15           HB       VAL  15  11.223   4.139   7.024
  110   HG11  VAL  15          HG11      VAL  15   8.930   5.518   7.217
  111   HG12  VAL  15          HG12      VAL  15   9.480   6.139   5.660
  112   HG13  VAL  15          HG13      VAL  15  10.495   6.325   7.091
  113   HG21  VAL  15          HG21      VAL  15   8.423   3.665   6.316
  114   HG22  VAL  15          HG22      VAL  15   9.543   2.636   7.209
  115   HG23  VAL  15          HG23      VAL  15   9.525   2.598   5.446
  116    H    CYS  16           HN       CYS  16  10.985   5.443   2.590
  117    HA   CYS  16           HA       CYS  16  10.751   8.146   3.133
  118    HB2  CYS  16           HB2      CYS  16  12.827   9.022   3.469
  119    HB3  CYS  16           HB1      CYS  16  13.172   7.409   4.095
  Start of MODEL    4
    1    H1   PHE   1           HT1      PHE   1  10.355  -4.844   8.030
    2    H2   PHE   1           HT2      PHE   1  11.988  -5.243   7.786
    3    H3   PHE   1           HT3      PHE   1  10.909  -5.233   6.475
    4    HA   PHE   1           HA       PHE   1  11.242  -2.763   8.010
    5    HB2  PHE   1           HB2      PHE   1  13.187  -2.155   6.610
    6    HB3  PHE   1           HB1      PHE   1  13.547  -3.544   7.636
    7    HD1  PHE   1           HD1      PHE   1  13.303  -2.317   4.247
    8    HD2  PHE   1           HD2      PHE   1  13.344  -5.881   6.645
    9    HE1  PHE   1           HE1      PHE   1  13.844  -3.664   2.236
   10    HE2  PHE   1           HE2      PHE   1  13.886  -7.228   4.634
   11    HZ   PHE   1           HZ       PHE   1  14.135  -6.120   2.430
   12    H    PHE   2           HN       PHE   2  11.825  -1.233   5.753
   13    HA   PHE   2           HA       PHE   2   9.251  -1.336   4.390
   14    HB2  PHE   2           HB2      PHE   2  10.000   0.828   5.188
   15    HB3  PHE   2           HB1      PHE   2  11.515   0.671   4.297
   16    HD1  PHE   2           HD1      PHE   2   8.574  -0.716   2.709
   17    HD2  PHE   2           HD2      PHE   2  10.898   2.865   3.184
   18    HE1  PHE   2           HE1      PHE   2   7.493   0.251   0.698
   19    HE2  PHE   2           HE2      PHE   2   9.817   3.833   1.174
   20    HZ   PHE   2           HZ       PHE   2   8.114   2.527  -0.069
   21    H    CYS   3           HN       CYS   3   9.031  -2.505   2.602
   22    HA   CYS   3           HA       CYS   3  11.198  -2.460   0.610
   23    HB2  CYS   3           HB2      CYS   3  10.341  -4.748   2.137
   24    HB3  CYS   3           HB1      CYS   3   9.988  -5.002   0.428
   25    H    VAL   4           HN       VAL   4  10.489  -2.117  -1.434
   26    HA   VAL   4           HA       VAL   4   7.577  -2.315  -1.913
   27    HB   VAL   4           HB       VAL   4   8.051  -0.480  -3.649
   28   HG11  VAL   4          HG11      VAL   4   7.454  -0.413  -0.882
   29   HG12  VAL   4          HG12      VAL   4   7.066   0.811  -2.090
   30   HG13  VAL   4          HG13      VAL   4   8.574   0.916  -1.183
   31   HG21  VAL   4          HG21      VAL   4  10.415   0.122  -1.880
   32   HG22  VAL   4          HG22      VAL   4  10.041   0.763  -3.479
   33   HG23  VAL   4          HG23      VAL   4  10.607  -0.898  -3.305
   34    H    GLN   5           HN       GLN   5   6.972  -3.632  -3.508
   35    HA   GLN   5           HA       GLN   5   7.119  -5.167  -5.219
   36    HB2  GLN   5           HB2      GLN   5   9.158  -3.324  -6.456
   37    HB3  GLN   5           HB1      GLN   5   7.930  -4.308  -7.255
   38    HG2  GLN   5           HG2      GLN   5   7.353  -1.944  -5.444
   39    HG3  GLN   5           HG1      GLN   5   7.310  -1.902  -7.207
   40   HE21  GLN   5          HE21      GLN   5   5.239  -2.034  -4.679
   41   HE22  GLN   5          HE22      GLN   5   3.997  -2.984  -5.354
   42    H    GLY   6           HN       GLY   6   8.482  -6.200  -3.262
   43    HA2  GLY   6           HA2      GLY   6  10.128  -7.730  -2.761
   44    HA3  GLY   6           HA1      GLY   6  10.511  -7.758  -4.480
   45    H    DBB   7           HN       DBB   7  10.880  -5.633  -1.637
   46    HA   DBB   7           HA       DBB   7  13.607  -5.480  -1.529
   47    HB2  DBB   7           HB2      DBB   7  11.519  -3.390  -0.962
   48    HG1  DBB   7           HG1      DBB   7  13.121  -1.812  -0.842
   49    HG2  DBB   7           HG2      DBB   7  14.341  -2.992  -1.324
   50    HG3  DBB   7           HG3      DBB   7  13.944  -2.781   0.381
   51    H    ALA   8           HN       ALA   8  11.584  -3.061  -3.214
   52    HA   ALA   8           HA       ALA   8  13.877  -2.551  -5.013
   53    HB1  ALA   8           HB1      ALA   8  11.552  -3.686  -5.819
   54    HB2  ALA   8           HB2      ALA   8  12.555  -2.674  -6.857
   55    HB3  ALA   8           HB3      ALA   8  11.162  -1.978  -6.030
   56    H    ASN   9           HN       ASN   9  13.422  -1.163  -2.585
   57    HA   ASN   9           HA       ASN   9  11.955   1.222  -2.878
   58    HB2  ASN   9           HB2      ASN   9  13.073   0.161  -0.773
   59    HB3  ASN   9           HB1      ASN   9  14.480   1.092  -1.262
   60   HD21  ASN   9          HD21      ASN   9  12.407   1.415   1.036
   61   HD22  ASN   9          HD22      ASN   9  11.953   3.053   0.921
   62    H    ARG  10           HN       ARG  10  15.436   1.464  -2.466
   63    HA   ARG  10           HA       ARG  10  17.041   2.651  -3.589
   64    HB2  ARG  10           HB2      ARG  10  15.089   2.190  -5.843
   65    HB3  ARG  10           HB1      ARG  10  16.605   3.063  -6.068
   66    HG2  ARG  10           HG2      ARG  10  17.131   0.818  -6.615
   67    HG3  ARG  10           HG1      ARG  10  17.737   1.024  -4.972
   68    HD2  ARG  10           HD2      ARG  10  15.692   0.007  -4.069
   69    HD3  ARG  10           HD1      ARG  10  15.044  -0.162  -5.699
   70    HE   ARG  10           HE       ARG  10  16.500  -1.965  -6.054
   71   HH11  ARG  10          HH11      ARG  10  17.164  -0.300  -3.093
   72   HH12  ARG  10          HH12      ARG  10  18.232  -1.521  -2.485
   73   HH21  ARG  10          HH21      ARG  10  17.899  -3.570  -5.263
   74   HH22  ARG  10          HH22      ARG  10  18.648  -3.373  -3.714
   75    H    PHE  11           HN       PHE  11  15.000   3.983  -2.064
   76    HA   PHE  11           HA       PHE  11  15.497   6.667  -2.837
   77    HB2  PHE  11           HB2      PHE  11  13.213   7.354  -3.413
   78    HB3  PHE  11           HB1      PHE  11  13.807   6.153  -4.559
   79    HD1  PHE  11           HD1      PHE  11  11.756   6.556  -1.467
   80    HD2  PHE  11           HD2      PHE  11  12.676   4.100  -4.869
   81    HE1  PHE  11           HE1      PHE  11   9.840   5.082  -0.918
   82    HE2  PHE  11           HE2      PHE  11  10.763   2.623  -4.321
   83    HZ   PHE  11           HZ       PHE  11   9.343   3.112  -2.348
   84    H    DBB  12           HN       DBB  12  14.240   4.273  -0.799
   85    HA   DBB  12           HA       DBB  12  12.634   5.517   1.026
   86    HB2  DBB  12           HB2      DBB  12  14.663   6.037   2.723
   87    HG1  DBB  12           HG1      DBB  12  15.795   7.394   0.362
   88    HG2  DBB  12           HG2      DBB  12  16.035   5.648   0.373
   89    HG3  DBB  12           HG3      DBB  12  16.618   6.626   1.718
   90    H    ILE  13           HN       ILE  13  15.569   3.635   0.651
   91    HA   ILE  13           HA       ILE  13  14.609   1.212   1.506
   92    HB   ILE  13           HB       ILE  13  17.401   1.968   2.274
   93   HG12  ILE  13          HG12      ILE  13  17.768   1.429  -0.324
   94   HG13  ILE  13          HG11      ILE  13  16.166   2.159  -0.439
   95   HG21  ILE  13          HG21      ILE  13  16.467  -0.359   0.605
   96   HG22  ILE  13          HG22      ILE  13  16.261  -0.380   2.357
   97   HG23  ILE  13          HG23      ILE  13  17.876  -0.252   1.660
   98   HD11  ILE  13          HD11      ILE  13  17.318   3.960   1.190
   99   HD12  ILE  13          HD12      ILE  13  17.413   4.086  -0.568
  100   HD13  ILE  13          HD13      ILE  13  18.760   3.399   0.340
  101    H    ASN  14           HN       ASN  14  13.167   1.703   3.273
  102    HA   ASN  14           HA       ASN  14  13.756   0.864   5.724
  103    HB2  ASN  14           HB2      ASN  14  15.008   3.518   5.330
  104    HB3  ASN  14           HB1      ASN  14  14.150   3.288   6.853
  105   HD21  ASN  14          HD21      ASN  14  14.668   0.496   7.249
  106   HD22  ASN  14          HD22      ASN  14  16.334   0.297   7.506
  107    H    VAL  15           HN       VAL  15  12.520   3.965   4.473
  108    HA   VAL  15           HA       VAL  15   9.808   3.356   4.844
  109    HB   VAL  15           HB       VAL  15   9.638   5.141   6.839
  110   HG11  VAL  15          HG11      VAL  15  10.259   2.567   8.008
  111   HG12  VAL  15          HG12      VAL  15   9.348   2.356   6.513
  112   HG13  VAL  15          HG13      VAL  15   8.689   3.346   7.815
  113   HG21  VAL  15          HG21      VAL  15  12.328   4.915   6.733
  114   HG22  VAL  15          HG22      VAL  15  11.972   3.584   7.835
  115   HG23  VAL  15          HG23      VAL  15  11.459   5.222   8.238
  116    H    CYS  16           HN       CYS  16  12.386   5.480   4.226
  117    HA   CYS  16           HA       CYS  16  10.842   7.865   3.802
  118    HB2  CYS  16           HB2      CYS  16  12.869   8.811   3.766
  119    HB3  CYS  16           HB1      CYS  16  13.578   7.208   3.962
  Start of MODEL    5
    1    H1   PHE   1           HT1      PHE   1  12.575  -1.461   7.541
    2    H2   PHE   1           HT2      PHE   1  12.895  -2.372   6.142
    3    H3   PHE   1           HT3      PHE   1  13.311  -2.984   7.672
    4    HA   PHE   1           HA       PHE   1  11.384  -4.134   7.205
    5    HB2  PHE   1           HB2      PHE   1   9.678  -3.172   8.685
    6    HB3  PHE   1           HB1      PHE   1  11.280  -2.970   9.396
    7    HD1  PHE   1           HD1      PHE   1   8.453  -1.264   7.768
    8    HD2  PHE   1           HD2      PHE   1  12.352  -0.777   9.503
    9    HE1  PHE   1           HE1      PHE   1   8.113   1.191   7.841
   10    HE2  PHE   1           HE2      PHE   1  12.012   1.679   9.576
   11    HZ   PHE   1           HZ       PHE   1   9.893   2.664   8.745
   12    H    PHE   2           HN       PHE   2  11.802  -1.301   5.499
   13    HA   PHE   2           HA       PHE   2   9.116  -1.396   4.281
   14    HB2  PHE   2           HB2      PHE   2   9.960   0.810   5.067
   15    HB3  PHE   2           HB1      PHE   2  11.309   0.667   3.943
   16    HD1  PHE   2           HD1      PHE   2  10.013   2.992   3.379
   17    HD2  PHE   2           HD2      PHE   2   8.623  -0.953   2.412
   18    HE1  PHE   2           HE1      PHE   2   8.602   3.934   1.574
   19    HE2  PHE   2           HE2      PHE   2   7.215  -0.014   0.599
   20    HZ   PHE   2           HZ       PHE   2   7.202   2.431   0.183
   21    H    CYS   3           HN       CYS   3   8.969  -2.687   2.561
   22    HA   CYS   3           HA       CYS   3  11.145  -2.618   0.580
   23    HB2  CYS   3           HB2      CYS   3  10.437  -4.863   2.187
   24    HB3  CYS   3           HB1      CYS   3   9.929  -5.202   0.533
   25    H    VAL   4           HN       VAL   4  10.418  -2.173  -1.412
   26    HA   VAL   4           HA       VAL   4   7.538  -2.579  -1.945
   27    HB   VAL   4           HB       VAL   4   7.793  -0.708  -3.598
   28   HG11  VAL   4          HG11      VAL   4   7.163  -0.582  -1.014
   29   HG12  VAL   4          HG12      VAL   4   7.324   0.880  -1.987
   30   HG13  VAL   4          HG13      VAL   4   8.650   0.365  -0.945
   31   HG21  VAL   4          HG21      VAL   4  10.532  -0.650  -2.327
   32   HG22  VAL   4          HG22      VAL   4   9.832   0.788  -3.071
   33   HG23  VAL   4          HG23      VAL   4  10.122  -0.656  -4.042
   34    H    GLN   5           HN       GLN   5   7.016  -3.886  -3.566
   35    HA   GLN   5           HA       GLN   5   7.264  -5.399  -5.286
   36    HB2  GLN   5           HB2      GLN   5   9.171  -3.346  -6.414
   37    HB3  GLN   5           HB1      GLN   5   8.127  -4.462  -7.298
   38    HG2  GLN   5           HG2      GLN   5   7.147  -2.240  -5.481
   39    HG3  GLN   5           HG1      GLN   5   7.192  -2.157  -7.243
   40   HE21  GLN   5          HE21      GLN   5   5.003  -2.570  -4.876
   41   HE22  GLN   5          HE22      GLN   5   3.944  -3.678  -5.616
   42    H    GLY   6           HN       GLY   6   8.565  -6.618  -3.526
   43    HA2  GLY   6           HA2      GLY   6  10.325  -8.011  -3.015
   44    HA3  GLY   6           HA1      GLY   6  10.736  -7.921  -4.726
   45    H    DBB   7           HN       DBB   7  10.832  -5.724  -1.907
   46    HA   DBB   7           HA       DBB   7  13.593  -5.489  -1.687
   47    HB2  DBB   7           HB2      DBB   7  11.342  -3.596  -1.051
   48    HG1  DBB   7           HG1      DBB   7  12.790  -1.882  -0.855
   49    HG2  DBB   7           HG2      DBB   7  14.108  -2.912  -1.410
   50    HG3  DBB   7           HG3      DBB   7  13.721  -2.825   0.307
   51    H    ALA   8           HN       ALA   8  11.454  -3.071  -3.214
   52    HA   ALA   8           HA       ALA   8  13.652  -2.453  -5.094
   53    HB1  ALA   8           HB1      ALA   8  11.138  -3.375  -5.728
   54    HB2  ALA   8           HB2      ALA   8  12.199  -2.484  -6.819
   55    HB3  ALA   8           HB3      ALA   8  10.957  -1.631  -5.904
   56    H    ASN   9           HN       ASN   9  13.156  -1.278  -2.433
   57    HA   ASN   9           HA       ASN   9  12.253   1.440  -3.086
   58    HB2  ASN   9           HB2      ASN   9  11.425   0.318  -1.015
   59    HB3  ASN   9           HB1      ASN   9  13.082   0.273  -0.418
   60   HD21  ASN   9          HD21      ASN   9  11.188   1.695   1.077
   61   HD22  ASN   9          HD22      ASN   9  11.482   3.366   0.930
   62    H    ARG  10           HN       ARG  10  13.871   2.492  -4.149
   63    HA   ARG  10           HA       ARG  10  16.612   2.311  -3.096
   64    HB2  ARG  10           HB2      ARG  10  15.823   3.829  -5.562
   65    HB3  ARG  10           HB1      ARG  10  17.358   3.057  -5.178
   66    HG2  ARG  10           HG2      ARG  10  14.779   1.775  -6.060
   67    HG3  ARG  10           HG1      ARG  10  16.392   1.590  -6.746
   68    HD2  ARG  10           HD2      ARG  10  16.944   0.640  -4.331
   69    HD3  ARG  10           HD1      ARG  10  15.210   0.325  -4.303
   70    HE   ARG  10           HE       ARG  10  17.169  -1.110  -5.823
   71   HH11  ARG  10          HH11      ARG  10  13.918   0.080  -5.830
   72   HH12  ARG  10          HH12      ARG  10  13.325  -1.152  -6.895
   73   HH21  ARG  10          HH21      ARG  10  16.398  -2.725  -7.219
   74   HH22  ARG  10          HH22      ARG  10  14.729  -2.739  -7.681
   75    H    PHE  11           HN       PHE  11  13.892   4.256  -2.895
   76    HA   PHE  11           HA       PHE  11  15.338   6.769  -2.551
   77    HB2  PHE  11           HB2      PHE  11  12.977   7.634  -2.113
   78    HB3  PHE  11           HB1      PHE  11  13.281   6.992  -3.729
   79    HD1  PHE  11           HD1      PHE  11  11.526   6.472  -0.553
   80    HD2  PHE  11           HD2      PHE  11  12.469   4.754  -4.374
   81    HE1  PHE  11           HE1      PHE  11   9.756   4.767  -0.225
   82    HE2  PHE  11           HE2      PHE  11  10.704   3.050  -4.049
   83    HZ   PHE  11           HZ       PHE  11   9.347   3.053  -1.973
   84    H    DBB  12           HN       DBB  12  13.152   4.708  -0.650
   85    HA   DBB  12           HA       DBB  12  12.631   4.789   1.609
   86    HB2  DBB  12           HB2      DBB  12  13.351   6.445   3.028
   87    HG1  DBB  12           HG1      DBB  12  15.937   5.903   1.821
   88    HG2  DBB  12           HG2      DBB  12  15.561   6.542   3.420
   89    HG3  DBB  12           HG3      DBB  12  15.675   7.633   2.039
   90    H    ILE  13           HN       ILE  13  14.038   2.809   0.416
   91    HA   ILE  13           HA       ILE  13  15.438   1.034   0.837
   92    HB   ILE  13           HB       ILE  13  17.120   2.784   2.609
   93   HG12  ILE  13          HG12      ILE  13  16.549   4.141   0.623
   94   HG13  ILE  13          HG11      ILE  13  18.238   3.637   0.570
   95   HG21  ILE  13          HG21      ILE  13  17.321   0.204   1.413
   96   HG22  ILE  13          HG22      ILE  13  18.531   1.044   2.383
   97   HG23  ILE  13          HG23      ILE  13  18.510   1.243   0.630
   98   HD11  ILE  13          HD11      ILE  13  17.770   2.863  -1.502
   99   HD12  ILE  13          HD12      ILE  13  16.030   2.955  -1.230
  100   HD13  ILE  13          HD13      ILE  13  16.935   1.544  -0.681
  101    H    ASN  14           HN       ASN  14  13.760   2.729   3.176
  102    HA   ASN  14           HA       ASN  14  13.364   0.457   4.833
  103    HB2  ASN  14           HB2      ASN  14  15.248   2.604   5.784
  104    HB3  ASN  14           HB1      ASN  14  14.290   1.664   6.926
  105   HD21  ASN  14          HD21      ASN  14  14.372  -0.837   5.377
  106   HD22  ASN  14          HD22      ASN  14  15.964  -1.417   5.476
  107    H    VAL  15           HN       VAL  15  13.179   3.927   4.351
  108    HA   VAL  15           HA       VAL  15  10.435   4.150   4.642
  109    HB   VAL  15           HB       VAL  15  10.679   3.471   6.959
  110   HG11  VAL  15          HG11      VAL  15  13.123   4.279   7.030
  111   HG12  VAL  15          HG12      VAL  15  12.161   4.522   8.488
  112   HG13  VAL  15          HG13      VAL  15  12.461   5.872   7.393
  113   HG21  VAL  15          HG21      VAL  15  10.336   6.276   7.592
  114   HG22  VAL  15          HG22      VAL  15   9.121   4.999   7.527
  115   HG23  VAL  15          HG23      VAL  15   9.541   5.893   6.065
  116    H    CYS  16           HN       CYS  16  10.563   5.690   3.068
  117    HA   CYS  16           HA       CYS  16  12.301   8.014   3.480
  118    HB2  CYS  16           HB2      CYS  16  11.107   6.675   1.176
  119    HB3  CYS  16           HB1      CYS  16  10.909   8.426   1.122
  Start of MODEL    6
    1    H1   PHE   1           HT1      PHE   1  13.018  -1.320   6.975
    2    H2   PHE   1           HT2      PHE   1  13.635  -2.406   8.126
    3    H3   PHE   1           HT3      PHE   1  12.003  -1.937   8.184
    4    HA   PHE   1           HA       PHE   1  13.261  -3.495   5.993
    5    HB2  PHE   1           HB2      PHE   1  13.093  -4.840   8.014
    6    HB3  PHE   1           HB1      PHE   1  11.427  -4.313   8.266
    7    HD1  PHE   1           HD1      PHE   1  13.597  -5.971   5.694
    8    HD2  PHE   1           HD2      PHE   1   9.673  -5.589   7.398
    9    HE1  PHE   1           HE1      PHE   1  12.788  -7.814   4.245
   10    HE2  PHE   1           HE2      PHE   1   8.864  -7.430   5.949
   11    HZ   PHE   1           HZ       PHE   1  10.421  -8.543   4.372
   12    H    PHE   2           HN       PHE   2  12.194  -1.510   4.888
   13    HA   PHE   2           HA       PHE   2   9.313  -2.040   4.487
   14    HB2  PHE   2           HB2      PHE   2   9.516   0.192   5.221
   15    HB3  PHE   2           HB1      PHE   2  10.959   0.471   4.245
   16    HD1  PHE   2           HD1      PHE   2   8.002  -1.357   2.994
   17    HD2  PHE   2           HD2      PHE   2  10.094   2.394   3.056
   18    HE1  PHE   2           HE1      PHE   2   6.594  -0.540   1.121
   19    HE2  PHE   2           HE2      PHE   2   8.687   3.212   1.189
   20    HZ   PHE   2           HZ       PHE   2   6.935   1.747   0.222
   21    H    CYS   3           HN       CYS   3   8.771  -2.964   2.631
   22    HA   CYS   3           HA       CYS   3  10.515  -2.527   0.290
   23    HB2  CYS   3           HB2      CYS   3   9.446  -5.055   1.441
   24    HB3  CYS   3           HB1      CYS   3   9.487  -4.919  -0.317
   25    H    VAL   4           HN       VAL   4   9.519  -2.033  -1.600
   26    HA   VAL   4           HA       VAL   4   6.588  -1.708  -1.488
   27    HB   VAL   4           HB       VAL   4   7.173  -0.236  -3.594
   28   HG11  VAL   4          HG11      VAL   4   6.773   1.494  -2.179
   29   HG12  VAL   4          HG12      VAL   4   8.188   1.123  -1.194
   30   HG13  VAL   4          HG13      VAL   4   6.673   0.261  -0.922
   31   HG21  VAL   4          HG21      VAL   4   9.399   0.713  -3.518
   32   HG22  VAL   4          HG22      VAL   4   9.570  -1.043  -3.562
   33   HG23  VAL   4          HG23      VAL   4   9.776  -0.174  -2.040
   34    H    GLN   5           HN       GLN   5   8.991  -3.662  -2.805
   35    HA   GLN   5           HA       GLN   5   7.371  -5.406  -4.149
   36    HB2  GLN   5           HB2      GLN   5   7.840  -4.685  -6.575
   37    HB3  GLN   5           HB1      GLN   5   6.582  -3.816  -5.696
   38    HG2  GLN   5           HG2      GLN   5   8.183  -2.031  -5.145
   39    HG3  GLN   5           HG1      GLN   5   9.458  -2.901  -5.997
   40   HE21  GLN   5          HE21      GLN   5   9.816  -1.689  -7.879
   41   HE22  GLN   5          HE22      GLN   5   8.587  -1.198  -8.951
   42    H    GLY   6           HN       GLY   6   9.010  -6.725  -3.259
   43    HA2  GLY   6           HA2      GLY   6  10.825  -8.132  -3.534
   44    HA3  GLY   6           HA1      GLY   6  11.137  -7.353  -5.082
   45    H    DBB   7           HN       DBB   7  10.814  -5.316  -2.327
   46    HA   DBB   7           HA       DBB   7  13.523  -5.311  -1.448
   47    HB2  DBB   7           HB2      DBB   7  11.259  -3.337  -1.155
   48    HG1  DBB   7           HG1      DBB   7  13.241  -2.827   0.781
   49    HG2  DBB   7           HG2      DBB   7  12.784  -1.785  -0.565
   50    HG3  DBB   7           HG3      DBB   7  14.101  -2.942  -0.755
   51    H    ALA   8           HN       ALA   8  11.661  -3.120  -3.547
   52    HA   ALA   8           HA       ALA   8  14.186  -2.310  -4.836
   53    HB1  ALA   8           HB1      ALA   8  11.397  -1.835  -5.883
   54    HB2  ALA   8           HB2      ALA   8  12.278  -3.331  -6.189
   55    HB3  ALA   8           HB3      ALA   8  12.917  -1.796  -6.776
   56    H    ASN   9           HN       ASN   9  13.213  -1.241  -2.283
   57    HA   ASN   9           HA       ASN   9  12.375   1.489  -2.944
   58    HB2  ASN   9           HB2      ASN   9  11.281   0.311  -1.066
   59    HB3  ASN   9           HB1      ASN   9  12.842   0.169  -0.265
   60   HD21  ASN   9          HD21      ASN   9  11.762   1.476   1.500
   61   HD22  ASN   9          HD22      ASN   9  11.705   3.168   1.333
   62    H    ARG  10           HN       ARG  10  14.490   1.841  -4.050
   63    HA   ARG  10           HA       ARG  10  16.917   1.904  -2.553
   64    HB2  ARG  10           HB2      ARG  10  16.457   3.658  -4.937
   65    HB3  ARG  10           HB1      ARG  10  17.894   2.749  -4.480
   66    HG2  ARG  10           HG2      ARG  10  15.363   1.748  -5.767
   67    HG3  ARG  10           HG1      ARG  10  17.032   1.499  -6.274
   68    HD2  ARG  10           HD2      ARG  10  17.172   0.309  -3.881
   69    HD3  ARG  10           HD1      ARG  10  15.450   0.080  -4.181
   70    HE   ARG  10           HE       ARG  10  17.551  -1.359  -5.426
   71   HH11  ARG  10          HH11      ARG  10  14.554   0.235  -6.094
   72   HH12  ARG  10          HH12      ARG  10  14.155  -0.780  -7.439
   73   HH21  ARG  10          HH21      ARG  10  17.032  -2.700  -7.183
   74   HH22  ARG  10          HH22      ARG  10  15.556  -2.445  -8.054
   75    H    PHE  11           HN       PHE  11  14.490   4.319  -3.392
   76    HA   PHE  11           HA       PHE  11  15.820   6.586  -2.384
   77    HB2  PHE  11           HB2      PHE  11  13.501   7.565  -2.311
   78    HB3  PHE  11           HB1      PHE  11  13.954   6.859  -3.863
   79    HD1  PHE  11           HD1      PHE  11  11.753   6.592  -0.955
   80    HD2  PHE  11           HD2      PHE  11  13.106   4.612  -4.516
   81    HE1  PHE  11           HE1      PHE  11   9.822   5.043  -0.828
   82    HE2  PHE  11           HE2      PHE  11  11.178   3.065  -4.394
   83    HZ   PHE  11           HZ       PHE  11   9.536   3.275  -2.550
   84    H    DBB  12           HN       DBB  12  13.275   4.587  -0.875
   85    HA   DBB  12           HA       DBB  12  12.429   4.688   1.289
   86    HB2  DBB  12           HB2      DBB  12  13.033   6.277   2.828
   87    HG1  DBB  12           HG1      DBB  12  15.557   7.308   2.219
   88    HG2  DBB  12           HG2      DBB  12  15.727   5.565   2.012
   89    HG3  DBB  12           HG3      DBB  12  15.158   6.219   3.548
   90    H    ILE  13           HN       ILE  13  14.035   2.694   0.209
   91    HA   ILE  13           HA       ILE  13  15.024   0.741   0.954
   92    HB   ILE  13           HB       ILE  13  16.888   2.792   2.172
   93   HG12  ILE  13          HG12      ILE  13  17.253   1.325  -0.436
   94   HG13  ILE  13          HG11      ILE  13  16.317   2.820  -0.371
   95   HG21  ILE  13          HG21      ILE  13  18.261   0.484   1.318
   96   HG22  ILE  13          HG22      ILE  13  16.849  -0.106   2.195
   97   HG23  ILE  13          HG23      ILE  13  17.981   0.994   2.983
   98   HD11  ILE  13          HD11      ILE  13  18.199   4.022   0.571
   99   HD12  ILE  13          HD12      ILE  13  18.729   3.205  -0.900
  100   HD13  ILE  13          HD13      ILE  13  19.142   2.534   0.679
  101    H    ASN  14           HN       ASN  14  13.160   2.379   2.862
  102    HA   ASN  14           HA       ASN  14  12.887   0.525   4.895
  103    HB2  ASN  14           HB2      ASN  14  15.215   2.097   5.302
  104    HB3  ASN  14           HB1      ASN  14  14.017   2.627   6.482
  105   HD21  ASN  14          HD21      ASN  14  16.161   0.018   5.600
  106   HD22  ASN  14          HD22      ASN  14  15.751  -1.013   6.885
  107    H    VAL  15           HN       VAL  15  12.900   3.994   4.206
  108    HA   VAL  15           HA       VAL  15  10.145   4.354   4.376
  109    HB   VAL  15           HB       VAL  15  10.315   3.777   6.735
  110   HG11  VAL  15          HG11      VAL  15  12.097   6.156   7.191
  111   HG12  VAL  15          HG12      VAL  15  12.807   4.605   6.745
  112   HG13  VAL  15          HG13      VAL  15  11.845   4.743   8.217
  113   HG21  VAL  15          HG21      VAL  15   8.915   5.458   7.376
  114   HG22  VAL  15          HG22      VAL  15   9.117   6.024   5.718
  115   HG23  VAL  15          HG23      VAL  15  10.102   6.711   7.010
  116    H    CYS  16           HN       CYS  16  10.296   5.856   2.790
  117    HA   CYS  16           HA       CYS  16  12.135   8.124   3.174
  118    HB2  CYS  16           HB2      CYS  16  11.075   6.703   0.838
  119    HB3  CYS  16           HB1      CYS  16  11.025   8.460   0.686
  Start of MODEL    7
    1    H1   PHE   1           HT1      PHE   1  13.030  -3.197   7.428
    2    H2   PHE   1           HT2      PHE   1  12.638  -1.574   7.115
    3    H3   PHE   1           HT3      PHE   1  12.709  -2.696   5.841
    4    HA   PHE   1           HA       PHE   1  10.868  -3.941   7.003
    5    HB2  PHE   1           HB2      PHE   1  11.097  -2.844   9.179
    6    HB3  PHE   1           HB1      PHE   1  10.752  -1.276   8.448
    7    HD1  PHE   1           HD1      PHE   1   9.304  -4.696   8.914
    8    HD2  PHE   1           HD2      PHE   1   8.534  -0.523   8.244
    9    HE1  PHE   1           HE1      PHE   1   6.872  -5.100   9.187
   10    HE2  PHE   1           HE2      PHE   1   6.102  -0.928   8.517
   11    HZ   PHE   1           HZ       PHE   1   5.272  -3.217   8.989
   12    H    PHE   2           HN       PHE   2  11.858  -1.433   5.121
   13    HA   PHE   2           HA       PHE   2   9.146  -0.970   4.032
   14    HB2  PHE   2           HB2      PHE   2  10.272   1.069   4.908
   15    HB3  PHE   2           HB1      PHE   2  11.582   0.803   3.759
   16    HD1  PHE   2           HD1      PHE   2  10.545   3.305   3.336
   17    HD2  PHE   2           HD2      PHE   2   8.750  -0.418   2.168
   18    HE1  PHE   2           HE1      PHE   2   9.252   4.481   1.587
   19    HE2  PHE   2           HE2      PHE   2   7.454   0.758   0.411
   20    HZ   PHE   2           HZ       PHE   2   7.705   3.207   0.117
   21    H    CYS   3           HN       CYS   3   9.186  -2.789   2.661
   22    HA   CYS   3           HA       CYS   3  11.182  -2.644   0.490
   23    HB2  CYS   3           HB2      CYS   3  10.236  -4.856   2.078
   24    HB3  CYS   3           HB1      CYS   3   9.869  -5.134   0.375
   25    H    VAL   4           HN       VAL   4  10.479  -2.241  -1.519
   26    HA   VAL   4           HA       VAL   4   7.572  -2.444  -2.032
   27    HB   VAL   4           HB       VAL   4   7.851  -0.536  -3.593
   28   HG11  VAL   4          HG11      VAL   4   7.035   0.147  -1.505
   29   HG12  VAL   4          HG12      VAL   4   8.462   1.164  -1.705
   30   HG13  VAL   4          HG13      VAL   4   8.535  -0.266  -0.674
   31   HG21  VAL   4          HG21      VAL   4  10.110   0.761  -2.949
   32   HG22  VAL   4          HG22      VAL   4  10.045  -0.392  -4.282
   33   HG23  VAL   4          HG23      VAL   4  10.679  -0.892  -2.714
   34    H    GLN   5           HN       GLN   5   7.006  -3.697  -3.699
   35    HA   GLN   5           HA       GLN   5   7.182  -5.120  -5.498
   36    HB2  GLN   5           HB2      GLN   5   9.439  -3.507  -6.600
   37    HB3  GLN   5           HB1      GLN   5   8.007  -4.142  -7.413
   38    HG2  GLN   5           HG2      GLN   5   8.044  -1.835  -5.442
   39    HG3  GLN   5           HG1      GLN   5   7.864  -1.692  -7.190
   40   HE21  GLN   5          HE21      GLN   5   5.957  -1.163  -4.769
   41   HE22  GLN   5          HE22      GLN   5   4.523  -1.958  -5.233
   42    H    GLY   6           HN       GLY   6   8.387  -6.265  -3.449
   43    HA2  GLY   6           HA2      GLY   6   9.912  -7.904  -2.910
   44    HA3  GLY   6           HA1      GLY   6  10.357  -7.934  -4.612
   45    H    DBB   7           HN       DBB   7  10.714  -5.737  -1.814
   46    HA   DBB   7           HA       DBB   7  13.462  -5.818  -1.562
   47    HB2  DBB   7           HB2      DBB   7  11.470  -3.619  -1.056
   48    HG1  DBB   7           HG1      DBB   7  13.149  -2.116  -1.009
   49    HG2  DBB   7           HG2      DBB   7  14.345  -3.373  -1.328
   50    HG3  DBB   7           HG3      DBB   7  13.847  -3.028   0.328
   51    H    ALA   8           HN       ALA   8  12.215  -2.750  -2.668
   52    HA   ALA   8           HA       ALA   8  14.457  -2.262  -4.344
   53    HB1  ALA   8           HB1      ALA   8  13.790  -3.141  -6.291
   54    HB2  ALA   8           HB2      ALA   8  12.372  -2.092  -6.258
   55    HB3  ALA   8           HB3      ALA   8  12.293  -3.704  -5.546
   56    H    ASN   9           HN       ASN   9  13.362  -0.829  -2.278
   57    HA   ASN   9           HA       ASN   9  11.793   1.332  -3.504
   58    HB2  ASN   9           HB2      ASN   9  11.382   2.107  -1.256
   59    HB3  ASN   9           HB1      ASN   9  11.086   0.371  -1.293
   60   HD21  ASN   9          HD21      ASN   9  11.568   1.176   1.199
   61   HD22  ASN   9          HD22      ASN   9  13.170   0.868   1.690
   62    H    ARG  10           HN       ARG  10  14.281   1.268  -4.554
   63    HA   ARG  10           HA       ARG  10  16.329   2.617  -3.226
   64    HB2  ARG  10           HB2      ARG  10  15.587   2.129  -6.055
   65    HB3  ARG  10           HB1      ARG  10  16.708   3.460  -5.760
   66    HG2  ARG  10           HG2      ARG  10  17.764   1.150  -6.112
   67    HG3  ARG  10           HG1      ARG  10  18.278   2.031  -4.671
   68    HD2  ARG  10           HD2      ARG  10  16.706   0.770  -3.293
   69    HD3  ARG  10           HD1      ARG  10  16.077  -0.053  -4.718
   70    HE   ARG  10           HE       ARG  10  18.635  -0.569  -3.399
   71   HH11  ARG  10          HH11      ARG  10  16.526  -1.029  -6.102
   72   HH12  ARG  10          HH12      ARG  10  17.308  -2.477  -6.642
   73   HH21  ARG  10          HH21      ARG  10  19.658  -2.476  -4.095
   74   HH22  ARG  10          HH22      ARG  10  19.080  -3.296  -5.506
   75    H    PHE  11           HN       PHE  11  15.228   4.195  -1.956
   76    HA   PHE  11           HA       PHE  11  15.469   6.808  -2.716
   77    HB2  PHE  11           HB2      PHE  11  13.084   7.474  -3.176
   78    HB3  PHE  11           HB1      PHE  11  13.827   6.520  -4.461
   79    HD1  PHE  11           HD1      PHE  11  12.097   5.853  -1.196
   80    HD2  PHE  11           HD2      PHE  11  12.474   4.847  -5.354
   81    HE1  PHE  11           HE1      PHE  11  10.327   4.139  -0.938
   82    HE2  PHE  11           HE2      PHE  11  10.700   3.132  -5.099
   83    HZ   PHE  11           HZ       PHE  11   9.627   2.777  -2.891
   84    H    DBB  12           HN       DBB  12  14.644   4.463  -0.604
   85    HA   DBB  12           HA       DBB  12  12.806   5.302   1.202
   86    HB2  DBB  12           HB2      DBB  12  14.502   6.480   2.856
   87    HG1  DBB  12           HG1      DBB  12  16.304   7.503   1.920
   88    HG2  DBB  12           HG2      DBB  12  15.415   7.937   0.461
   89    HG3  DBB  12           HG3      DBB  12  16.092   6.318   0.632
   90    H    ILE  13           HN       ILE  13  14.284   3.001   0.332
   91    HA   ILE  13           HA       ILE  13  14.874   0.988   1.277
   92    HB   ILE  13           HB       ILE  13  16.938   2.123   3.012
   93   HG12  ILE  13          HG12      ILE  13  16.835   4.010   1.477
   94   HG13  ILE  13          HG11      ILE  13  18.252   3.042   1.075
   95   HG21  ILE  13          HG21      ILE  13  17.175   0.510   0.464
   96   HG22  ILE  13          HG22      ILE  13  16.762  -0.213   2.019
   97   HG23  ILE  13          HG23      ILE  13  18.319   0.587   1.804
   98   HD11  ILE  13          HD11      ILE  13  15.805   2.194  -0.318
   99   HD12  ILE  13          HD12      ILE  13  17.424   2.476  -0.959
  100   HD13  ILE  13          HD13      ILE  13  16.321   3.831  -0.719
  101    H    ASN  14           HN       ASN  14  15.822   2.928   4.094
  102    HA   ASN  14           HA       ASN  14  14.842   1.173   5.999
  103    HB2  ASN  14           HB2      ASN  14  15.220   4.166   6.087
  104    HB3  ASN  14           HB1      ASN  14  14.750   3.226   7.502
  105   HD21  ASN  14          HD21      ASN  14  16.437   0.873   6.510
  106   HD22  ASN  14          HD22      ASN  14  18.032   1.323   6.868
  107    H    VAL  15           HN       VAL  15  13.276   4.322   5.449
  108    HA   VAL  15           HA       VAL  15  10.680   3.119   5.059
  109    HB   VAL  15           HB       VAL  15  10.917   4.850   7.501
  110   HG11  VAL  15          HG11      VAL  15   8.938   3.009   7.894
  111   HG12  VAL  15          HG12      VAL  15   8.900   3.172   6.138
  112   HG13  VAL  15          HG13      VAL  15   8.679   4.592   7.162
  113   HG21  VAL  15          HG21      VAL  15  11.096   2.841   8.885
  114   HG22  VAL  15          HG22      VAL  15  12.472   2.913   7.785
  115   HG23  VAL  15          HG23      VAL  15  11.129   1.821   7.447
  116    H    CYS  16           HN       CYS  16  11.612   4.604   3.193
  117    HA   CYS  16           HA       CYS  16  10.113   7.084   3.377
  118    HB2  CYS  16           HB2      CYS  16  11.831   8.496   3.638
  119    HB3  CYS  16           HB1      CYS  16  12.882   7.107   3.900
  Start of MODEL    8
    1    H1   PHE   1           HT1      PHE   1  11.945  -1.458   7.571
    2    H2   PHE   1           HT2      PHE   1  13.286  -2.234   6.873
    3    H3   PHE   1           HT3      PHE   1  12.869  -2.545   8.490
    4    HA   PHE   1           HA       PHE   1  12.220  -4.222   6.626
    5    HB2  PHE   1           HB2      PHE   1  10.265  -4.865   7.994
    6    HB3  PHE   1           HB1      PHE   1  11.637  -4.429   9.013
    7    HD1  PHE   1           HD1      PHE   1   8.332  -3.359   7.765
    8    HD2  PHE   1           HD2      PHE   1  11.632  -2.393  10.340
    9    HE1  PHE   1           HE1      PHE   1   6.963  -1.607   8.863
   10    HE2  PHE   1           HE2      PHE   1  10.261  -0.641  11.439
   11    HZ   PHE   1           HZ       PHE   1   7.927  -0.248  10.699
   12    H    PHE   2           HN       PHE   2  11.977  -1.774   5.238
   13    HA   PHE   2           HA       PHE   2   9.143  -1.825   4.389
   14    HB2  PHE   2           HB2      PHE   2   9.601   0.361   5.178
   15    HB3  PHE   2           HB1      PHE   2  11.182   0.397   4.398
   16    HD1  PHE   2           HD1      PHE   2   8.037  -0.890   2.897
   17    HD2  PHE   2           HD2      PHE   2  10.908   2.304   2.977
   18    HE1  PHE   2           HE1      PHE   2   7.012   0.082   0.860
   19    HE2  PHE   2           HE2      PHE   2   9.883   3.276   0.938
   20    HZ   PHE   2           HZ       PHE   2   7.935   2.165  -0.120
   21    H    CYS   3           HN       CYS   3   8.777  -2.697   2.461
   22    HA   CYS   3           HA       CYS   3  10.762  -2.379   0.324
   23    HB2  CYS   3           HB2      CYS   3  10.032  -4.918   1.641
   24    HB3  CYS   3           HB1      CYS   3   9.997  -4.951  -0.122
   25    H    VAL   4           HN       VAL   4   9.502  -1.200  -1.027
   26    HA   VAL   4           HA       VAL   4   6.708  -1.513  -1.349
   27    HB   VAL   4           HB       VAL   4   7.286  -0.302  -3.615
   28   HG11  VAL   4          HG11      VAL   4   8.071   1.650  -1.745
   29   HG12  VAL   4          HG12      VAL   4   7.034   0.536  -0.852
   30   HG13  VAL   4          HG13      VAL   4   6.432   1.324  -2.310
   31   HG21  VAL   4          HG21      VAL   4   9.781   0.402  -2.098
   32   HG22  VAL   4          HG22      VAL   4   9.442   0.566  -3.820
   33   HG23  VAL   4          HG23      VAL   4   9.781  -1.024  -3.136
   34    H    GLN   5           HN       GLN   5   9.475  -2.757  -3.192
   35    HA   GLN   5           HA       GLN   5   7.730  -4.850  -4.285
   36    HB2  GLN   5           HB2      GLN   5   9.575  -3.160  -5.989
   37    HB3  GLN   5           HB1      GLN   5   8.612  -4.529  -6.544
   38    HG2  GLN   5           HG2      GLN   5   7.466  -2.015  -5.296
   39    HG3  GLN   5           HG1      GLN   5   7.529  -2.332  -7.028
   40   HE21  GLN   5          HE21      GLN   5   5.289  -2.286  -4.732
   41   HE22  GLN   5          HE22      GLN   5   4.349  -3.637  -5.153
   42    H    GLY   6           HN       GLY   6   8.693  -6.538  -3.281
   43    HA2  GLY   6           HA2      GLY   6  10.371  -7.942  -2.509
   44    HA3  GLY   6           HA1      GLY   6  10.910  -7.818  -4.181
   45    H    DBB   7           HN       DBB   7  10.865  -4.903  -2.369
   46    HA   DBB   7           HA       DBB   7  13.670  -5.137  -1.567
   47    HB2  DBB   7           HB2      DBB   7  11.526  -3.072  -1.066
   48    HG1  DBB   7           HG1      DBB   7  13.353  -1.649  -1.189
   49    HG2  DBB   7           HG2      DBB   7  14.502  -2.918  -0.765
   50    HG3  DBB   7           HG3      DBB   7  13.495  -2.186   0.484
   51    H    ALA   8           HN       ALA   8  11.613  -3.056  -3.597
   52    HA   ALA   8           HA       ALA   8  14.024  -2.345  -5.148
   53    HB1  ALA   8           HB1      ALA   8  11.537  -3.350  -5.971
   54    HB2  ALA   8           HB2      ALA   8  12.816  -2.706  -7.001
   55    HB3  ALA   8           HB3      ALA   8  11.527  -1.646  -6.428
   56    H    ASN   9           HN       ASN   9  13.595  -0.966  -2.775
   57    HA   ASN   9           HA       ASN   9  12.087   1.421  -3.099
   58    HB2  ASN   9           HB2      ASN   9  14.340   0.633  -1.254
   59    HB3  ASN   9           HB1      ASN   9  13.597   2.231  -1.201
   60   HD21  ASN   9          HD21      ASN   9  12.807   1.633   1.016
   61   HD22  ASN   9          HD22      ASN   9  11.434   0.647   1.167
   62    H    ARG  10           HN       ARG  10  15.582   1.472  -2.577
   63    HA   ARG  10           HA       ARG  10  17.280   2.588  -3.658
   64    HB2  ARG  10           HB2      ARG  10  15.231   2.524  -5.869
   65    HB3  ARG  10           HB1      ARG  10  16.783   3.341  -6.061
   66    HG2  ARG  10           HG2      ARG  10  17.282   1.199  -6.847
   67    HG3  ARG  10           HG1      ARG  10  17.768   1.079  -5.156
   68    HD2  ARG  10           HD2      ARG  10  15.573   0.104  -4.592
   69    HD3  ARG  10           HD1      ARG  10  15.089   0.219  -6.281
   70    HE   ARG  10           HE       ARG  10  16.432  -1.632  -6.750
   71   HH11  ARG  10          HH11      ARG  10  17.033  -0.378  -3.582
   72   HH12  ARG  10          HH12      ARG  10  18.007  -1.721  -3.084
   73   HH21  ARG  10          HH21      ARG  10  17.708  -3.397  -6.105
   74   HH22  ARG  10          HH22      ARG  10  18.389  -3.431  -4.513
   75    H    PHE  11           HN       PHE  11  14.712   3.867  -2.342
   76    HA   PHE  11           HA       PHE  11  15.679   6.600  -2.663
   77    HB2  PHE  11           HB2      PHE  11  13.419   7.485  -3.128
   78    HB3  PHE  11           HB1      PHE  11  13.990   6.437  -4.426
   79    HD1  PHE  11           HD1      PHE  11  11.814   6.571  -1.412
   80    HD2  PHE  11           HD2      PHE  11  12.866   4.403  -4.968
   81    HE1  PHE  11           HE1      PHE  11   9.833   5.111  -1.109
   82    HE2  PHE  11           HE2      PHE  11  10.885   2.944  -4.665
   83    HZ   PHE  11           HZ       PHE  11   9.368   3.298  -2.735
   84    H    DBB  12           HN       DBB  12  14.130   4.112  -0.921
   85    HA   DBB  12           HA       DBB  12  12.667   5.356   1.045
   86    HB2  DBB  12           HB2      DBB  12  14.728   5.341   2.791
   87    HG1  DBB  12           HG1      DBB  12  16.071   5.041   0.424
   88    HG2  DBB  12           HG2      DBB  12  16.762   5.790   1.864
   89    HG3  DBB  12           HG3      DBB  12  16.065   6.797   0.594
   90    H    ILE  13           HN       ILE  13  15.501   3.232   0.746
   91    HA   ILE  13           HA       ILE  13  14.315   0.791   0.970
   92    HB   ILE  13           HB       ILE  13  16.842   1.276   2.512
   93   HG12  ILE  13          HG12      ILE  13  17.807   1.000   0.018
   94   HG13  ILE  13          HG11      ILE  13  16.311   1.851  -0.367
   95   HG21  ILE  13          HG21      ILE  13  17.402  -0.881   1.763
   96   HG22  ILE  13          HG22      ILE  13  16.282  -0.801   0.403
   97   HG23  ILE  13          HG23      ILE  13  15.665  -1.002   2.042
   98   HD11  ILE  13          HD11      ILE  13  18.698   2.802   1.136
   99   HD12  ILE  13          HD12      ILE  13  17.125   3.359   1.705
  100   HD13  ILE  13          HD13      ILE  13  17.629   3.686   0.047
  101    H    ASN  14           HN       ASN  14  14.669   3.163   3.467
  102    HA   ASN  14           HA       ASN  14  13.449   1.277   5.393
  103    HB2  ASN  14           HB2      ASN  14  14.621   2.422   7.190
  104    HB3  ASN  14           HB1      ASN  14  15.788   1.857   5.995
  105   HD21  ASN  14          HD21      ASN  14  16.820   3.849   7.454
  106   HD22  ASN  14          HD22      ASN  14  16.763   5.343   6.651
  107    H    VAL  15           HN       VAL  15  11.419   2.101   4.452
  108    HA   VAL  15           HA       VAL  15   9.642   3.581   4.314
  109    HB   VAL  15           HB       VAL  15  10.410   4.289   7.141
  110   HG11  VAL  15          HG11      VAL  15   8.381   5.270   5.902
  111   HG12  VAL  15          HG12      VAL  15   8.062   4.504   7.459
  112   HG13  VAL  15          HG13      VAL  15   7.703   3.642   5.962
  113   HG21  VAL  15          HG21      VAL  15   9.613   2.199   7.919
  114   HG22  VAL  15          HG22      VAL  15  10.644   1.777   6.551
  115   HG23  VAL  15          HG23      VAL  15   8.890   1.798   6.361
  116    H    CYS  16           HN       CYS  16  11.036   4.923   2.826
  117    HA   CYS  16           HA       CYS  16  10.929   7.674   3.703
  118    HB2  CYS  16           HB2      CYS  16  13.094   8.017   4.159
  119    HB3  CYS  16           HB1      CYS  16  13.374   6.283   3.998
  Start of MODEL    9
    1    H1   PHE   1           HT1      PHE   1  11.580  -1.354   8.178
    2    H2   PHE   1           HT2      PHE   1  13.103  -2.000   8.564
    3    H3   PHE   1           HT3      PHE   1  11.696  -2.672   9.239
    4    HA   PHE   1           HA       PHE   1  12.918  -3.141   6.674
    5    HB2  PHE   1           HB2      PHE   1  12.608  -4.900   8.347
    6    HB3  PHE   1           HB1      PHE   1  10.871  -4.598   8.373
    7    HD1  PHE   1           HD1      PHE   1  13.661  -5.511   6.049
    8    HD2  PHE   1           HD2      PHE   1   9.454  -5.736   6.886
    9    HE1  PHE   1           HE1      PHE   1  13.362  -7.053   4.130
   10    HE2  PHE   1           HE2      PHE   1   9.155  -7.277   4.966
   11    HZ   PHE   1           HZ       PHE   1  11.109  -7.936   3.588
   12    H    PHE   2           HN       PHE   2  12.081  -1.660   5.198
   13    HA   PHE   2           HA       PHE   2   9.197  -1.971   4.621
   14    HB2  PHE   2           HB2      PHE   2   9.474   0.241   5.522
   15    HB3  PHE   2           HB1      PHE   2  10.881   0.538   4.502
   16    HD1  PHE   2           HD1      PHE   2   7.851  -1.255   3.368
   17    HD2  PHE   2           HD2      PHE   2  10.005   2.460   3.330
   18    HE1  PHE   2           HE1      PHE   2   6.369  -0.413   1.564
   19    HE2  PHE   2           HE2      PHE   2   8.522   3.302   1.530
   20    HZ   PHE   2           HZ       PHE   2   6.704   1.867   0.649
   21    H    CYS   3           HN       CYS   3   9.661  -3.579   3.064
   22    HA   CYS   3           HA       CYS   3  11.293  -2.739   0.768
   23    HB2  CYS   3           HB2      CYS   3  10.804  -5.259   2.067
   24    HB3  CYS   3           HB1      CYS   3  10.314  -5.361   0.377
   25    H    VAL   4           HN       VAL   4  10.406  -2.198  -1.133
   26    HA   VAL   4           HA       VAL   4   7.525  -2.746  -1.513
   27    HB   VAL   4           HB       VAL   4   7.477  -0.634  -2.857
   28   HG11  VAL   4          HG11      VAL   4   8.449   0.318  -0.249
   29   HG12  VAL   4          HG12      VAL   4   7.278  -0.997  -0.137
   30   HG13  VAL   4          HG13      VAL   4   6.856   0.490  -0.987
   31   HG21  VAL   4          HG21      VAL   4   9.467   0.936  -2.145
   32   HG22  VAL   4          HG22      VAL   4   9.685  -0.186  -3.489
   33   HG23  VAL   4          HG23      VAL   4  10.326  -0.583  -1.895
   34    H    GLN   5           HN       GLN   5   7.007  -3.841  -3.292
   35    HA   GLN   5           HA       GLN   5   7.297  -5.088  -5.212
   36    HB2  GLN   5           HB2      GLN   5   8.915  -2.785  -6.262
   37    HB3  GLN   5           HB1      GLN   5   7.726  -3.782  -7.100
   38    HG2  GLN   5           HG2      GLN   5   7.081  -1.851  -4.853
   39    HG3  GLN   5           HG1      GLN   5   6.851  -1.510  -6.567
   40   HE21  GLN   5          HE21      GLN   5   5.050  -2.278  -3.979
   41   HE22  GLN   5          HE22      GLN   5   3.873  -3.279  -4.696
   42    H    GLY   6           HN       GLY   6   8.888  -6.338  -3.711
   43    HA2  GLY   6           HA2      GLY   6  10.820  -7.583  -3.564
   44    HA3  GLY   6           HA1      GLY   6  11.095  -7.163  -5.252
   45    H    DBB   7           HN       DBB   7  11.282  -5.686  -2.005
   46    HA   DBB   7           HA       DBB   7  13.925  -5.093  -1.855
   47    HB2  DBB   7           HB2      DBB   7  11.531  -3.501  -0.966
   48    HG1  DBB   7           HG1      DBB   7  14.222  -2.529  -1.277
   49    HG2  DBB   7           HG2      DBB   7  13.847  -2.658   0.442
   50    HG3  DBB   7           HG3      DBB   7  12.820  -1.689  -0.614
   51    H    ALA   8           HN       ALA   8  11.480  -2.973  -3.361
   52    HA   ALA   8           HA       ALA   8  13.617  -1.848  -5.055
   53    HB1  ALA   8           HB1      ALA   8  12.159  -2.297  -6.703
   54    HB2  ALA   8           HB2      ALA   8  11.159  -0.995  -6.060
   55    HB3  ALA   8           HB3      ALA   8  10.873  -2.658  -5.553
   56    H    ASN   9           HN       ASN   9  12.606  -1.118  -2.224
   57    HA   ASN   9           HA       ASN   9  11.389   1.428  -2.356
   58    HB2  ASN   9           HB2      ASN   9  11.576  -0.060  -0.316
   59    HB3  ASN   9           HB1      ASN   9  13.247   0.480  -0.183
   60   HD21  ASN   9          HD21      ASN   9  11.832   1.200   1.979
   61   HD22  ASN   9          HD22      ASN   9  11.352   2.833   1.921
   62    H    ARG  10           HN       ARG  10  14.743   0.389  -2.515
   63    HA   ARG  10           HA       ARG  10  16.701   1.666  -2.592
   64    HB2  ARG  10           HB2      ARG  10  14.900   2.308  -4.856
   65    HB3  ARG  10           HB1      ARG  10  16.320   3.335  -4.656
   66    HG2  ARG  10           HG2      ARG  10  17.163   1.616  -5.996
   67    HG3  ARG  10           HG1      ARG  10  17.588   1.053  -4.379
   68    HD2  ARG  10           HD2      ARG  10  15.554  -0.333  -4.319
   69    HD3  ARG  10           HD1      ARG  10  15.112   0.236  -5.926
   70    HE   ARG  10           HE       ARG  10  17.726  -1.047  -5.690
   71   HH11  ARG  10          HH11      ARG  10  14.365  -1.257  -6.484
   72   HH12  ARG  10          HH12      ARG  10  14.540  -2.685  -7.448
   73   HH21  ARG  10          HH21      ARG  10  17.963  -2.923  -6.949
   74   HH22  ARG  10          HH22      ARG  10  16.577  -3.628  -7.713
   75    H    PHE  11           HN       PHE  11  14.805   4.325  -3.831
   76    HA   PHE  11           HA       PHE  11  15.945   6.394  -2.586
   77    HB2  PHE  11           HB2      PHE  11  13.686   7.511  -2.517
   78    HB3  PHE  11           HB1      PHE  11  14.093   6.776  -4.068
   79    HD1  PHE  11           HD1      PHE  11  12.010   6.493  -1.038
   80    HD2  PHE  11           HD2      PHE  11  12.982   4.753  -4.842
   81    HE1  PHE  11           HE1      PHE  11   9.990   5.063  -0.900
   82    HE2  PHE  11           HE2      PHE  11  10.965   3.319  -4.702
   83    HZ   PHE  11           HZ       PHE  11   9.471   3.472  -2.729
   84    H    DBB  12           HN       DBB  12  13.333   4.483  -1.084
   85    HA   DBB  12           HA       DBB  12  12.483   4.606   1.078
   86    HB2  DBB  12           HB2      DBB  12  13.138   6.166   2.629
   87    HG1  DBB  12           HG1      DBB  12  15.257   6.076   3.352
   88    HG2  DBB  12           HG2      DBB  12  15.692   7.123   2.001
   89    HG3  DBB  12           HG3      DBB  12  15.806   5.372   1.830
   90    H    ILE  13           HN       ILE  13  13.861   2.480   0.089
   91    HA   ILE  13           HA       ILE  13  14.755   0.498   0.856
   92    HB   ILE  13           HB       ILE  13  16.772   2.548   1.771
   93   HG12  ILE  13          HG12      ILE  13  17.294   0.440  -0.264
   94   HG13  ILE  13          HG11      ILE  13  16.154   1.709  -0.710
   95   HG21  ILE  13          HG21      ILE  13  17.291   0.811   3.246
   96   HG22  ILE  13          HG22      ILE  13  18.250   0.372   1.831
   97   HG23  ILE  13          HG23      ILE  13  16.711  -0.432   2.137
   98   HD11  ILE  13          HD11      ILE  13  17.886   3.389   0.075
   99   HD12  ILE  13          HD12      ILE  13  18.324   2.483  -1.373
  100   HD13  ILE  13          HD13      ILE  13  19.024   2.045   0.185
  101    H    ASN  14           HN       ASN  14  13.120   2.406   2.803
  102    HA   ASN  14           HA       ASN  14  12.726   0.553   4.846
  103    HB2  ASN  14           HB2      ASN  14  13.850   1.847   6.734
  104    HB3  ASN  14           HB1      ASN  14  14.917   0.922   5.680
  105   HD21  ASN  14          HD21      ASN  14  16.771   2.310   5.946
  106   HD22  ASN  14          HD22      ASN  14  16.798   3.904   5.363
  107    H    VAL  15           HN       VAL  15  12.902   3.997   4.074
  108    HA   VAL  15           HA       VAL  15  10.190   4.521   4.299
  109    HB   VAL  15           HB       VAL  15  10.301   3.962   6.648
  110   HG11  VAL  15          HG11      VAL  15  12.912   5.026   6.436
  111   HG12  VAL  15          HG12      VAL  15  12.158   4.326   7.868
  112   HG13  VAL  15          HG13      VAL  15  12.053   6.063   7.575
  113   HG21  VAL  15          HG21      VAL  15  10.409   6.958   6.717
  114   HG22  VAL  15          HG22      VAL  15   9.240   5.865   7.458
  115   HG23  VAL  15          HG23      VAL  15   9.175   6.181   5.724
  116    H    CYS  16           HN       CYS  16  10.454   5.984   2.683
  117    HA   CYS  16           HA       CYS  16  12.445   8.114   3.024
  118    HB2  CYS  16           HB2      CYS  16  11.166   6.796   0.739
  119    HB3  CYS  16           HB1      CYS  16  11.266   8.552   0.587
  Start of MODEL   10
    1    H1   PHE   1           HT1      PHE   1  13.831  -4.950   6.250
    2    H2   PHE   1           HT2      PHE   1  13.728  -3.487   5.392
    3    H3   PHE   1           HT3      PHE   1  12.718  -4.790   4.981
    4    HA   PHE   1           HA       PHE   1  11.822  -4.622   7.342
    5    HB2  PHE   1           HB2      PHE   1  13.716  -3.073   8.015
    6    HB3  PHE   1           HB1      PHE   1  12.950  -1.828   7.030
    7    HD1  PHE   1           HD1      PHE   1  12.737  -3.809  10.106
    8    HD2  PHE   1           HD2      PHE   1  10.732  -0.925   7.634
    9    HE1  PHE   1           HE1      PHE   1  11.186  -3.289  11.969
   10    HE2  PHE   1           HE2      PHE   1   9.182  -0.404   9.498
   11    HZ   PHE   1           HZ       PHE   1   9.409  -1.587  11.667
   12    H    PHE   2           HN       PHE   2  12.189  -1.945   5.004
   13    HA   PHE   2           HA       PHE   2   9.266  -2.061   4.552
   14    HB2  PHE   2           HB2      PHE   2   9.696   0.040   5.551
   15    HB3  PHE   2           HB1      PHE   2  11.164   0.280   4.604
   16    HD1  PHE   2           HD1      PHE   2   7.484  -0.290   4.123
   17    HD2  PHE   2           HD2      PHE   2  11.068   1.588   2.687
   18    HE1  PHE   2           HE1      PHE   2   6.175   0.861   2.357
   19    HE2  PHE   2           HE2      PHE   2   9.764   2.737   0.922
   20    HZ   PHE   2           HZ       PHE   2   7.314   2.376   0.759
   21    H    CYS   3           HN       CYS   3   9.523  -3.595   2.859
   22    HA   CYS   3           HA       CYS   3  10.950  -2.612   0.476
   23    HB2  CYS   3           HB2      CYS   3  10.370  -5.291   1.572
   24    HB3  CYS   3           HB1      CYS   3  10.190  -5.134  -0.175
   25    H    VAL   4           HN       VAL   4   9.594  -1.350  -0.658
   26    HA   VAL   4           HA       VAL   4   6.786  -1.660  -0.776
   27    HB   VAL   4           HB       VAL   4   7.088  -0.180  -2.880
   28   HG11  VAL   4          HG11      VAL   4   7.141   0.310  -0.098
   29   HG12  VAL   4          HG12      VAL   4   6.700   1.447  -1.372
   30   HG13  VAL   4          HG13      VAL   4   8.367   1.362  -0.801
   31   HG21  VAL   4          HG21      VAL   4   9.245   0.751  -3.247
   32   HG22  VAL   4          HG22      VAL   4   9.535  -0.979  -3.073
   33   HG23  VAL   4          HG23      VAL   4   9.868   0.111  -1.725
   34    H    GLN   5           HN       GLN   5   9.395  -2.707  -2.936
   35    HA   GLN   5           HA       GLN   5   7.542  -4.662  -4.113
   36    HB2  GLN   5           HB2      GLN   5   9.313  -3.540  -6.135
   37    HB3  GLN   5           HB1      GLN   5   7.568  -3.784  -6.186
   38    HG2  GLN   5           HG2      GLN   5   7.283  -1.713  -4.815
   39    HG3  GLN   5           HG1      GLN   5   9.020  -1.450  -4.906
   40   HE21  GLN   5          HE21      GLN   5   7.526   0.575  -5.970
   41   HE22  GLN   5          HE22      GLN   5   7.550   0.525  -7.672
   42    H    GLY   6           HN       GLY   6   8.552  -6.458  -3.355
   43    HA2  GLY   6           HA2      GLY   6  10.273  -7.940  -2.860
   44    HA3  GLY   6           HA1      GLY   6  10.655  -7.665  -4.558
   45    H    DBB   7           HN       DBB   7  10.828  -4.950  -2.452
   46    HA   DBB   7           HA       DBB   7  13.678  -5.269  -1.909
   47    HB2  DBB   7           HB2      DBB   7  11.597  -3.236  -1.126
   48    HG1  DBB   7           HG1      DBB   7  13.948  -2.650   0.269
   49    HG2  DBB   7           HG2      DBB   7  13.231  -1.681  -1.020
   50    HG3  DBB   7           HG3      DBB   7  14.476  -2.873  -1.400
   51    H    ALA   8           HN       ALA   8  11.513  -3.135  -3.740
   52    HA   ALA   8           HA       ALA   8  13.791  -2.374  -5.437
   53    HB1  ALA   8           HB1      ALA   8  11.825  -1.428  -6.862
   54    HB2  ALA   8           HB2      ALA   8  10.818  -2.451  -5.835
   55    HB3  ALA   8           HB3      ALA   8  12.092  -3.171  -6.821
   56    H    ASN   9           HN       ASN   9  13.574  -1.196  -2.864
   57    HA   ASN   9           HA       ASN   9  12.300   1.345  -2.959
   58    HB2  ASN   9           HB2      ASN   9  14.176  -0.066  -1.164
   59    HB3  ASN   9           HB1      ASN   9  14.235   1.695  -1.107
   60   HD21  ASN   9          HD21      ASN   9  12.433   2.811  -0.218
   61   HD22  ASN   9          HD22      ASN   9  11.129   2.005   0.517
   62    H    ARG  10           HN       ARG  10  15.683   1.386  -2.188
   63    HA   ARG  10           HA       ARG  10  17.465   2.539  -3.074
   64    HB2  ARG  10           HB2      ARG  10  15.820   2.047  -5.544
   65    HB3  ARG  10           HB1      ARG  10  17.325   2.967  -5.612
   66    HG2  ARG  10           HG2      ARG  10  18.100   0.805  -6.010
   67    HG3  ARG  10           HG1      ARG  10  18.281   0.914  -4.257
   68    HD2  ARG  10           HD2      ARG  10  16.060  -0.146  -3.974
   69    HD3  ARG  10           HD1      ARG  10  15.917  -0.289  -5.724
   70    HE   ARG  10           HE       ARG  10  17.647  -1.875  -3.983
   71   HH11  ARG  10          HH11      ARG  10  16.725  -0.882  -7.168
   72   HH12  ARG  10          HH12      ARG  10  17.440  -2.251  -7.951
   73   HH21  ARG  10          HH21      ARG  10  18.587  -3.672  -5.003
   74   HH22  ARG  10          HH22      ARG  10  18.494  -3.832  -6.725
   75    H    PHE  11           HN       PHE  11  15.532   3.998  -1.737
   76    HA   PHE  11           HA       PHE  11  16.106   6.639  -2.372
   77    HB2  PHE  11           HB2      PHE  11  14.048   7.444  -3.423
   78    HB3  PHE  11           HB1      PHE  11  14.812   6.227  -4.449
   79    HD1  PHE  11           HD1      PHE  11  12.299   6.543  -1.687
   80    HD2  PHE  11           HD2      PHE  11  13.558   4.394  -5.186
   81    HE1  PHE  11           HE1      PHE  11  10.248   5.154  -1.566
   82    HE2  PHE  11           HE2      PHE  11  11.510   3.002  -5.069
   83    HZ   PHE  11           HZ       PHE  11   9.855   3.378  -3.260
   84    H    DBB  12           HN       DBB  12  14.572   4.263  -0.651
   85    HA   DBB  12           HA       DBB  12  12.591   5.640   0.800
   86    HB2  DBB  12           HB2      DBB  12  14.062   5.656   2.985
   87    HG1  DBB  12           HG1      DBB  12  16.123   4.787   2.156
   88    HG2  DBB  12           HG2      DBB  12  16.393   6.524   2.297
   89    HG3  DBB  12           HG3      DBB  12  16.062   5.808   0.719
   90    H    ILE  13           HN       ILE  13  15.269   3.361   1.191
   91    HA   ILE  13           HA       ILE  13  13.805   1.028   1.137
   92    HB   ILE  13           HB       ILE  13  16.245   1.409   2.875
   93   HG12  ILE  13          HG12      ILE  13  17.269   0.636   0.503
   94   HG13  ILE  13          HG11      ILE  13  15.900   1.582  -0.083
   95   HG21  ILE  13          HG21      ILE  13  14.760  -0.801   2.503
   96   HG22  ILE  13          HG22      ILE  13  16.516  -0.873   2.655
   97   HG23  ILE  13          HG23      ILE  13  15.766  -0.908   1.058
   98   HD11  ILE  13          HD11      ILE  13  18.398   2.515   1.042
   99   HD12  ILE  13          HD12      ILE  13  17.040   3.102   2.004
  100   HD13  ILE  13          HD13      ILE  13  17.111   3.449   0.276
  101    H    ASN  14           HN       ASN  14  14.757   2.927   3.990
  102    HA   ASN  14           HA       ASN  14  13.522   1.240   5.892
  103    HB2  ASN  14           HB2      ASN  14  14.379   4.119   5.887
  104    HB3  ASN  14           HB1      ASN  14  13.538   3.426   7.273
  105   HD21  ASN  14          HD21      ASN  14  16.455   4.302   6.953
  106   HD22  ASN  14          HD22      ASN  14  17.354   2.937   7.415
  107    H    VAL  15           HN       VAL  15  12.386   4.088   4.114
  108    HA   VAL  15           HA       VAL  15   9.796   3.480   3.697
  109    HB   VAL  15           HB       VAL  15   9.392   2.979   6.024
  110   HG11  VAL  15          HG11      VAL  15   9.792   4.681   7.777
  111   HG12  VAL  15          HG12      VAL  15  10.483   5.755   6.562
  112   HG13  VAL  15          HG13      VAL  15  11.289   4.237   6.956
  113   HG21  VAL  15          HG21      VAL  15   7.811   4.591   4.598
  114   HG22  VAL  15          HG22      VAL  15   8.247   5.734   5.867
  115   HG23  VAL  15          HG23      VAL  15   7.456   4.215   6.284
  116    H    CYS  16           HN       CYS  16  12.126   5.342   3.171
  117    HA   CYS  16           HA       CYS  16  10.704   7.919   3.243
  118    HB2  CYS  16           HB2      CYS  16  12.715   8.969   3.404
  119    HB3  CYS  16           HB1      CYS  16  13.226   7.404   4.037
  Start of MODEL   11
    1    H1   PHE   1           HT1      PHE   1   9.821  -2.096   8.285
    2    H2   PHE   1           HT2      PHE   1  11.355  -2.105   9.015
    3    H3   PHE   1           HT3      PHE   1  10.479  -3.552   8.854
    4    HA   PHE   1           HA       PHE   1  12.238  -2.293   7.005
    5    HB2  PHE   1           HB2      PHE   1  11.964  -4.758   7.889
    6    HB3  PHE   1           HB1      PHE   1  10.789  -4.890   6.579
    7    HD1  PHE   1           HD1      PHE   1  14.308  -3.850   7.300
    8    HD2  PHE   1           HD2      PHE   1  11.501  -5.243   4.362
    9    HE1  PHE   1           HE1      PHE   1  16.154  -4.130   5.669
   10    HE2  PHE   1           HE2      PHE   1  13.348  -5.522   2.730
   11    HZ   PHE   1           HZ       PHE   1  15.674  -4.966   3.384
   12    H    PHE   2           HN       PHE   2  11.724  -1.193   5.213
   13    HA   PHE   2           HA       PHE   2   8.973  -1.445   4.157
   14    HB2  PHE   2           HB2      PHE   2   9.413   0.806   4.904
   15    HB3  PHE   2           HB1      PHE   2  10.942   0.842   4.026
   16    HD1  PHE   2           HD1      PHE   2   8.135  -0.875   2.468
   17    HD2  PHE   2           HD2      PHE   2  10.153   2.896   2.855
   18    HE1  PHE   2           HE1      PHE   2   6.967  -0.042   0.444
   19    HE2  PHE   2           HE2      PHE   2   8.986   3.729   0.837
   20    HZ   PHE   2           HZ       PHE   2   7.390   2.264  -0.369
   21    H    CYS   3           HN       CYS   3   8.937  -2.759   2.440
   22    HA   CYS   3           HA       CYS   3  11.077  -2.445   0.427
   23    HB2  CYS   3           HB2      CYS   3  10.279  -4.817   1.864
   24    HB3  CYS   3           HB1      CYS   3   9.996  -5.029   0.137
   25    H    VAL   4           HN       VAL   4  10.406  -2.054  -1.601
   26    HA   VAL   4           HA       VAL   4   7.518  -2.335  -2.160
   27    HB   VAL   4           HB       VAL   4   7.963  -0.530  -3.896
   28   HG11  VAL   4          HG11      VAL   4   7.198  -0.364  -1.302
   29   HG12  VAL   4          HG12      VAL   4   7.319   1.042  -2.361
   30   HG13  VAL   4          HG13      VAL   4   8.639   0.650  -1.262
   31   HG21  VAL   4          HG21      VAL   4   9.981   0.893  -3.361
   32   HG22  VAL   4          HG22      VAL   4  10.378  -0.683  -4.046
   33   HG23  VAL   4          HG23      VAL   4  10.548  -0.405  -2.311
   34    H    GLN   5           HN       GLN   5   7.273  -4.169  -3.284
   35    HA   GLN   5           HA       GLN   5   7.317  -5.505  -5.173
   36    HB2  GLN   5           HB2      GLN   5   9.572  -3.765  -6.186
   37    HB3  GLN   5           HB1      GLN   5   8.523  -4.827  -7.125
   38    HG2  GLN   5           HG2      GLN   5   7.601  -2.387  -5.578
   39    HG3  GLN   5           HG1      GLN   5   7.824  -2.459  -7.326
   40   HE21  GLN   5          HE21      GLN   5   5.419  -2.558  -5.080
   41   HE22  GLN   5          HE22      GLN   5   4.310  -3.572  -5.882
   42    H    GLY   6           HN       GLY   6   8.561  -6.330  -2.892
   43    HA2  GLY   6           HA2      GLY   6   9.976  -8.027  -2.219
   44    HA3  GLY   6           HA1      GLY   6  10.477  -8.205  -3.898
   45    H    DBB   7           HN       DBB   7  10.677  -5.098  -2.363
   46    HA   DBB   7           HA       DBB   7  13.537  -5.431  -1.786
   47    HB2  DBB   7           HB2      DBB   7  11.523  -3.282  -1.142
   48    HG1  DBB   7           HG1      DBB   7  14.272  -2.888  -1.643
   49    HG2  DBB   7           HG2      DBB   7  14.102  -2.910   0.112
   50    HG3  DBB   7           HG3      DBB   7  13.166  -1.767  -0.850
   51    H    ALA   8           HN       ALA   8  11.823  -2.569  -2.962
   52    HA   ALA   8           HA       ALA   8  13.949  -2.130  -4.926
   53    HB1  ALA   8           HB1      ALA   8  11.221  -1.697  -5.982
   54    HB2  ALA   8           HB2      ALA   8  11.709  -3.381  -5.797
   55    HB3  ALA   8           HB3      ALA   8  12.666  -2.291  -6.799
   56    H    ASN   9           HN       ASN   9  13.240  -0.816  -2.456
   57    HA   ASN   9           HA       ASN   9  11.698   1.512  -2.886
   58    HB2  ASN   9           HB2      ASN   9  13.702   0.635  -0.866
   59    HB3  ASN   9           HB1      ASN   9  13.343   2.355  -0.968
   60   HD21  ASN   9          HD21      ASN   9  12.610   0.936   1.355
   61   HD22  ASN   9          HD22      ASN   9  10.914   0.805   1.416
   62    H    ARG  10           HN       ARG  10  15.220   1.459  -2.405
   63    HA   ARG  10           HA       ARG  10  16.925   2.543  -3.504
   64    HB2  ARG  10           HB2      ARG  10  14.729   2.922  -5.496
   65    HB3  ARG  10           HB1      ARG  10  16.181   3.907  -5.637
   66    HG2  ARG  10           HG2      ARG  10  16.390   1.827  -6.945
   67    HG3  ARG  10           HG1      ARG  10  17.564   1.867  -5.628
   68    HD2  ARG  10           HD2      ARG  10  16.142   0.451  -4.255
   69    HD3  ARG  10           HD1      ARG  10  14.869   0.493  -5.472
   70    HE   ARG  10           HE       ARG  10  16.145  -0.978  -6.812
   71   HH11  ARG  10          HH11      ARG  10  17.758  -0.021  -3.902
   72   HH12  ARG  10          HH12      ARG  10  18.974  -1.249  -4.012
   73   HH21  ARG  10          HH21      ARG  10  17.744  -2.573  -6.973
   74   HH22  ARG  10          HH22      ARG  10  18.966  -2.695  -5.752
   75    H    PHE  11           HN       PHE  11  13.957   4.122  -2.661
   76    HA   PHE  11           HA       PHE  11  15.333   6.719  -2.417
   77    HB2  PHE  11           HB2      PHE  11  12.979   7.573  -1.996
   78    HB3  PHE  11           HB1      PHE  11  13.278   6.934  -3.614
   79    HD1  PHE  11           HD1      PHE  11  11.519   6.427  -0.444
   80    HD2  PHE  11           HD2      PHE  11  12.462   4.708  -4.255
   81    HE1  PHE  11           HE1      PHE  11   9.736   4.733  -0.120
   82    HE2  PHE  11           HE2      PHE  11  10.688   3.012  -3.938
   83    HZ   PHE  11           HZ       PHE  11   9.324   3.019  -1.868
   84    H    DBB  12           HN       DBB  12  13.136   4.612  -0.567
   85    HA   DBB  12           HA       DBB  12  12.602   4.671   1.699
   86    HB2  DBB  12           HB2      DBB  12  13.346   6.289   3.142
   87    HG1  DBB  12           HG1      DBB  12  15.701   7.437   2.147
   88    HG2  DBB  12           HG2      DBB  12  15.917   5.697   1.970
   89    HG3  DBB  12           HG3      DBB  12  15.538   6.382   3.550
   90    H    ILE  13           HN       ILE  13  14.347   2.881   0.283
   91    HA   ILE  13           HA       ILE  13  15.546   0.997   0.842
   92    HB   ILE  13           HB       ILE  13  17.379   2.852   2.347
   93   HG12  ILE  13          HG12      ILE  13  16.812   4.068   0.329
   94   HG13  ILE  13          HG11      ILE  13  18.400   3.341   0.089
   95   HG21  ILE  13          HG21      ILE  13  18.754   1.176   0.575
   96   HG22  ILE  13          HG22      ILE  13  17.460   0.171   1.226
   97   HG23  ILE  13          HG23      ILE  13  18.602   0.956   2.318
   98   HD11  ILE  13          HD11      ILE  13  17.579   2.388  -1.774
   99   HD12  ILE  13          HD12      ILE  13  15.939   2.898  -1.373
  100   HD13  ILE  13          HD13      ILE  13  16.572   1.381  -0.733
  101    H    ASN  14           HN       ASN  14  13.616   2.296   2.913
  102    HA   ASN  14           HA       ASN  14  13.632   0.273   4.817
  103    HB2  ASN  14           HB2      ASN  14  15.851   1.419   5.406
  104    HB3  ASN  14           HB1      ASN  14  14.869   2.756   6.000
  105   HD21  ASN  14          HD21      ASN  14  15.274   2.440   8.258
  106   HD22  ASN  14          HD22      ASN  14  14.772   1.050   9.093
  107    H    VAL  15           HN       VAL  15  13.122   3.731   4.304
  108    HA   VAL  15           HA       VAL  15  10.380   3.756   4.496
  109    HB   VAL  15           HB       VAL  15  10.427   4.865   6.961
  110   HG11  VAL  15          HG11      VAL  15   8.883   3.255   7.221
  111   HG12  VAL  15          HG12      VAL  15  10.143   2.023   7.292
  112   HG13  VAL  15          HG13      VAL  15   9.463   2.500   5.737
  113   HG21  VAL  15          HG21      VAL  15  12.051   2.463   7.546
  114   HG22  VAL  15          HG22      VAL  15  12.045   4.037   8.343
  115   HG23  VAL  15          HG23      VAL  15  12.944   3.811   6.841
  116    H    CYS  16           HN       CYS  16  10.806   5.358   2.935
  117    HA   CYS  16           HA       CYS  16  12.275   7.745   3.641
  118    HB2  CYS  16           HB2      CYS  16  11.069   6.597   1.230
  119    HB3  CYS  16           HB1      CYS  16  10.906   8.349   1.336
  Start of MODEL   12
    1    H1   PHE   1           HT1      PHE   1  11.249  -1.906   5.946
    2    H2   PHE   1           HT2      PHE   1  11.411  -3.403   5.161
    3    H3   PHE   1           HT3      PHE   1  11.769  -3.266   6.816
    4    HA   PHE   1           HA       PHE   1   9.600  -4.336   6.369
    5    HB2  PHE   1           HB2      PHE   1  10.030  -3.218   8.509
    6    HB3  PHE   1           HB1      PHE   1   9.579  -1.665   7.807
    7    HD1  PHE   1           HD1      PHE   1   8.265  -5.109   8.448
    8    HD2  PHE   1           HD2      PHE   1   7.333  -0.965   7.807
    9    HE1  PHE   1           HE1      PHE   1   5.884  -5.565   8.966
   10    HE2  PHE   1           HE2      PHE   1   4.951  -1.421   8.325
   11    HZ   PHE   1           HZ       PHE   1   4.226  -3.721   8.905
   12    H    PHE   2           HN       PHE   2   9.827  -0.906   5.457
   13    HA   PHE   2           HA       PHE   2   7.219  -0.792   4.281
   14    HB2  PHE   2           HB2      PHE   2   8.104   1.286   4.965
   15    HB3  PHE   2           HB1      PHE   2   9.647   0.986   4.167
   16    HD1  PHE   2           HD1      PHE   2   6.001   1.466   3.473
   17    HD2  PHE   2           HD2      PHE   2  10.015   1.696   1.958
   18    HE1  PHE   2           HE1      PHE   2   5.161   2.549   1.406
   19    HE2  PHE   2           HE2      PHE   2   9.175   2.780  -0.107
   20    HZ   PHE   2           HZ       PHE   2   6.747   3.208  -0.383
   21    H    CYS   3           HN       CYS   3  10.322  -1.859   3.233
   22    HA   CYS   3           HA       CYS   3  10.811  -1.626   0.729
   23    HB2  CYS   3           HB2      CYS   3  10.414  -4.140   2.246
   24    HB3  CYS   3           HB1      CYS   3  10.552  -4.291   0.494
   25    H    VAL   4           HN       VAL   4   9.510  -0.861  -0.804
   26    HA   VAL   4           HA       VAL   4   6.794  -1.546  -1.125
   27    HB   VAL   4           HB       VAL   4   7.173  -0.513  -3.457
   28   HG11  VAL   4          HG11      VAL   4   6.216   0.961  -1.943
   29   HG12  VAL   4          HG12      VAL   4   7.765   1.761  -2.208
   30   HG13  VAL   4          HG13      VAL   4   7.521   0.766  -0.772
   31   HG21  VAL   4          HG21      VAL   4   9.796   0.290  -2.181
   32   HG22  VAL   4          HG22      VAL   4   9.263   0.574  -3.838
   33   HG23  VAL   4          HG23      VAL   4   9.680  -1.057  -3.314
   34    H    GLN   5           HN       GLN   5   9.739  -2.723  -2.717
   35    HA   GLN   5           HA       GLN   5   8.202  -5.062  -3.638
   36    HB2  GLN   5           HB2      GLN   5  10.271  -4.062  -5.506
   37    HB3  GLN   5           HB1      GLN   5   8.709  -4.803  -5.844
   38    HG2  GLN   5           HG2      GLN   5   7.596  -2.683  -5.134
   39    HG3  GLN   5           HG1      GLN   5   9.184  -1.950  -4.936
   40   HE21  GLN   5          HE21      GLN   5   7.955  -0.516  -6.723
   41   HE22  GLN   5          HE22      GLN   5   8.287  -0.963  -8.333
   42    H    GLY   6           HN       GLY   6   9.252  -6.152  -1.879
   43    HA2  GLY   6           HA2      GLY   6  10.935  -7.374  -0.879
   44    HA3  GLY   6           HA1      GLY   6  11.488  -7.647  -2.530
   45    H    DBB   7           HN       DBB   7  11.305  -4.394  -1.462
   46    HA   DBB   7           HA       DBB   7  14.141  -4.305  -0.705
   47    HB2  DBB   7           HB2      DBB   7  11.907  -2.274  -0.533
   48    HG1  DBB   7           HG1      DBB   7  14.811  -2.064   0.309
   49    HG2  DBB   7           HG2      DBB   7  13.550  -0.897   0.715
   50    HG3  DBB   7           HG3      DBB   7  14.033  -1.127  -0.967
   51    H    ALA   8           HN       ALA   8  11.853  -2.915  -3.034
   52    HA   ALA   8           HA       ALA   8  14.146  -2.231  -4.762
   53    HB1  ALA   8           HB1      ALA   8  11.300  -2.418  -5.697
   54    HB2  ALA   8           HB2      ALA   8  12.283  -3.871  -5.504
   55    HB3  ALA   8           HB3      ALA   8  12.787  -2.608  -6.627
   56    H    ASN   9           HN       ASN   9  13.751  -0.371  -2.824
   57    HA   ASN   9           HA       ASN   9  12.492   1.824  -4.337
   58    HB2  ASN   9           HB2      ASN   9  12.101   2.754  -1.886
   59    HB3  ASN   9           HB1      ASN   9  10.933   1.691  -2.667
   60   HD21  ASN   9          HD21      ASN   9  12.189   2.107   0.275
   61   HD22  ASN   9          HD22      ASN   9  12.340   0.494   0.795
   62    H    ARG  10           HN       ARG  10  14.175   2.993  -5.041
   63    HA   ARG  10           HA       ARG  10  16.685   3.183  -3.732
   64    HB2  ARG  10           HB2      ARG  10  15.376   4.830  -5.895
   65    HB3  ARG  10           HB1      ARG  10  17.003   5.163  -5.303
   66    HG2  ARG  10           HG2      ARG  10  17.342   3.738  -7.162
   67    HG3  ARG  10           HG1      ARG  10  17.482   2.671  -5.765
   68    HD2  ARG  10           HD2      ARG  10  15.152   1.966  -6.043
   69    HD3  ARG  10           HD1      ARG  10  14.964   3.071  -7.403
   70    HE   ARG  10           HE       ARG  10  17.118   1.439  -8.037
   71   HH11  ARG  10          HH11      ARG  10  13.764   1.097  -7.262
   72   HH12  ARG  10          HH12      ARG  10  13.544  -0.324  -8.228
   73   HH21  ARG  10          HH21      ARG  10  16.838  -0.420  -9.308
   74   HH22  ARG  10          HH22      ARG  10  15.285  -1.182  -9.388
   75    H    PHE  11           HN       PHE  11  13.807   5.231  -3.738
   76    HA   PHE  11           HA       PHE  11  14.865   7.439  -2.359
   77    HB2  PHE  11           HB2      PHE  11  12.467   7.861  -1.726
   78    HB3  PHE  11           HB1      PHE  11  12.732   7.616  -3.454
   79    HD1  PHE  11           HD1      PHE  11  11.304   6.197  -0.380
   80    HD2  PHE  11           HD2      PHE  11  12.080   5.520  -4.550
   81    HE1  PHE  11           HE1      PHE  11   9.742   4.271  -0.359
   82    HE2  PHE  11           HE2      PHE  11  10.518   3.597  -4.529
   83    HZ   PHE  11           HZ       PHE  11   9.351   2.969  -2.434
   84    H    DBB  12           HN       DBB  12  13.170   4.566  -1.144
   85    HA   DBB  12           HA       DBB  12  12.710   3.936   1.047
   86    HB2  DBB  12           HB2      DBB  12  13.244   5.196   2.907
   87    HG1  DBB  12           HG1      DBB  12  15.780   5.620   1.507
   88    HG2  DBB  12           HG2      DBB  12  15.448   5.550   3.237
   89    HG3  DBB  12           HG3      DBB  12  15.208   7.058   2.354
   90    H    ILE  13           HN       ILE  13  14.122   2.416  -0.448
   91    HA   ILE  13           HA       ILE  13  15.794   0.842  -0.577
   92    HB   ILE  13           HB       ILE  13  17.358   2.563   1.356
   93   HG12  ILE  13          HG12      ILE  13  18.236   2.955  -1.303
   94   HG13  ILE  13          HG11      ILE  13  16.481   3.124  -1.343
   95   HG21  ILE  13          HG21      ILE  13  19.273   1.443   0.425
   96   HG22  ILE  13          HG22      ILE  13  18.297   0.700  -0.841
   97   HG23  ILE  13          HG23      ILE  13  18.104   0.189   0.837
   98   HD11  ILE  13          HD11      ILE  13  18.305   5.069  -0.515
   99   HD12  ILE  13          HD12      ILE  13  17.627   4.440   0.987
  100   HD13  ILE  13          HD13      ILE  13  16.561   5.096  -0.256
  101    H    ASN  14           HN       ASN  14  15.216   2.157   2.666
  102    HA   ASN  14           HA       ASN  14  15.074  -0.619   3.669
  103    HB2  ASN  14           HB2      ASN  14  15.986   0.124   5.791
  104    HB3  ASN  14           HB1      ASN  14  17.100   0.565   4.499
  105   HD21  ASN  14          HD21      ASN  14  17.414   2.045   6.765
  106   HD22  ASN  14          HD22      ASN  14  16.743   3.595   6.588
  107    H    VAL  15           HN       VAL  15  13.711   2.558   3.499
  108    HA   VAL  15           HA       VAL  15  11.121   2.062   3.881
  109    HB   VAL  15           HB       VAL  15  11.365   0.852   5.907
  110   HG11  VAL  15          HG11      VAL  15  13.610   2.583   6.260
  111   HG12  VAL  15          HG12      VAL  15  13.174   1.163   7.211
  112   HG13  VAL  15          HG13      VAL  15  12.570   2.754   7.673
  113   HG21  VAL  15          HG21      VAL  15   9.800   3.061   5.756
  114   HG22  VAL  15          HG22      VAL  15  10.768   3.470   7.174
  115   HG23  VAL  15          HG23      VAL  15   9.815   1.985   7.155
  116    H    CYS  16           HN       CYS  16  10.900   3.970   2.779
  117    HA   CYS  16           HA       CYS  16  11.977   6.441   3.879
  118    HB2  CYS  16           HB2      CYS  16  10.840   5.552   1.315
  119    HB3  CYS  16           HB1      CYS  16  10.371   7.186   1.787
  Start of MODEL   13
    1    H1   PHE   1           HT1      PHE   1   9.539  -4.101   7.927
    2    H2   PHE   1           HT2      PHE   1  10.414  -2.674   7.634
    3    H3   PHE   1           HT3      PHE   1  11.206  -4.052   8.237
    4    HA   PHE   1           HA       PHE   1  11.765  -4.004   5.982
    5    HB2  PHE   1           HB2      PHE   1   9.403  -5.843   6.457
    6    HB3  PHE   1           HB1      PHE   1  10.472  -5.960   5.060
    7    HD1  PHE   1           HD1      PHE   1  10.094  -6.603   8.628
    8    HD2  PHE   1           HD2      PHE   1  12.899  -6.472   5.376
    9    HE1  PHE   1           HE1      PHE   1  11.718  -7.905   9.976
   10    HE2  PHE   1           HE2      PHE   1  14.522  -7.774   6.725
   11    HZ   PHE   1           HZ       PHE   1  13.932  -8.491   9.025
   12    H    PHE   2           HN       PHE   2  11.085  -1.792   5.373
   13    HA   PHE   2           HA       PHE   2   8.511  -1.165   4.409
   14    HB2  PHE   2           HB2      PHE   2  10.233   0.542   4.900
   15    HB3  PHE   2           HB1      PHE   2  11.188  -0.036   3.538
   16    HD1  PHE   2           HD1      PHE   2  10.790   2.613   3.139
   17    HD2  PHE   2           HD2      PHE   2   7.825  -0.450   2.647
   18    HE1  PHE   2           HE1      PHE   2   9.514   4.091   1.613
   19    HE2  PHE   2           HE2      PHE   2   6.556   1.017   1.106
   20    HZ   PHE   2           HZ       PHE   2   7.400   3.294   0.595
   21    H    CYS   3           HN       CYS   3  11.437  -2.274   2.719
   22    HA   CYS   3           HA       CYS   3  11.406  -2.412   0.266
   23    HB2  CYS   3           HB2      CYS   3  11.184  -4.760   1.996
   24    HB3  CYS   3           HB1      CYS   3  10.677  -5.080   0.338
   25    H    VAL   4           HN       VAL   4   9.777  -1.295  -0.758
   26    HA   VAL   4           HA       VAL   4   7.034  -1.897  -0.618
   27    HB   VAL   4           HB       VAL   4   6.859  -0.571  -2.710
   28   HG11  VAL   4          HG11      VAL   4   8.595   0.407  -0.441
   29   HG12  VAL   4          HG12      VAL   4   6.886   0.733  -0.732
   30   HG13  VAL   4          HG13      VAL   4   8.113   1.477  -1.758
   31   HG21  VAL   4          HG21      VAL   4   8.943   0.367  -3.668
   32   HG22  VAL   4          HG22      VAL   4   8.912  -1.391  -3.799
   33   HG23  VAL   4          HG23      VAL   4   9.891  -0.617  -2.554
   34    H    GLN   5           HN       GLN   5   9.519  -2.918  -2.961
   35    HA   GLN   5           HA       GLN   5   7.828  -5.221  -3.641
   36    HB2  GLN   5           HB2      GLN   5   9.081  -3.482  -5.770
   37    HB3  GLN   5           HB1      GLN   5   7.974  -4.837  -6.000
   38    HG2  GLN   5           HG2      GLN   5   7.264  -2.296  -4.504
   39    HG3  GLN   5           HG1      GLN   5   6.862  -2.592  -6.195
   40   HE21  GLN   5          HE21      GLN   5   5.130  -2.374  -3.628
   41   HE22  GLN   5          HE22      GLN   5   4.152  -3.767  -3.693
   42    H    GLY   6           HN       GLY   6   9.114  -6.901  -3.168
   43    HA2  GLY   6           HA2      GLY   6  11.068  -8.120  -2.822
   44    HA3  GLY   6           HA1      GLY   6  11.259  -7.795  -4.542
   45    H    DBB   7           HN       DBB   7  11.242  -5.122  -2.367
   46    HA   DBB   7           HA       DBB   7  14.118  -5.020  -2.000
   47    HB2  DBB   7           HB2      DBB   7  11.800  -3.264  -1.234
   48    HG1  DBB   7           HG1      DBB   7  14.702  -2.573  -1.407
   49    HG2  DBB   7           HG2      DBB   7  13.833  -2.058   0.040
   50    HG3  DBB   7           HG3      DBB   7  13.290  -1.524  -1.551
   51    H    ALA   8           HN       ALA   8  11.653  -3.174  -3.779
   52    HA   ALA   8           HA       ALA   8  13.712  -2.334  -5.697
   53    HB1  ALA   8           HB1      ALA   8  10.742  -2.635  -5.773
   54    HB2  ALA   8           HB2      ALA   8  11.956  -3.170  -6.936
   55    HB3  ALA   8           HB3      ALA   8  11.497  -1.469  -6.859
   56    H    ASN   9           HN       ASN   9  12.315  -1.171  -2.933
   57    HA   ASN   9           HA       ASN   9  11.423   1.334  -3.155
   58    HB2  ASN   9           HB2      ASN   9  12.060   0.252  -1.011
   59    HB3  ASN   9           HB1      ASN   9  13.751   0.611  -1.360
   60   HD21  ASN   9          HD21      ASN   9  11.709   1.681   0.746
   61   HD22  ASN   9          HD22      ASN   9  11.892   3.371   0.632
   62    H    ARG  10           HN       ARG  10  14.902   1.256  -2.540
   63    HA   ARG  10           HA       ARG  10  16.640   2.464  -3.442
   64    HB2  ARG  10           HB2      ARG  10  14.845   1.981  -5.784
   65    HB3  ARG  10           HB1      ARG  10  16.225   3.066  -5.971
   66    HG2  ARG  10           HG2      ARG  10  16.873   0.771  -6.558
   67    HG3  ARG  10           HG1      ARG  10  17.715   1.281  -5.092
   68    HD2  ARG  10           HD2      ARG  10  16.113   0.095  -3.702
   69    HD3  ARG  10           HD1      ARG  10  15.139  -0.316  -5.109
   70    HE   ARG  10           HE       ARG  10  17.401  -1.479  -5.812
   71   HH11  ARG  10          HH11      ARG  10  15.937  -1.266  -2.679
   72   HH12  ARG  10          HH12      ARG  10  16.585  -2.772  -2.125
   73   HH21  ARG  10          HH21      ARG  10  18.233  -3.464  -5.095
   74   HH22  ARG  10          HH22      ARG  10  17.882  -4.018  -3.492
   75    H    PHE  11           HN       PHE  11  15.058   3.944  -1.865
   76    HA   PHE  11           HA       PHE  11  15.582   6.582  -2.517
   77    HB2  PHE  11           HB2      PHE  11  13.359   7.446  -3.171
   78    HB3  PHE  11           HB1      PHE  11  14.002   6.326  -4.375
   79    HD1  PHE  11           HD1      PHE  11  12.092   6.102  -1.145
   80    HD2  PHE  11           HD2      PHE  11  12.476   4.787  -5.217
   81    HE1  PHE  11           HE1      PHE  11  10.119   4.636  -0.853
   82    HE2  PHE  11           HE2      PHE  11  10.496   3.323  -4.927
   83    HZ   PHE  11           HZ       PHE  11   9.319   3.244  -2.747
   84    H    DBB  12           HN       DBB  12  14.612   4.265  -0.503
   85    HA   DBB  12           HA       DBB  12  12.802   5.628   1.235
   86    HB2  DBB  12           HB2      DBB  12  14.556   5.725   3.128
   87    HG1  DBB  12           HG1      DBB  12  16.168   4.844   0.934
   88    HG2  DBB  12           HG2      DBB  12  16.677   5.185   2.587
   89    HG3  DBB  12           HG3      DBB  12  16.694   6.468   1.377
   90    H    ILE  13           HN       ILE  13  15.448   3.287   1.093
   91    HA   ILE  13           HA       ILE  13  14.050   0.973   1.332
   92    HB   ILE  13           HB       ILE  13  16.539   1.210   2.969
   93   HG12  ILE  13          HG12      ILE  13  17.189   2.656   1.204
   94   HG13  ILE  13          HG11      ILE  13  17.765   1.072   0.688
   95   HG21  ILE  13          HG21      ILE  13  15.826  -0.700   0.737
   96   HG22  ILE  13          HG22      ILE  13  15.255  -0.943   2.389
   97   HG23  ILE  13          HG23      ILE  13  16.985  -0.938   2.045
   98   HD11  ILE  13          HD11      ILE  13  16.584   1.354  -1.212
   99   HD12  ILE  13          HD12      ILE  13  15.810   2.808  -0.578
  100   HD13  ILE  13          HD13      ILE  13  15.116   1.221  -0.242
  101    H    ASN  14           HN       ASN  14  15.386   2.777   4.108
  102    HA   ASN  14           HA       ASN  14  14.105   1.194   6.080
  103    HB2  ASN  14           HB2      ASN  14  15.332   3.941   6.081
  104    HB3  ASN  14           HB1      ASN  14  14.533   3.297   7.514
  105   HD21  ASN  14          HD21      ASN  14  17.342   3.816   7.542
  106   HD22  ASN  14          HD22      ASN  14  18.162   2.331   7.626
  107    H    VAL  15           HN       VAL  15  13.219   4.204   4.454
  108    HA   VAL  15           HA       VAL  15  10.558   3.983   4.232
  109    HB   VAL  15           HB       VAL  15  10.175   3.418   6.515
  110   HG11  VAL  15          HG11      VAL  15  11.027   5.471   8.125
  111   HG12  VAL  15          HG12      VAL  15  12.325   5.394   6.933
  112   HG13  VAL  15          HG13      VAL  15  11.912   3.965   7.881
  113   HG21  VAL  15          HG21      VAL  15   8.532   4.957   6.965
  114   HG22  VAL  15          HG22      VAL  15   8.945   5.527   5.349
  115   HG23  VAL  15          HG23      VAL  15   9.621   6.330   6.767
  116    H    CYS  16           HN       CYS  16  11.972   5.405   2.714
  117    HA   CYS  16           HA       CYS  16  11.224   8.164   3.256
  118    HB2  CYS  16           HB2      CYS  16  13.308   9.091   3.361
  119    HB3  CYS  16           HB1      CYS  16  13.699   7.513   4.045
  Start of MODEL   14
    1    H1   PHE   1           HT1      PHE   1  11.738  -2.847   5.901
    2    H2   PHE   1           HT2      PHE   1  11.511  -3.415   7.486
    3    H3   PHE   1           HT3      PHE   1  10.903  -1.895   7.028
    4    HA   PHE   1           HA       PHE   1  10.005  -4.486   5.892
    5    HB2  PHE   1           HB2      PHE   1   8.792  -2.676   8.001
    6    HB3  PHE   1           HB1      PHE   1   7.914  -3.980   7.201
    7    HD1  PHE   1           HD1      PHE   1  10.343  -3.123   9.758
    8    HD2  PHE   1           HD2      PHE   1   8.745  -6.352   7.419
    9    HE1  PHE   1           HE1      PHE   1  11.317  -4.757  11.348
   10    HE2  PHE   1           HE2      PHE   1   9.720  -7.987   9.010
   11    HZ   PHE   1           HZ       PHE   1  11.005  -7.189  10.975
   12    H    PHE   2           HN       PHE   2  10.528  -1.230   5.442
   13    HA   PHE   2           HA       PHE   2   8.152  -0.320   4.241
   14    HB2  PHE   2           HB2      PHE   2  10.061   1.137   4.886
   15    HB3  PHE   2           HB1      PHE   2  10.986   0.472   3.539
   16    HD1  PHE   2           HD1      PHE   2   8.446   2.848   4.540
   17    HD2  PHE   2           HD2      PHE   2  10.092   0.735   1.182
   18    HE1  PHE   2           HE1      PHE   2   7.370   4.463   2.996
   19    HE2  PHE   2           HE2      PHE   2   9.015   2.348  -0.363
   20    HZ   PHE   2           HZ       PHE   2   7.654   4.214   0.545
   21    H    CYS   3           HN       CYS   3  11.009  -1.911   2.854
   22    HA   CYS   3           HA       CYS   3  11.110  -2.058   0.364
   23    HB2  CYS   3           HB2      CYS   3  10.406  -4.367   2.097
   24    HB3  CYS   3           HB1      CYS   3  10.362  -4.620   0.353
   25    H    VAL   4           HN       VAL   4   9.775  -1.139  -1.058
   26    HA   VAL   4           HA       VAL   4   6.952  -1.329  -1.015
   27    HB   VAL   4           HB       VAL   4   7.161  -0.463  -3.397
   28   HG11  VAL   4          HG11      VAL   4   7.510   0.775  -0.934
   29   HG12  VAL   4          HG12      VAL   4   7.238   1.599  -2.469
   30   HG13  VAL   4          HG13      VAL   4   8.881   1.354  -1.878
   31   HG21  VAL   4          HG21      VAL   4  10.101  -0.448  -2.638
   32   HG22  VAL   4          HG22      VAL   4   9.405   0.223  -4.112
   33   HG23  VAL   4          HG23      VAL   4   9.375  -1.519  -3.836
   34    H    GLN   5           HN       GLN   5   9.449  -3.089  -2.803
   35    HA   GLN   5           HA       GLN   5   7.702  -5.359  -3.129
   36    HB2  GLN   5           HB2      GLN   5   8.292  -5.182  -5.744
   37    HB3  GLN   5           HB1      GLN   5   6.805  -4.525  -5.059
   38    HG2  GLN   5           HG2      GLN   5   7.900  -2.324  -4.798
   39    HG3  GLN   5           HG1      GLN   5   9.378  -2.982  -5.500
   40   HE21  GLN   5          HE21      GLN   5   8.426  -0.882  -6.906
   41   HE22  GLN   5          HE22      GLN   5   7.608  -1.381  -8.316
   42    H    GLY   6           HN       GLY   6   9.196  -6.717  -2.276
   43    HA2  GLY   6           HA2      GLY   6  11.112  -7.978  -2.094
   44    HA3  GLY   6           HA1      GLY   6  11.256  -7.767  -3.837
   45    H    DBB   7           HN       DBB   7  11.375  -5.298  -1.291
   46    HA   DBB   7           HA       DBB   7  14.130  -4.990  -1.056
   47    HB2  DBB   7           HB2      DBB   7  11.908  -2.963  -0.866
   48    HG1  DBB   7           HG1      DBB   7  14.799  -2.694   0.007
   49    HG2  DBB   7           HG2      DBB   7  13.525  -1.499   0.250
   50    HG3  DBB   7           HG3      DBB   7  14.085  -1.874  -1.381
   51    H    ALA   8           HN       ALA   8  12.133  -2.649  -2.846
   52    HA   ALA   8           HA       ALA   8  14.385  -2.265  -4.707
   53    HB1  ALA   8           HB1      ALA   8  12.940  -3.736  -5.922
   54    HB2  ALA   8           HB2      ALA   8  12.679  -2.117  -6.571
   55    HB3  ALA   8           HB3      ALA   8  11.508  -2.817  -5.453
   56    H    ASN   9           HN       ASN   9  13.482  -0.687  -2.462
   57    HA   ASN   9           HA       ASN   9  12.335   1.677  -3.800
   58    HB2  ASN   9           HB2      ASN   9  11.773   2.480  -1.573
   59    HB3  ASN   9           HB1      ASN   9  11.141   0.849  -1.792
   60   HD21  ASN   9          HD21      ASN   9  11.582   1.797   0.828
   61   HD22  ASN   9          HD22      ASN   9  12.908   0.968   1.504
   62    H    ARG  10           HN       ARG  10  14.087   2.659  -4.721
   63    HA   ARG  10           HA       ARG  10  16.640   2.894  -3.501
   64    HB2  ARG  10           HB2      ARG  10  15.638   4.903  -5.485
   65    HB3  ARG  10           HB1      ARG  10  17.236   4.168  -5.346
   66    HG2  ARG  10           HG2      ARG  10  14.698   2.893  -6.385
   67    HG3  ARG  10           HG1      ARG  10  16.213   3.147  -7.250
   68    HD2  ARG  10           HD2      ARG  10  17.325   1.620  -5.574
   69    HD3  ARG  10           HD1      ARG  10  15.721   1.252  -4.941
   70    HE   ARG  10           HE       ARG  10  15.337  -0.071  -6.809
   71   HH11  ARG  10          HH11      ARG  10  18.072   1.998  -7.277
   72   HH12  ARG  10          HH12      ARG  10  18.557   1.250  -8.763
   73   HH21  ARG  10          HH21      ARG  10  15.967  -1.055  -8.757
   74   HH22  ARG  10          HH22      ARG  10  17.366  -0.477  -9.600
   75    H    PHE  11           HN       PHE  11  13.795   4.992  -3.586
   76    HA   PHE  11           HA       PHE  11  14.931   7.259  -2.368
   77    HB2  PHE  11           HB2      PHE  11  12.517   7.703  -1.647
   78    HB3  PHE  11           HB1      PHE  11  12.795   7.518  -3.380
   79    HD1  PHE  11           HD1      PHE  11  11.250   6.077  -0.400
   80    HD2  PHE  11           HD2      PHE  11  12.205   5.394  -4.528
   81    HE1  PHE  11           HE1      PHE  11   9.659   4.178  -0.448
   82    HE2  PHE  11           HE2      PHE  11  10.612   3.498  -4.585
   83    HZ   PHE  11           HZ       PHE  11   9.349   2.883  -2.548
   84    H    DBB  12           HN       DBB  12  13.038   4.608  -0.899
   85    HA   DBB  12           HA       DBB  12  12.694   4.147   1.351
   86    HB2  DBB  12           HB2      DBB  12  13.322   5.610   3.021
   87    HG1  DBB  12           HG1      DBB  12  15.833   5.590   1.600
   88    HG2  DBB  12           HG2      DBB  12  15.521   6.015   3.284
   89    HG3  DBB  12           HG3      DBB  12  15.386   7.242   2.025
   90    H    ILE  13           HN       ILE  13  14.242   2.618  -0.231
   91    HA   ILE  13           HA       ILE  13  15.738   0.888  -0.095
   92    HB   ILE  13           HB       ILE  13  17.483   2.708   1.556
   93   HG12  ILE  13          HG12      ILE  13  18.124   2.931  -1.196
   94   HG13  ILE  13          HG11      ILE  13  16.385   3.199  -1.064
   95   HG21  ILE  13          HG21      ILE  13  19.105   1.473  -0.181
   96   HG22  ILE  13          HG22      ILE  13  17.804   0.282  -0.153
   97   HG23  ILE  13          HG23      ILE  13  18.631   0.719   1.342
   98   HD11  ILE  13          HD11      ILE  13  17.746   4.551   1.093
   99   HD12  ILE  13          HD12      ILE  13  16.717   5.234  -0.167
  100   HD13  ILE  13          HD13      ILE  13  18.447   5.033  -0.452
  101    H    ASN  14           HN       ASN  14  13.940   1.873   2.347
  102    HA   ASN  14           HA       ASN  14  13.899  -0.374   3.872
  103    HB2  ASN  14           HB2      ASN  14  15.849  -0.503   4.971
  104    HB3  ASN  14           HB1      ASN  14  16.364   1.056   4.334
  105   HD21  ASN  14          HD21      ASN  14  16.644   2.647   5.902
  106   HD22  ASN  14          HD22      ASN  14  15.886   2.658   7.420
  107    H    VAL  15           HN       VAL  15  13.534   3.001   3.553
  108    HA   VAL  15           HA       VAL  15  11.303   2.960   5.439
  109    HB   VAL  15           HB       VAL  15  12.061   5.129   6.432
  110   HG11  VAL  15          HG11      VAL  15  13.509   2.532   6.778
  111   HG12  VAL  15          HG12      VAL  15  12.432   3.369   7.895
  112   HG13  VAL  15          HG13      VAL  15  14.084   3.942   7.666
  113   HG21  VAL  15          HG21      VAL  15  14.826   4.984   6.068
  114   HG22  VAL  15          HG22      VAL  15  13.747   6.172   5.336
  115   HG23  VAL  15          HG23      VAL  15  14.171   4.704   4.455
  116    H    CYS  16           HN       CYS  16  12.066   6.102   4.918
  117    HA   CYS  16           HA       CYS  16  10.164   7.260   3.721
  118    HB2  CYS  16           HB2      CYS  16  11.550   8.750   2.658
  119    HB3  CYS  16           HB1      CYS  16  12.747   7.909   3.643
  Start of MODEL   15
    1    H1   PHE   1           HT1      PHE   1  12.982  -2.652   5.574
    2    H2   PHE   1           HT2      PHE   1  13.573  -3.611   6.846
    3    H3   PHE   1           HT3      PHE   1  13.007  -2.039   7.154
    4    HA   PHE   1           HA       PHE   1  11.513  -4.507   6.704
    5    HB2  PHE   1           HB2      PHE   1  11.090  -1.995   8.351
    6    HB3  PHE   1           HB1      PHE   1  10.025  -3.401   8.370
    7    HD1  PHE   1           HD1      PHE   1  13.128  -1.973   9.582
    8    HD2  PHE   1           HD2      PHE   1  10.948  -5.642   9.096
    9    HE1  PHE   1           HE1      PHE   1  14.608  -3.073  11.240
   10    HE2  PHE   1           HE2      PHE   1  12.429  -6.742  10.754
   11    HZ   PHE   1           HZ       PHE   1  14.260  -5.457  11.826
   12    H    PHE   2           HN       PHE   2  11.905  -1.465   5.259
   13    HA   PHE   2           HA       PHE   2   9.138  -1.397   4.254
   14    HB2  PHE   2           HB2      PHE   2   9.847   0.734   5.070
   15    HB3  PHE   2           HB1      PHE   2  11.379   0.629   4.204
   16    HD1  PHE   2           HD1      PHE   2   8.165  -0.474   2.762
   17    HD2  PHE   2           HD2      PHE   2  11.093   2.659   2.927
   18    HE1  PHE   2           HE1      PHE   2   7.129   0.599   0.781
   19    HE2  PHE   2           HE2      PHE   2  10.062   3.734   0.946
   20    HZ   PHE   2           HZ       PHE   2   8.077   2.703  -0.129
   21    H    CYS   3           HN       CYS   3   9.343  -3.187   2.828
   22    HA   CYS   3           HA       CYS   3  11.193  -2.808   0.568
   23    HB2  CYS   3           HB2      CYS   3  10.238  -5.114   2.010
   24    HB3  CYS   3           HB1      CYS   3   9.833  -5.263   0.301
   25    H    VAL   4           HN       VAL   4  10.468  -2.324  -1.422
   26    HA   VAL   4           HA       VAL   4   7.542  -2.339  -1.856
   27    HB   VAL   4           HB       VAL   4   7.971  -0.450  -3.452
   28   HG11  VAL   4          HG11      VAL   4   7.583   1.018  -1.759
   29   HG12  VAL   4          HG12      VAL   4   9.069   0.580  -0.917
   30   HG13  VAL   4          HG13      VAL   4   7.623  -0.412  -0.730
   31   HG21  VAL   4          HG21      VAL   4  10.133  -0.157  -4.055
   32   HG22  VAL   4          HG22      VAL   4  10.715  -1.125  -2.702
   33   HG23  VAL   4          HG23      VAL   4  10.365   0.588  -2.474
   34    H    GLN   5           HN       GLN   5   6.825  -3.546  -3.494
   35    HA   GLN   5           HA       GLN   5   6.949  -5.180  -5.138
   36    HB2  GLN   5           HB2      GLN   5   8.194  -4.103  -7.216
   37    HB3  GLN   5           HB1      GLN   5   6.633  -3.489  -6.673
   38    HG2  GLN   5           HG2      GLN   5   7.790  -1.774  -5.312
   39    HG3  GLN   5           HG1      GLN   5   9.342  -2.374  -5.894
   40   HE21  GLN   5          HE21      GLN   5   8.127  -2.900  -8.641
   41   HE22  GLN   5          HE22      GLN   5   8.023  -1.363  -9.359
   42    H    GLY   6           HN       GLY   6   8.458  -6.410  -3.649
   43    HA2  GLY   6           HA2      GLY   6  10.267  -7.818  -3.451
   44    HA3  GLY   6           HA1      GLY   6  10.593  -7.495  -5.151
   45    H    DBB   7           HN       DBB   7  11.036  -6.196  -1.882
   46    HA   DBB   7           HA       DBB   7  13.607  -5.727  -1.663
   47    HB2  DBB   7           HB2      DBB   7  11.396  -3.763  -1.104
   48    HG1  DBB   7           HG1      DBB   7  13.706  -3.101   0.402
   49    HG2  DBB   7           HG2      DBB   7  12.902  -2.115  -0.819
   50    HG3  DBB   7           HG3      DBB   7  14.212  -3.200  -1.285
   51    H    ALA   8           HN       ALA   8  11.557  -3.502  -3.556
   52    HA   ALA   8           HA       ALA   8  13.934  -2.824  -5.167
   53    HB1  ALA   8           HB1      ALA   8  11.736  -1.791  -6.489
   54    HB2  ALA   8           HB2      ALA   8  11.115  -3.285  -5.788
   55    HB3  ALA   8           HB3      ALA   8  12.522  -3.329  -6.850
   56    H    ASN   9           HN       ASN   9  13.106  -1.664  -2.519
   57    HA   ASN   9           HA       ASN   9  12.324   1.063  -3.194
   58    HB2  ASN   9           HB2      ASN   9  11.477  -0.114  -1.139
   59    HB3  ASN   9           HB1      ASN   9  13.120  -0.064  -0.508
   60   HD21  ASN   9          HD21      ASN   9  12.247   1.336   1.261
   61   HD22  ASN   9          HD22      ASN   9  11.998   2.991   0.958
   62    H    ARG  10           HN       ARG  10  13.874   2.306  -4.049
   63    HA   ARG  10           HA       ARG  10  16.542   2.271  -2.772
   64    HB2  ARG  10           HB2      ARG  10  15.726   2.430  -5.643
   65    HB3  ARG  10           HB1      ARG  10  17.191   3.264  -5.126
   66    HG2  ARG  10           HG2      ARG  10  17.559   0.888  -5.917
   67    HG3  ARG  10           HG1      ARG  10  18.148   1.214  -4.286
   68    HD2  ARG  10           HD2      ARG  10  16.444   0.002  -3.280
   69    HD3  ARG  10           HD1      ARG  10  15.336   0.239  -4.628
   70    HE   ARG  10           HE       ARG  10  17.176  -1.928  -4.313
   71   HH11  ARG  10          HH11      ARG  10  15.718   0.202  -6.616
   72   HH12  ARG  10          HH12      ARG  10  15.841  -0.915  -7.934
   73   HH21  ARG  10          HH21      ARG  10  17.341  -3.399  -6.036
   74   HH22  ARG  10          HH22      ARG  10  16.759  -2.954  -7.606
   75    H    PHE  11           HN       PHE  11  13.916   3.903  -2.503
   76    HA   PHE  11           HA       PHE  11  15.170   6.565  -2.796
   77    HB2  PHE  11           HB2      PHE  11  12.775   7.399  -2.808
   78    HB3  PHE  11           HB1      PHE  11  13.286   6.505  -4.240
   79    HD1  PHE  11           HD1      PHE  11  11.502   6.164  -0.983
   80    HD2  PHE  11           HD2      PHE  11  12.229   4.476  -4.861
   81    HE1  PHE  11           HE1      PHE  11   9.697   4.517  -0.599
   82    HE2  PHE  11           HE2      PHE  11  10.425   2.830  -4.489
   83    HZ   PHE  11           HZ       PHE  11   9.150   2.844  -2.362
   84    H    DBB  12           HN       DBB  12  13.705   4.287  -0.668
   85    HA   DBB  12           HA       DBB  12  12.627   5.657   1.408
   86    HB2  DBB  12           HB2      DBB  12  14.845   5.855   2.854
   87    HG1  DBB  12           HG1      DBB  12  16.099   7.049   0.505
   88    HG2  DBB  12           HG2      DBB  12  15.900   5.306   0.322
   89    HG3  DBB  12           HG3      DBB  12  16.791   5.950   1.701
   90    H    ILE  13           HN       ILE  13  15.607   3.712   1.221
   91    HA   ILE  13           HA       ILE  13  14.578   1.210   1.663
   92    HB   ILE  13           HB       ILE  13  17.072   1.902   3.138
   93   HG12  ILE  13          HG12      ILE  13  17.392   3.380   1.301
   94   HG13  ILE  13          HG11      ILE  13  18.228   1.899   0.832
   95   HG21  ILE  13          HG21      ILE  13  15.967  -0.433   2.480
   96   HG22  ILE  13          HG22      ILE  13  17.718  -0.220   2.467
   97   HG23  ILE  13          HG23      ILE  13  16.807  -0.132   0.958
   98   HD11  ILE  13          HD11      ILE  13  16.953   1.828  -1.020
   99   HD12  ILE  13          HD12      ILE  13  16.006   3.210  -0.466
  100   HD13  ILE  13          HD13      ILE  13  15.544   1.576   0.009
  101    H    ASN  14           HN       ASN  14  15.134   3.757   4.012
  102    HA   ASN  14           HA       ASN  14  14.157   1.996   6.164
  103    HB2  ASN  14           HB2      ASN  14  16.299   3.182   6.549
  104    HB3  ASN  14           HB1      ASN  14  15.459   4.719   6.353
  105   HD21  ASN  14          HD21      ASN  14  16.000   2.026   8.547
  106   HD22  ASN  14          HD22      ASN  14  15.129   2.675   9.852
  107    H    VAL  15           HN       VAL  15  12.295   2.884   4.252
  108    HA   VAL  15           HA       VAL  15  10.153   3.729   4.219
  109    HB   VAL  15           HB       VAL  15  10.611   4.653   7.058
  110   HG11  VAL  15          HG11      VAL  15   8.487   5.358   6.756
  111   HG12  VAL  15          HG12      VAL  15   8.026   3.657   6.682
  112   HG13  VAL  15          HG13      VAL  15   8.370   4.544   5.197
  113   HG21  VAL  15          HG21      VAL  15  11.120   2.126   6.394
  114   HG22  VAL  15          HG22      VAL  15   9.359   2.011   6.401
  115   HG23  VAL  15          HG23      VAL  15  10.218   2.511   7.859
  116    H    CYS  16           HN       CYS  16  11.677   5.226   2.840
  117    HA   CYS  16           HA       CYS  16  10.952   7.962   3.573
  118    HB2  CYS  16           HB2      CYS  16  13.041   8.743   3.861
  119    HB3  CYS  16           HB1      CYS  16  13.519   7.056   4.043
  Start of MODEL   16
    1    H1   PHE   1           HT1      PHE   1  14.545  -2.413   7.269
    2    H2   PHE   1           HT2      PHE   1  13.106  -1.748   7.881
    3    H3   PHE   1           HT3      PHE   1  13.551  -1.474   6.265
    4    HA   PHE   1           HA       PHE   1  13.461  -4.009   6.023
    5    HB2  PHE   1           HB2      PHE   1  11.824  -3.511   8.528
    6    HB3  PHE   1           HB1      PHE   1  11.772  -5.000   7.584
    7    HD1  PHE   1           HD1      PHE   1  13.616  -3.063  10.040
    8    HD2  PHE   1           HD2      PHE   1  13.865  -6.381   7.322
    9    HE1  PHE   1           HE1      PHE   1  15.625  -3.893  11.235
   10    HE2  PHE   1           HE2      PHE   1  15.874  -7.210   8.518
   11    HZ   PHE   1           HZ       PHE   1  16.754  -5.965  10.474
   12    H    PHE   2           HN       PHE   2  12.643  -1.571   4.865
   13    HA   PHE   2           HA       PHE   2   9.741  -1.962   4.470
   14    HB2  PHE   2           HB2      PHE   2  10.174   0.275   5.187
   15    HB3  PHE   2           HB1      PHE   2  11.519   0.443   4.061
   16    HD1  PHE   2           HD1      PHE   2   8.153  -1.060   3.463
   17    HD2  PHE   2           HD2      PHE   2  10.844   2.180   2.621
   18    HE1  PHE   2           HE1      PHE   2   6.598  -0.219   1.723
   19    HE2  PHE   2           HE2      PHE   2   9.291   3.021   0.883
   20    HZ   PHE   2           HZ       PHE   2   7.166   1.822   0.433
   21    H    CYS   3           HN       CYS   3   9.137  -2.908   2.639
   22    HA   CYS   3           HA       CYS   3  10.775  -2.484   0.234
   23    HB2  CYS   3           HB2      CYS   3  10.126  -5.057   1.547
   24    HB3  CYS   3           HB1      CYS   3   9.950  -5.008  -0.208
   25    H    VAL   4           HN       VAL   4   9.466  -1.360  -1.033
   26    HA   VAL   4           HA       VAL   4   6.642  -1.443  -0.953
   27    HB   VAL   4           HB       VAL   4   6.975  -0.316  -3.292
   28   HG11  VAL   4          HG11      VAL   4   8.343   1.150  -1.069
   29   HG12  VAL   4          HG12      VAL   4   6.674   0.637  -0.823
   30   HG13  VAL   4          HG13      VAL   4   7.079   1.710  -2.164
   31   HG21  VAL   4          HG21      VAL   4   9.753   0.078  -2.196
   32   HG22  VAL   4          HG22      VAL   4   9.161   0.356  -3.835
   33   HG23  VAL   4          HG23      VAL   4   9.412  -1.291  -3.255
   34    H    GLN   5           HN       GLN   5   9.012  -3.039  -3.068
   35    HA   GLN   5           HA       GLN   5   7.195  -5.181  -3.624
   36    HB2  GLN   5           HB2      GLN   5   7.451  -4.591  -6.218
   37    HB3  GLN   5           HB1      GLN   5   6.091  -4.012  -5.255
   38    HG2  GLN   5           HG2      GLN   5   7.297  -1.905  -4.813
   39    HG3  GLN   5           HG1      GLN   5   8.656  -2.480  -5.777
   40   HE21  GLN   5          HE21      GLN   5   8.133  -0.458  -7.117
   41   HE22  GLN   5          HE22      GLN   5   6.928  -0.595  -8.314
   42    H    GLY   6           HN       GLY   6   8.822  -6.589  -3.096
   43    HA2  GLY   6           HA2      GLY   6  10.616  -7.976  -3.518
   44    HA3  GLY   6           HA1      GLY   6  10.712  -7.254  -5.121
   45    H    DBB   7           HN       DBB   7  10.833  -5.245  -2.286
   46    HA   DBB   7           HA       DBB   7  13.622  -5.207  -1.848
   47    HB2  DBB   7           HB2      DBB   7  11.406  -3.249  -1.289
   48    HG1  DBB   7           HG1      DBB   7  12.910  -1.593  -1.053
   49    HG2  DBB   7           HG2      DBB   7  14.224  -2.686  -1.487
   50    HG3  DBB   7           HG3      DBB   7  13.713  -2.546   0.195
   51    H    ALA   8           HN       ALA   8  11.510  -3.142  -3.816
   52    HA   ALA   8           HA       ALA   8  13.744  -2.544  -5.593
   53    HB1  ALA   8           HB1      ALA   8  11.458  -1.160  -6.452
   54    HB2  ALA   8           HB2      ALA   8  10.868  -2.699  -5.826
   55    HB3  ALA   8           HB3      ALA   8  12.089  -2.675  -7.098
   56    H    ASN   9           HN       ASN   9  12.776  -1.285  -2.764
   57    HA   ASN   9           HA       ASN   9  12.765   1.530  -3.471
   58    HB2  ASN   9           HB2      ASN   9  11.425   0.602  -1.576
   59    HB3  ASN   9           HB1      ASN   9  12.933   0.251  -0.735
   60   HD21  ASN   9          HD21      ASN   9  11.111   2.042   0.450
   61   HD22  ASN   9          HD22      ASN   9  11.750   3.619   0.385
   62    H    ARG  10           HN       ARG  10  14.679   2.240  -4.232
   63    HA   ARG  10           HA       ARG  10  17.154   1.531  -2.804
   64    HB2  ARG  10           HB2      ARG  10  16.503   2.478  -5.557
   65    HB3  ARG  10           HB1      ARG  10  18.069   2.925  -4.878
   66    HG2  ARG  10           HG2      ARG  10  18.200   0.788  -6.121
   67    HG3  ARG  10           HG1      ARG  10  18.555   0.560  -4.407
   68    HD2  ARG  10           HD2      ARG  10  16.521  -0.493  -3.985
   69    HD3  ARG  10           HD1      ARG  10  15.729   0.260  -5.367
   70    HE   ARG  10           HE       ARG  10  16.640  -1.408  -6.756
   71   HH11  ARG  10          HH11      ARG  10  17.816  -1.578  -3.506
   72   HH12  ARG  10          HH12      ARG  10  18.505  -3.156  -3.692
   73   HH21  ARG  10          HH21      ARG  10  17.537  -3.478  -7.005
   74   HH22  ARG  10          HH22      ARG  10  18.347  -4.232  -5.673
   75    H    PHE  11           HN       PHE  11  14.852   3.700  -2.405
   76    HA   PHE  11           HA       PHE  11  16.702   5.935  -1.847
   77    HB2  PHE  11           HB2      PHE  11  14.540   7.334  -1.890
   78    HB3  PHE  11           HB1      PHE  11  15.148   6.751  -3.439
   79    HD1  PHE  11           HD1      PHE  11  12.274   7.024  -1.437
   80    HD2  PHE  11           HD2      PHE  11  14.274   4.289  -4.079
   81    HE1  PHE  11           HE1      PHE  11  10.147   5.800  -1.783
   82    HE2  PHE  11           HE2      PHE  11  12.146   3.068  -4.425
   83    HZ   PHE  11           HZ       PHE  11  10.091   3.813  -3.267
   84    H    DBB  12           HN       DBB  12  13.430   5.129  -0.708
   85    HA   DBB  12           HA       DBB  12  12.532   4.829   1.342
   86    HB2  DBB  12           HB2      DBB  12  13.189   6.328   3.103
   87    HG1  DBB  12           HG1      DBB  12  15.253   7.406   3.272
   88    HG2  DBB  12           HG2      DBB  12  15.595   7.232   1.550
   89    HG3  DBB  12           HG3      DBB  12  15.725   5.837   2.619
   90    H    ILE  13           HN       ILE  13  13.909   2.769   0.554
   91    HA   ILE  13           HA       ILE  13  14.687   0.783   1.377
   92    HB   ILE  13           HB       ILE  13  16.844   2.430   2.691
   93   HG12  ILE  13          HG12      ILE  13  17.373   1.670  -0.072
   94   HG13  ILE  13          HG11      ILE  13  15.992   2.762   0.041
   95   HG21  ILE  13          HG21      ILE  13  17.962   0.468   2.745
   96   HG22  ILE  13          HG22      ILE  13  17.572   0.123   1.060
   97   HG23  ILE  13          HG23      ILE  13  16.431  -0.307   2.334
   98   HD11  ILE  13          HD11      ILE  13  17.896   4.182  -0.131
   99   HD12  ILE  13          HD12      ILE  13  18.810   3.221   1.031
  100   HD13  ILE  13          HD13      ILE  13  17.451   4.206   1.576
  101    H    ASN  14           HN       ASN  14  13.060   2.721   3.206
  102    HA   ASN  14           HA       ASN  14  12.882   0.947   5.432
  103    HB2  ASN  14           HB2      ASN  14  14.351   3.553   5.772
  104    HB3  ASN  14           HB1      ASN  14  13.472   2.822   7.113
  105   HD21  ASN  14          HD21      ASN  14  14.037   0.039   6.337
  106   HD22  ASN  14          HD22      ASN  14  15.687  -0.221   6.633
  107    H    VAL  15           HN       VAL  15  12.204   4.093   4.008
  108    HA   VAL  15           HA       VAL  15   9.399   3.821   4.550
  109    HB   VAL  15           HB       VAL  15   9.738   4.628   6.703
  110   HG11  VAL  15          HG11      VAL  15  12.202   5.577   5.573
  111   HG12  VAL  15          HG12      VAL  15  11.778   5.384   7.274
  112   HG13  VAL  15          HG13      VAL  15  11.429   6.901   6.444
  113   HG21  VAL  15          HG21      VAL  15   8.442   6.481   6.591
  114   HG22  VAL  15          HG22      VAL  15   8.581   6.337   4.838
  115   HG23  VAL  15          HG23      VAL  15   9.685   7.387   5.728
  116    H    CYS  16           HN       CYS  16  11.072   6.912   4.487
  117    HA   CYS  16           HA       CYS  16  11.183   8.577   2.913
  118    HB2  CYS  16           HB2      CYS  16  11.224   6.103   1.309
  119    HB3  CYS  16           HB1      CYS  16  10.696   7.545   0.445
  Start of MODEL   17
    1    H1   PHE   1           HT1      PHE   1  11.614  -2.368   8.915
    2    H2   PHE   1           HT2      PHE   1  10.548  -1.370   8.047
    3    H3   PHE   1           HT3      PHE   1  12.197  -1.412   7.643
    4    HA   PHE   1           HA       PHE   1  12.058  -3.396   6.569
    5    HB2  PHE   1           HB2      PHE   1  11.235  -4.661   8.480
    6    HB3  PHE   1           HB1      PHE   1   9.634  -3.941   8.306
    7    HD1  PHE   1           HD1      PHE   1  12.168  -5.951   6.416
    8    HD2  PHE   1           HD2      PHE   1   8.019  -4.980   6.960
    9    HE1  PHE   1           HE1      PHE   1  11.540  -7.725   4.801
   10    HE2  PHE   1           HE2      PHE   1   7.392  -6.754   5.345
   11    HZ   PHE   1           HZ       PHE   1   9.153  -8.127   4.265
   12    H    PHE   2           HN       PHE   2  11.541  -1.317   5.253
   13    HA   PHE   2           HA       PHE   2   8.787  -1.448   4.197
   14    HB2  PHE   2           HB2      PHE   2   9.275   0.768   4.907
   15    HB3  PHE   2           HB1      PHE   2  10.872   0.733   4.159
   16    HD1  PHE   2           HD1      PHE   2   7.644  -0.478   2.744
   17    HD2  PHE   2           HD2      PHE   2  10.758   2.476   2.562
   18    HE1  PHE   2           HE1      PHE   2   6.683   0.411   0.635
   19    HE2  PHE   2           HE2      PHE   2   9.798   3.368   0.466
   20    HZ   PHE   2           HZ       PHE   2   7.756   2.337  -0.500
   21    H    CYS   3           HN       CYS   3   8.552  -2.569   2.388
   22    HA   CYS   3           HA       CYS   3  10.612  -2.331   0.312
   23    HB2  CYS   3           HB2      CYS   3   9.845  -4.782   1.748
   24    HB3  CYS   3           HB1      CYS   3   9.826  -4.924  -0.009
   25    H    VAL   4           HN       VAL   4   9.420  -1.212  -1.144
   26    HA   VAL   4           HA       VAL   4   6.647  -1.556  -1.595
   27    HB   VAL   4           HB       VAL   4   7.303  -0.416  -3.862
   28   HG11  VAL   4          HG11      VAL   4   6.446   1.273  -2.646
   29   HG12  VAL   4          HG12      VAL   4   8.065   1.574  -2.011
   30   HG13  VAL   4          HG13      VAL   4   6.963   0.501  -1.147
   31   HG21  VAL   4          HG21      VAL   4   9.469   0.568  -3.928
   32   HG22  VAL   4          HG22      VAL   4   9.752  -1.108  -3.457
   33   HG23  VAL   4          HG23      VAL   4   9.788   0.169  -2.239
   34    H    GLN   5           HN       GLN   5   9.498  -2.816  -3.299
   35    HA   GLN   5           HA       GLN   5   7.825  -4.984  -4.359
   36    HB2  GLN   5           HB2      GLN   5   9.707  -3.373  -6.102
   37    HB3  GLN   5           HB1      GLN   5   8.662  -4.701  -6.610
   38    HG2  GLN   5           HG2      GLN   5   7.670  -2.097  -5.416
   39    HG3  GLN   5           HG1      GLN   5   7.701  -2.456  -7.142
   40   HE21  GLN   5          HE21      GLN   5   5.416  -2.132  -5.010
   41   HE22  GLN   5          HE22      GLN   5   4.426  -3.479  -5.316
   42    H    GLY   6           HN       GLY   6   8.802  -6.684  -3.416
   43    HA2  GLY   6           HA2      GLY   6  10.496  -8.030  -2.568
   44    HA3  GLY   6           HA1      GLY   6  11.103  -7.863  -4.213
   45    H    DBB   7           HN       DBB   7  10.863  -5.000  -2.310
   46    HA   DBB   7           HA       DBB   7  13.608  -5.140  -1.342
   47    HB2  DBB   7           HB2      DBB   7  11.375  -3.146  -1.073
   48    HG1  DBB   7           HG1      DBB   7  13.419  -2.284   0.595
   49    HG2  DBB   7           HG2      DBB   7  12.949  -1.522  -0.925
   50    HG3  DBB   7           HG3      DBB   7  14.266  -2.694  -0.898
   51    H    ALA   8           HN       ALA   8  11.695  -3.294  -3.691
   52    HA   ALA   8           HA       ALA   8  14.185  -2.595  -5.083
   53    HB1  ALA   8           HB1      ALA   8  11.560  -1.906  -6.271
   54    HB2  ALA   8           HB2      ALA   8  11.902  -3.627  -6.085
   55    HB3  ALA   8           HB3      ALA   8  12.991  -2.608  -7.025
   56    H    ASN   9           HN       ASN   9  13.225  -1.248  -2.615
   57    HA   ASN   9           HA       ASN   9  12.368   1.387  -3.525
   58    HB2  ASN   9           HB2      ASN   9  11.470   0.409  -1.433
   59    HB3  ASN   9           HB1      ASN   9  13.096   0.431  -0.751
   60   HD21  ASN   9          HD21      ASN   9  11.650   1.909   0.818
   61   HD22  ASN   9          HD22      ASN   9  11.703   3.571   0.464
   62    H    ARG  10           HN       ARG  10  13.986   2.420  -4.585
   63    HA   ARG  10           HA       ARG  10  16.635   2.562  -3.290
   64    HB2  ARG  10           HB2      ARG  10  16.366   3.744  -5.958
   65    HB3  ARG  10           HB1      ARG  10  17.553   2.595  -5.353
   66    HG2  ARG  10           HG2      ARG  10  14.716   1.892  -6.159
   67    HG3  ARG  10           HG1      ARG  10  16.150   1.609  -7.149
   68    HD2  ARG  10           HD2      ARG  10  15.693   0.464  -4.381
   69    HD3  ARG  10           HD1      ARG  10  15.477  -0.421  -5.887
   70    HE   ARG  10           HE       ARG  10  17.998   0.252  -4.625
   71   HH11  ARG  10          HH11      ARG  10  16.327  -0.557  -7.544
   72   HH12  ARG  10          HH12      ARG  10  17.730  -1.190  -8.338
   73   HH21  ARG  10          HH21      ARG  10  19.846  -0.577  -5.659
   74   HH22  ARG  10          HH22      ARG  10  19.722  -1.201  -7.270
   75    H    PHE  11           HN       PHE  11  14.459   4.039  -2.250
   76    HA   PHE  11           HA       PHE  11  15.547   6.725  -2.503
   77    HB2  PHE  11           HB2      PHE  11  13.264   7.695  -2.852
   78    HB3  PHE  11           HB1      PHE  11  13.903   6.818  -4.244
   79    HD1  PHE  11           HD1      PHE  11  11.749   6.384  -1.211
   80    HD2  PHE  11           HD2      PHE  11  12.714   5.014  -5.166
   81    HE1  PHE  11           HE1      PHE  11   9.799   4.857  -1.144
   82    HE2  PHE  11           HE2      PHE  11  10.773   3.486  -5.118
   83    HZ   PHE  11           HZ       PHE  11   9.308   3.395  -3.115
   84    H    DBB  12           HN       DBB  12  13.914   4.280  -0.818
   85    HA   DBB  12           HA       DBB  12  12.408   5.315   1.140
   86    HB2  DBB  12           HB2      DBB  12  14.272   5.741   2.958
   87    HG1  DBB  12           HG1      DBB  12  15.828   7.179   0.975
   88    HG2  DBB  12           HG2      DBB  12  15.825   5.453   0.620
   89    HG3  DBB  12           HG3      DBB  12  16.382   6.028   2.193
   90    H    ILE  13           HN       ILE  13  15.281   3.443   0.486
   91    HA   ILE  13           HA       ILE  13  14.448   0.960   0.919
   92    HB   ILE  13           HB       ILE  13  17.016   1.615   2.295
   93   HG12  ILE  13          HG12      ILE  13  17.883   1.681  -0.224
   94   HG13  ILE  13          HG11      ILE  13  16.272   2.335  -0.515
   95   HG21  ILE  13          HG21      ILE  13  16.845  -0.252   0.011
   96   HG22  ILE  13          HG22      ILE  13  15.838  -0.683   1.392
   97   HG23  ILE  13          HG23      ILE  13  17.578  -0.483   1.598
   98   HD11  ILE  13          HD11      ILE  13  18.546   3.512   1.008
   99   HD12  ILE  13          HD12      ILE  13  16.923   3.812   1.628
  100   HD13  ILE  13          HD13      ILE  13  17.346   4.306  -0.011
  101    H    ASN  14           HN       ASN  14  15.557   3.068   3.565
  102    HA   ASN  14           HA       ASN  14  15.055   1.238   5.654
  103    HB2  ASN  14           HB2      ASN  14  15.198   4.254   5.597
  104    HB3  ASN  14           HB1      ASN  14  14.995   3.329   7.085
  105   HD21  ASN  14          HD21      ASN  14  17.334   4.921   6.642
  106   HD22  ASN  14          HD22      ASN  14  18.664   3.878   6.477
  107    H    VAL  15           HN       VAL  15  13.043   3.723   4.146
  108    HA   VAL  15           HA       VAL  15  10.602   2.597   4.289
  109    HB   VAL  15           HB       VAL  15  10.753   2.119   6.626
  110   HG11  VAL  15          HG11      VAL  15  11.024   4.264   8.152
  111   HG12  VAL  15          HG12      VAL  15  11.838   4.910   6.727
  112   HG13  VAL  15          HG13      VAL  15  12.446   3.447   7.502
  113   HG21  VAL  15          HG21      VAL  15   8.636   3.280   5.656
  114   HG22  VAL  15          HG22      VAL  15   9.166   4.679   6.591
  115   HG23  VAL  15          HG23      VAL  15   8.797   3.160   7.408
  116    H    CYS  16           HN       CYS  16  12.511   5.069   3.672
  117    HA   CYS  16           HA       CYS  16  10.542   7.215   3.884
  118    HB2  CYS  16           HB2      CYS  16  12.300   8.651   3.728
  119    HB3  CYS  16           HB1      CYS  16  13.235   7.228   4.186
  Start of MODEL   18
    1    H1   PHE   1           HT1      PHE   1  12.322  -1.514   8.210
    2    H2   PHE   1           HT2      PHE   1  11.837  -2.752   9.268
    3    H3   PHE   1           HT3      PHE   1  10.672  -1.793   8.487
    4    HA   PHE   1           HA       PHE   1  12.552  -3.250   6.795
    5    HB2  PHE   1           HB2      PHE   1  10.280  -4.526   8.342
    6    HB3  PHE   1           HB1      PHE   1  11.048  -5.263   6.936
    7    HD1  PHE   1           HD1      PHE   1  11.346  -4.523  10.486
    8    HD2  PHE   1           HD2      PHE   1  13.486  -5.840   7.003
    9    HE1  PHE   1           HE1      PHE   1  13.161  -5.397  11.932
   10    HE2  PHE   1           HE2      PHE   1  15.303  -6.713   8.449
   11    HZ   PHE   1           HZ       PHE   1  15.139  -6.492  10.913
   12    H    PHE   2           HN       PHE   2  11.916  -1.567   5.340
   13    HA   PHE   2           HA       PHE   2   9.100  -1.753   4.450
   14    HB2  PHE   2           HB2      PHE   2   9.530   0.468   5.251
   15    HB3  PHE   2           HB1      PHE   2  11.041   0.562   4.347
   16    HD1  PHE   2           HD1      PHE   2   7.826  -0.879   3.147
   17    HD2  PHE   2           HD2      PHE   2  10.589   2.400   2.902
   18    HE1  PHE   2           HE1      PHE   2   6.591   0.015   1.190
   19    HE2  PHE   2           HE2      PHE   2   9.355   3.294   0.947
   20    HZ   PHE   2           HZ       PHE   2   7.356   2.103   0.092
   21    H    CYS   3           HN       CYS   3   9.007  -3.043   2.725
   22    HA   CYS   3           HA       CYS   3  11.039  -2.677   0.606
   23    HB2  CYS   3           HB2      CYS   3  10.227  -5.075   1.994
   24    HB3  CYS   3           HB1      CYS   3   9.862  -5.211   0.273
   25    H    VAL   4           HN       VAL   4  10.301  -2.258  -1.398
   26    HA   VAL   4           HA       VAL   4   7.381  -2.425  -1.839
   27    HB   VAL   4           HB       VAL   4   7.780  -0.527  -3.480
   28   HG11  VAL   4          HG11      VAL   4   6.836  -0.279  -1.155
   29   HG12  VAL   4          HG12      VAL   4   7.678   1.155  -1.744
   30   HG13  VAL   4          HG13      VAL   4   8.469   0.078  -0.594
   31   HG21  VAL   4          HG21      VAL   4  10.309  -0.976  -3.478
   32   HG22  VAL   4          HG22      VAL   4  10.341  -0.164  -1.912
   33   HG23  VAL   4          HG23      VAL   4   9.814   0.713  -3.350
   34    H    GLN   5           HN       GLN   5   6.727  -3.624  -3.514
   35    HA   GLN   5           HA       GLN   5   6.953  -5.257  -5.151
   36    HB2  GLN   5           HB2      GLN   5   8.222  -4.076  -7.192
   37    HB3  GLN   5           HB1      GLN   5   6.581  -3.631  -6.721
   38    HG2  GLN   5           HG2      GLN   5   7.458  -1.803  -5.328
   39    HG3  GLN   5           HG1      GLN   5   9.107  -2.257  -5.754
   40   HE21  GLN   5          HE21      GLN   5   7.824   0.336  -6.357
   41   HE22  GLN   5          HE22      GLN   5   7.812   0.480  -8.051
   42    H    GLY   6           HN       GLY   6   8.492  -6.444  -3.670
   43    HA2  GLY   6           HA2      GLY   6  10.368  -7.757  -3.442
   44    HA3  GLY   6           HA1      GLY   6  10.689  -7.426  -5.140
   45    H    DBB   7           HN       DBB   7  11.037  -6.054  -1.882
   46    HA   DBB   7           HA       DBB   7  13.600  -5.491  -1.652
   47    HB2  DBB   7           HB2      DBB   7  11.290  -3.649  -1.106
   48    HG1  DBB   7           HG1      DBB   7  14.147  -2.996  -1.192
   49    HG2  DBB   7           HG2      DBB   7  13.401  -2.650   0.368
   50    HG3  DBB   7           HG3      DBB   7  12.751  -1.923  -1.102
   51    H    ALA   8           HN       ALA   8  11.461  -3.333  -3.523
   52    HA   ALA   8           HA       ALA   8  13.809  -2.545  -5.135
   53    HB1  ALA   8           HB1      ALA   8  12.450  -2.398  -6.990
   54    HB2  ALA   8           HB2      ALA   8  11.015  -2.014  -6.039
   55    HB3  ALA   8           HB3      ALA   8  11.611  -3.672  -6.105
   56    H    ASN   9           HN       ASN   9  13.576  -1.261  -2.720
   57    HA   ASN   9           HA       ASN   9  12.031   1.150  -2.914
   58    HB2  ASN   9           HB2      ASN   9  13.379  -0.197  -0.891
   59    HB3  ASN   9           HB1      ASN   9  14.318   1.274  -1.117
   60   HD21  ASN   9          HD21      ASN   9  12.816   0.886   1.258
   61   HD22  ASN   9          HD22      ASN   9  11.536   2.006   1.278
   62    H    ARG  10           HN       ARG  10  15.514   1.191  -2.301
   63    HA   ARG  10           HA       ARG  10  17.207   2.440  -3.210
   64    HB2  ARG  10           HB2      ARG  10  15.491   1.974  -5.640
   65    HB3  ARG  10           HB1      ARG  10  17.044   2.805  -5.718
   66    HG2  ARG  10           HG2      ARG  10  17.391   0.445  -6.206
   67    HG3  ARG  10           HG1      ARG  10  18.107   0.814  -4.635
   68    HD2  ARG  10           HD2      ARG  10  16.224  -0.129  -3.469
   69    HD3  ARG  10           HD1      ARG  10  15.305  -0.287  -4.964
   70    HE   ARG  10           HE       ARG  10  17.449  -2.039  -4.041
   71   HH11  ARG  10          HH11      ARG  10  15.410  -0.946  -6.613
   72   HH12  ARG  10          HH12      ARG  10  15.600  -2.382  -7.564
   73   HH21  ARG  10          HH21      ARG  10  17.706  -3.932  -5.286
   74   HH22  ARG  10          HH22      ARG  10  16.899  -4.072  -6.812
   75    H    PHE  11           HN       PHE  11  15.362   3.899  -1.803
   76    HA   PHE  11           HA       PHE  11  15.883   6.536  -2.527
   77    HB2  PHE  11           HB2      PHE  11  13.774   7.314  -3.452
   78    HB3  PHE  11           HB1      PHE  11  14.393   6.016  -4.476
   79    HD1  PHE  11           HD1      PHE  11  12.236   6.516  -1.451
   80    HD2  PHE  11           HD2      PHE  11  12.989   4.235  -5.007
   81    HE1  PHE  11           HE1      PHE  11  10.195   5.184  -1.017
   82    HE2  PHE  11           HE2      PHE  11  10.952   2.899  -4.583
   83    HZ   PHE  11           HZ       PHE  11   9.550   3.365  -2.592
   84    H    DBB  12           HN       DBB  12  14.164   4.143  -0.839
   85    HA   DBB  12           HA       DBB  12  12.304   5.180   0.726
   86    HB2  DBB  12           HB2      DBB  12  13.771   5.928   2.792
   87    HG1  DBB  12           HG1      DBB  12  15.920   6.440   2.357
   88    HG2  DBB  12           HG2      DBB  12  15.467   7.396   0.945
   89    HG3  DBB  12           HG3      DBB  12  15.716   5.656   0.792
   90    H    ILE  13           HN       ILE  13  15.444   3.634   0.958
   91    HA   ILE  13           HA       ILE  13  14.623   1.101   1.546
   92    HB   ILE  13           HB       ILE  13  17.029   2.110   2.997
   93   HG12  ILE  13          HG12      ILE  13  17.216   3.413   1.003
   94   HG13  ILE  13          HG11      ILE  13  18.218   1.987   0.728
   95   HG21  ILE  13          HG21      ILE  13  17.926   0.005   2.362
   96   HG22  ILE  13          HG22      ILE  13  16.751  -0.194   1.061
   97   HG23  ILE  13          HG23      ILE  13  16.241  -0.343   2.744
   98   HD11  ILE  13          HD11      ILE  13  15.578   2.715  -0.481
   99   HD12  ILE  13          HD12      ILE  13  15.943   1.007  -0.236
  100   HD13  ILE  13          HD13      ILE  13  17.001   1.999  -1.239
  101    H    ASN  14           HN       ASN  14  15.465   3.569   3.993
  102    HA   ASN  14           HA       ASN  14  14.802   1.975   6.231
  103    HB2  ASN  14           HB2      ASN  14  16.128   4.195   6.110
  104    HB3  ASN  14           HB1      ASN  14  14.549   4.970   6.212
  105   HD21  ASN  14          HD21      ASN  14  14.936   5.788   8.390
  106   HD22  ASN  14          HD22      ASN  14  14.992   4.746   9.729
  107    H    VAL  15           HN       VAL  15  12.911   4.272   4.306
  108    HA   VAL  15           HA       VAL  15  10.454   3.030   4.612
  109    HB   VAL  15           HB       VAL  15   9.594   4.984   6.283
  110   HG11  VAL  15          HG11      VAL  15  10.598   2.739   7.834
  111   HG12  VAL  15          HG12      VAL  15   9.888   2.197   6.313
  112   HG13  VAL  15          HG13      VAL  15   8.933   3.163   7.437
  113   HG21  VAL  15          HG21      VAL  15  12.283   5.315   6.501
  114   HG22  VAL  15          HG22      VAL  15  12.012   4.120   7.769
  115   HG23  VAL  15          HG23      VAL  15  11.156   5.661   7.814
  116    H    CYS  16           HN       CYS  16  11.886   6.279   4.807
  117    HA   CYS  16           HA       CYS  16  11.531   8.175   3.568
  118    HB2  CYS  16           HB2      CYS  16  11.247   5.946   1.699
  119    HB3  CYS  16           HB1      CYS  16  10.512   7.452   1.164
  Start of MODEL   19
    1    H1   PHE   1           HT1      PHE   1  10.209  -5.535   6.086
    2    H2   PHE   1           HT2      PHE   1   8.816  -4.579   6.254
    3    H3   PHE   1           HT3      PHE   1   9.862  -4.799   7.573
    4    HA   PHE   1           HA       PHE   1  10.797  -2.882   6.994
    5    HB2  PHE   1           HB2      PHE   1  11.692  -4.607   4.665
    6    HB3  PHE   1           HB1      PHE   1  12.426  -3.064   5.105
    7    HD1  PHE   1           HD1      PHE   1  12.324  -6.602   5.761
    8    HD2  PHE   1           HD2      PHE   1  13.368  -2.804   7.476
    9    HE1  PHE   1           HE1      PHE   1  13.729  -7.752   7.452
   10    HE2  PHE   1           HE2      PHE   1  14.773  -3.954   9.166
   11    HZ   PHE   1           HZ       PHE   1  14.954  -6.427   9.154
   12    H    PHE   2           HN       PHE   2  11.124  -1.208   5.157
   13    HA   PHE   2           HA       PHE   2   8.561  -0.486   4.166
   14    HB2  PHE   2           HB2      PHE   2  10.036   1.302   4.631
   15    HB3  PHE   2           HB1      PHE   2  11.343   0.576   3.695
   16    HD1  PHE   2           HD1      PHE   2   7.721   1.052   2.870
   17    HD2  PHE   2           HD2      PHE   2  11.792   2.029   1.908
   18    HE1  PHE   2           HE1      PHE   2   6.951   2.266   0.849
   19    HE2  PHE   2           HE2      PHE   2  11.023   3.243  -0.114
   20    HZ   PHE   2           HZ       PHE   2   8.602   3.361  -0.642
   21    H    CYS   3           HN       CYS   3  11.096  -2.448   2.914
   22    HA   CYS   3           HA       CYS   3  11.275  -2.386   0.305
   23    HB2  CYS   3           HB2      CYS   3  10.804  -4.623   2.143
   24    HB3  CYS   3           HB1      CYS   3  10.367  -4.975   0.471
   25    H    VAL   4           HN       VAL   4   9.775  -1.289  -0.904
   26    HA   VAL   4           HA       VAL   4   6.973  -1.599  -0.717
   27    HB   VAL   4           HB       VAL   4   7.001  -0.529  -3.023
   28   HG11  VAL   4          HG11      VAL   4   8.303   1.554  -2.013
   29   HG12  VAL   4          HG12      VAL   4   8.271   0.576  -0.545
   30   HG13  VAL   4          HG13      VAL   4   6.761   1.039  -1.330
   31   HG21  VAL   4          HG21      VAL   4   9.149   0.257  -3.858
   32   HG22  VAL   4          HG22      VAL   4   9.232  -1.493  -3.653
   33   HG23  VAL   4          HG23      VAL   4   9.982  -0.429  -2.463
   34    H    GLN   5           HN       GLN   5   9.375  -3.043  -2.902
   35    HA   GLN   5           HA       GLN   5   7.615  -5.322  -3.334
   36    HB2  GLN   5           HB2      GLN   5   8.284  -4.877  -5.929
   37    HB3  GLN   5           HB1      GLN   5   6.750  -4.380  -5.213
   38    HG2  GLN   5           HG2      GLN   5   7.688  -2.168  -4.699
   39    HG3  GLN   5           HG1      GLN   5   9.240  -2.658  -5.377
   40   HE21  GLN   5          HE21      GLN   5   8.216  -0.479  -6.614
   41   HE22  GLN   5          HE22      GLN   5   7.514  -0.873  -8.107
   42    H    GLY   6           HN       GLY   6   8.955  -6.949  -2.885
   43    HA2  GLY   6           HA2      GLY   6  10.891  -8.200  -2.717
   44    HA3  GLY   6           HA1      GLY   6  11.040  -7.818  -4.430
   45    H    DBB   7           HN       DBB   7  11.092  -5.315  -2.002
   46    HA   DBB   7           HA       DBB   7  13.923  -5.191  -1.664
   47    HB2  DBB   7           HB2      DBB   7  11.649  -3.308  -1.080
   48    HG1  DBB   7           HG1      DBB   7  14.016  -2.356   0.146
   49    HG2  DBB   7           HG2      DBB   7  13.060  -1.553  -1.099
   50    HG3  DBB   7           HG3      DBB   7  14.404  -2.599  -1.556
   51    H    ALA   8           HN       ALA   8  11.696  -2.996  -3.398
   52    HA   ALA   8           HA       ALA   8  13.917  -2.382  -5.253
   53    HB1  ALA   8           HB1      ALA   8  11.721  -3.597  -6.054
   54    HB2  ALA   8           HB2      ALA   8  12.439  -2.320  -7.035
   55    HB3  ALA   8           HB3      ALA   8  11.050  -1.966  -6.008
   56    H    ASN   9           HN       ASN   9  13.335  -1.054  -2.717
   57    HA   ASN   9           HA       ASN   9  11.904   1.330  -2.982
   58    HB2  ASN   9           HB2      ASN   9  14.253   0.516  -1.292
   59    HB3  ASN   9           HB1      ASN   9  13.633   2.164  -1.234
   60   HD21  ASN   9          HD21      ASN   9  13.446   0.505   1.063
   61   HD22  ASN   9          HD22      ASN   9  11.815   0.124   1.330
   62    H    ARG  10           HN       ARG  10  15.396   1.575  -2.636
   63    HA   ARG  10           HA       ARG  10  16.962   2.846  -3.735
   64    HB2  ARG  10           HB2      ARG  10  15.062   2.171  -5.966
   65    HB3  ARG  10           HB1      ARG  10  16.430   3.249  -6.243
   66    HG2  ARG  10           HG2      ARG  10  17.111   0.973  -6.770
   67    HG3  ARG  10           HG1      ARG  10  17.943   1.490  -5.303
   68    HD2  ARG  10           HD2      ARG  10  16.290   0.317  -3.924
   69    HD3  ARG  10           HD1      ARG  10  15.398  -0.156  -5.368
   70    HE   ARG  10           HE       ARG  10  17.083  -1.733  -5.853
   71   HH11  ARG  10          HH11      ARG  10  17.832   0.258  -3.122
   72   HH12  ARG  10          HH12      ARG  10  19.133  -0.744  -2.574
   73   HH21  ARG  10          HH21      ARG  10  18.789  -3.051  -5.139
   74   HH22  ARG  10          HH22      ARG  10  19.676  -2.617  -3.716
   75    H    PHE  11           HN       PHE  11  15.356   4.287  -2.130
   76    HA   PHE  11           HA       PHE  11  15.588   6.903  -2.937
   77    HB2  PHE  11           HB2      PHE  11  13.332   7.546  -3.644
   78    HB3  PHE  11           HB1      PHE  11  14.012   6.356  -4.755
   79    HD1  PHE  11           HD1      PHE  11  12.144   6.348  -1.492
   80    HD2  PHE  11           HD2      PHE  11  12.572   4.658  -5.417
   81    HE1  PHE  11           HE1      PHE  11  10.225   4.840  -1.051
   82    HE2  PHE  11           HE2      PHE  11  10.654   3.149  -4.977
   83    HZ   PHE  11           HZ       PHE  11   9.481   3.240  -2.794
   84    H    DBB  12           HN       DBB  12  14.702   4.557  -0.842
   85    HA   DBB  12           HA       DBB  12  12.834   5.841   0.862
   86    HB2  DBB  12           HB2      DBB  12  15.141   5.974   2.511
   87    HG1  DBB  12           HG1      DBB  12  16.203   6.190   0.126
   88    HG2  DBB  12           HG2      DBB  12  16.656   7.355   1.372
   89    HG3  DBB  12           HG3      DBB  12  15.473   7.796   0.139
   90    H    ILE  13           HN       ILE  13  15.894   4.053   1.104
   91    HA   ILE  13           HA       ILE  13  14.707   1.531   1.562
   92    HB   ILE  13           HB       ILE  13  17.429   2.188   2.623
   93   HG12  ILE  13          HG12      ILE  13  17.546   3.406   0.597
   94   HG13  ILE  13          HG11      ILE  13  18.176   1.814   0.167
   95   HG21  ILE  13          HG21      ILE  13  16.587  -0.086   0.835
   96   HG22  ILE  13          HG22      ILE  13  16.241  -0.128   2.564
   97   HG23  ILE  13          HG23      ILE  13  17.910  -0.030   2.000
   98   HD11  ILE  13          HD11      ILE  13  15.614   3.112  -0.611
   99   HD12  ILE  13          HD12      ILE  13  15.558   1.377  -0.296
  100   HD13  ILE  13          HD13      ILE  13  16.644   2.014  -1.530
  101    H    ASN  14           HN       ASN  14  14.039   0.517   3.372
  102    HA   ASN  14           HA       ASN  14  13.551   0.130   5.589
  103    HB2  ASN  14           HB2      ASN  14  15.997   0.631   5.924
  104    HB3  ASN  14           HB1      ASN  14  15.547   2.308   6.228
  105   HD21  ASN  14          HD21      ASN  14  16.094   2.313   8.490
  106   HD22  ASN  14          HD22      ASN  14  15.253   1.377   9.629
  107    H    VAL  15           HN       VAL  15  12.118   2.044   3.949
  108    HA   VAL  15           HA       VAL  15  10.180   3.267   4.420
  109    HB   VAL  15           HB       VAL  15  11.317   3.906   7.140
  110   HG11  VAL  15          HG11      VAL  15   8.605   3.940   5.822
  111   HG12  VAL  15          HG12      VAL  15   9.423   5.237   6.693
  112   HG13  VAL  15          HG13      VAL  15   8.757   3.864   7.578
  113   HG21  VAL  15          HG21      VAL  15  10.783   1.842   7.940
  114   HG22  VAL  15          HG22      VAL  15  10.927   1.331   6.259
  115   HG23  VAL  15          HG23      VAL  15   9.343   1.722   6.930
  116    H    CYS  16           HN       CYS  16  10.308   5.009   3.160
  117    HA   CYS  16           HA       CYS  16  10.832   7.543   3.810
  118    HB2  CYS  16           HB2      CYS  16  12.987   7.627   4.476
  119    HB3  CYS  16           HB1      CYS  16  13.366   6.066   3.748
  Start of MODEL   20
    1    H1   PHE   1           HT1      PHE   1  10.533  -1.301   8.420
    2    H2   PHE   1           HT2      PHE   1  10.006  -2.753   9.126
    3    H3   PHE   1           HT3      PHE   1   8.988  -1.902   8.066
    4    HA   PHE   1           HA       PHE   1  11.584  -2.696   7.013
    5    HB2  PHE   1           HB2      PHE   1  10.918  -4.702   8.265
    6    HB3  PHE   1           HB1      PHE   1   9.322  -4.654   7.515
    7    HD1  PHE   1           HD1      PHE   1  12.966  -4.817   6.665
    8    HD2  PHE   1           HD2      PHE   1   8.945  -5.754   5.474
    9    HE1  PHE   1           HE1      PHE   1  13.837  -6.094   4.726
   10    HE2  PHE   1           HE2      PHE   1   9.817  -7.030   3.535
   11    HZ   PHE   1           HZ       PHE   1  12.263  -7.200   3.161
   12    H    PHE   2           HN       PHE   2  11.245  -1.235   5.363
   13    HA   PHE   2           HA       PHE   2   8.778  -1.570   3.768
   14    HB2  PHE   2           HB2      PHE   2   8.983   0.698   4.542
   15    HB3  PHE   2           HB1      PHE   2  10.674   0.771   4.046
   16    HD1  PHE   2           HD1      PHE   2   7.652  -0.572   2.283
   17    HD2  PHE   2           HD2      PHE   2  10.821   2.328   2.305
   18    HE1  PHE   2           HE1      PHE   2   6.958   0.205   0.033
   19    HE2  PHE   2           HE2      PHE   2  10.128   3.102   0.055
   20    HZ   PHE   2           HZ       PHE   2   8.196   2.042  -1.082
   21    H    CYS   3           HN       CYS   3   9.053  -2.764   1.992
   22    HA   CYS   3           HA       CYS   3  11.578  -2.465   0.494
   23    HB2  CYS   3           HB2      CYS   3  10.807  -4.792   1.865
   24    HB3  CYS   3           HB1      CYS   3  10.462  -5.101   0.163
   25    H    VAL   4           HN       VAL   4   8.885  -1.296   0.129
   26    HA   VAL   4           HA       VAL   4   7.222  -1.123  -1.484
   27    HB   VAL   4           HB       VAL   4   8.365  -1.260  -3.844
   28   HG11  VAL   4          HG11      VAL   4   9.561   0.738  -1.940
   29   HG12  VAL   4          HG12      VAL   4   7.831   0.763  -2.280
   30   HG13  VAL   4          HG13      VAL   4   8.991   0.989  -3.589
   31   HG21  VAL   4          HG21      VAL   4  10.310  -2.568  -3.143
   32   HG22  VAL   4          HG22      VAL   4  10.716  -1.358  -1.925
   33   HG23  VAL   4          HG23      VAL   4  10.841  -0.961  -3.639
   34    H    GLN   5           HN       GLN   5   8.805  -3.027  -3.829
   35    HA   GLN   5           HA       GLN   5   6.645  -4.975  -3.771
   36    HB2  GLN   5           HB2      GLN   5   9.009  -4.865  -5.651
   37    HB3  GLN   5           HB1      GLN   5   7.467  -5.683  -5.907
   38    HG2  GLN   5           HG2      GLN   5   7.875  -2.691  -5.647
   39    HG3  GLN   5           HG1      GLN   5   7.504  -3.562  -7.135
   40   HE21  GLN   5          HE21      GLN   5   6.009  -1.632  -4.967
   41   HE22  GLN   5          HE22      GLN   5   4.445  -2.305  -4.982
   42    H    GLY   6           HN       GLY   6  10.134  -5.451  -4.304
   43    HA2  GLY   6           HA2      GLY   6  10.083  -7.638  -2.313
   44    HA3  GLY   6           HA1      GLY   6  10.797  -7.878  -3.904
   45    H    DBB   7           HN       DBB   7  11.291  -4.726  -2.954
   46    HA   DBB   7           HA       DBB   7  13.986  -5.353  -1.891
   47    HB2  DBB   7           HB2      DBB   7  12.021  -3.202  -1.141
   48    HG1  DBB   7           HG1      DBB   7  13.739  -1.962  -0.043
   49    HG2  DBB   7           HG2      DBB   7  14.354  -2.272  -1.667
   50    HG3  DBB   7           HG3      DBB   7  14.925  -3.239  -0.307
   51    H    ALA   8           HN       ALA   8  12.007  -3.011  -3.664
   52    HA   ALA   8           HA       ALA   8  14.396  -2.259  -5.234
   53    HB1  ALA   8           HB1      ALA   8  12.227  -1.450  -6.716
   54    HB2  ALA   8           HB2      ALA   8  11.640  -2.939  -5.978
   55    HB3  ALA   8           HB3      ALA   8  13.108  -2.959  -6.956
   56    H    ASN   9           HN       ASN   9  13.768  -1.058  -2.736
   57    HA   ASN   9           HA       ASN   9  12.250   1.267  -2.817
   58    HB2  ASN   9           HB2      ASN   9  14.712   0.469  -1.293
   59    HB3  ASN   9           HB1      ASN   9  14.040   2.088  -1.118
   60   HD21  ASN   9          HD21      ASN   9  13.008   1.981   0.908
   61   HD22  ASN   9          HD22      ASN   9  11.840   0.816   1.324
   62    H    ARG  10           HN       ARG  10  15.722   1.732  -2.592
   63    HA   ARG  10           HA       ARG  10  17.158   3.135  -3.705
   64    HB2  ARG  10           HB2      ARG  10  15.270   2.334  -5.899
   65    HB3  ARG  10           HB1      ARG  10  16.594   3.461  -6.202
   66    HG2  ARG  10           HG2      ARG  10  17.503   1.324  -6.698
   67    HG3  ARG  10           HG1      ARG  10  18.106   1.701  -5.082
   68    HD2  ARG  10           HD2      ARG  10  16.305   0.376  -4.075
   69    HD3  ARG  10           HD1      ARG  10  15.643   0.034  -5.671
   70    HE   ARG  10           HE       ARG  10  18.101  -0.948  -5.962
   71   HH11  ARG  10          HH11      ARG  10  15.895  -1.124  -3.303
   72   HH12  ARG  10          HH12      ARG  10  16.461  -2.668  -2.757
   73   HH21  ARG  10          HH21      ARG  10  18.840  -2.977  -5.260
   74   HH22  ARG  10          HH22      ARG  10  18.128  -3.717  -3.866
   75    H    PHE  11           HN       PHE  11  15.266   4.389  -2.119
   76    HA   PHE  11           HA       PHE  11  15.403   7.055  -2.935
   77    HB2  PHE  11           HB2      PHE  11  13.076   7.526  -3.581
   78    HB3  PHE  11           HB1      PHE  11  13.794   6.367  -4.704
   79    HD1  PHE  11           HD1      PHE  11  12.018   6.354  -1.400
   80    HD2  PHE  11           HD2      PHE  11  12.527   4.480  -5.226
   81    HE1  PHE  11           HE1      PHE  11  10.292   4.693  -0.799
   82    HE2  PHE  11           HE2      PHE  11  10.793   2.809  -4.637
   83    HZ   PHE  11           HZ       PHE  11   9.672   2.910  -2.424
   84    H    DBB  12           HN       DBB  12  13.973   4.512  -1.126
   85    HA   DBB  12           HA       DBB  12  12.265   5.519   0.662
   86    HB2  DBB  12           HB2      DBB  12  13.975   6.088   2.606
   87    HG1  DBB  12           HG1      DBB  12  15.698   5.883   0.426
   88    HG2  DBB  12           HG2      DBB  12  16.066   6.656   1.969
   89    HG3  DBB  12           HG3      DBB  12  15.467   7.621   0.619
   90    H    ILE  13           HN       ILE  13  15.502   4.056   0.882
   91    HA   ILE  13           HA       ILE  13  14.589   1.440   1.282
   92    HB   ILE  13           HB       ILE  13  17.196   2.450   2.389
   93   HG12  ILE  13          HG12      ILE  13  17.623   1.691  -0.271
   94   HG13  ILE  13          HG11      ILE  13  16.182   2.708  -0.332
   95   HG21  ILE  13          HG21      ILE  13  16.869   0.013   0.699
   96   HG22  ILE  13          HG22      ILE  13  16.172  -0.038   2.318
   97   HG23  ILE  13          HG23      ILE  13  17.897   0.269   2.110
   98   HD11  ILE  13          HD11      ILE  13  17.498   4.521  -0.139
   99   HD12  ILE  13          HD12      ILE  13  18.925   3.502   0.057
  100   HD13  ILE  13          HD13      ILE  13  17.972   3.964   1.467
  101    H    ASN  14           HN       ASN  14  13.923   0.335   3.016
  102    HA   ASN  14           HA       ASN  14  13.220  -0.120   5.155
  103    HB2  ASN  14           HB2      ASN  14  15.694   0.045   5.570
  104    HB3  ASN  14           HB1      ASN  14  15.453   1.736   6.005
  105   HD21  ASN  14          HD21      ASN  14  16.455  -0.062   7.945
  106   HD22  ASN  14          HD22      ASN  14  15.268  -0.313   9.133
  107    H    VAL  15           HN       VAL  15  11.939   1.981   3.745
  108    HA   VAL  15           HA       VAL  15  10.189   3.406   4.283
  109    HB   VAL  15           HB       VAL  15  10.788   2.345   6.766
  110   HG11  VAL  15          HG11      VAL  15  10.818   4.288   8.301
  111   HG12  VAL  15          HG12      VAL  15  10.969   5.371   6.918
  112   HG13  VAL  15          HG13      VAL  15  12.267   4.240   7.297
  113   HG21  VAL  15          HG21      VAL  15   8.582   3.060   5.557
  114   HG22  VAL  15          HG22      VAL  15   8.789   4.573   6.441
  115   HG23  VAL  15          HG23      VAL  15   8.622   3.052   7.320
  116    H    CYS  16           HN       CYS  16  10.327   5.378   3.414
  117    HA   CYS  16           HA       CYS  16  12.790   6.894   3.765
  118    HB2  CYS  16           HB2      CYS  16  11.088   6.537   1.615
  119    HB3  CYS  16           HB1      CYS  16  10.738   8.178   2.163