*HEADER    CELL ADHESION                           15-NOV-06   2NWM              
*TITLE     SOLUTION STRUCTURE OF THE FIRST SH3 DOMAIN OF HUMAN VINEXIN           
*TITLE    2 AND ITS INTERACTION WITH THE PEPTIDES FROM VINCULIN                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VINEXIN;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SH3 DOMAIN;                                                
*COMPND   5 SYNONYM: SORBIN AND SH3 DOMAIN-CONTAINING PROTEIN 3, SH3-            
*COMPND   6 CONTAINING ADAPTER MOLECULE 1, SCAM-1;                               
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: VINEXIN;                                                       
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET22B(+)                                 
*KEYWDS    VINEXIN SH3 DOMAIN                                                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.ZHANG, B.YAO, J.WU, Y.SHI                                           
*REVDAT   1   24-APR-07 2NWM    0   

!NOE
!M0
!K1 
assign (resid  1  and name ha  ) (resid  2 and name hn   ) 1.80 0.00 1.20
assign (resid  1  and name hg# ) (resid  2 and name hn   ) 1.80 0.00 4.20
assign (resid  1  and name ha  ) (resid 56 and name hd1  ) 1.80 0.00 3.20
assign (resid  1  and name ha  ) (resid 56 and name hd2  ) 1.80 0.00 3.20
assign (resid  1  and name hg# ) (resid 56 and name hd1  ) 1.80 0.00 3.20
assign (resid  1  and name hg# ) (resid 56 and name hd2  ) 1.80 0.00 3.20
!A2 
assign (resid  2  and name ha  ) (resid  2 and name hn   ) 1.80 0.00 3.20
assign (resid  2  and name hb# ) (resid  2 and name hn   ) 1.80 0.00 2.20
assign (resid  2  and name hn  ) (resid  3 and name hn   ) 1.80 0.00 4.20
assign (resid  2  and name ha  ) (resid  3 and name hn   ) 1.80 0.00 1.20
assign (resid  2  and name hn  ) (resid 26 and name ha   ) 1.80 0.00 4.20
assign (resid  2  and name hb# ) (resid 55 and name ha   ) 1.80 0.00 4.20
assign (resid  2  and name ha  ) (resid  2 and name hb#  ) 1.80 0.00 2.20
assign (resid  2  and name ha  ) (resid 26 and name ha   ) 1.80 0.00 2.70
assign (resid  2  and name hb# ) (resid 26 and name ha   ) 1.80 0.00 3.70
assign (resid  2  and name ha  ) (resid  2 and name hb#  ) 1.80 0.00 2.70
assign (resid  2  and name hb# ) (resid 24 and name hd1# ) 1.80 0.00 4.20
assign (resid  2  and name hb# ) (resid 24 and name hg2# ) 1.80 0.00 3.20
assign (resid  2  and name hb# ) (resid 57 and name hb#  ) 1.80 0.00 3.20
assign (resid  2  and name hb# ) (resid 55 and name hd*  ) 1.80 0.00 3.20
!A3 
assign (resid  3  and name ha  ) (resid  3 and name hn   ) 1.80 0.00 3.20
assign (resid  3  and name hb# ) (resid  3 and name hn   ) 1.80 0.00 2.20
assign (resid  25 and name hn  ) (resid  3 and name hn   ) 1.80 0.00 3.20
assign (resid  26 and name ha  ) (resid  3 and name hn   ) 1.80 0.00 3.20
assign (resid  3  and name hn  ) (resid  4 and name hn   ) 1.80 0.00 4.20
assign (resid  3  and name ha  ) (resid  4 and name hn   ) 1.80 0.00 1.20
assign (resid  3  and name hb# ) (resid  4 and name hn   ) 1.80 0.00 2.70
assign (resid  3  and name ha  ) (resid  55 and name hn  ) 1.80 0.00 2.70
assign (resid  3  and name hn  ) (resid  26 and name ha  ) 1.80 0.00 3.70
assign (resid  3  and name hb# ) (resid  25 and name hn  ) 1.80 0.00 4.20
assign (resid  3  and name hn  ) (resid  25 and name hn  ) 1.80 0.00 2.70
assign (resid  3  and name hn  ) (resid  25 and name hg* ) 1.80 0.00 3.20
assign (resid  3  and name hn  ) (resid  24 and name hd1#) 1.80 0.00 3.20
assign (resid  3  and name ha  ) (resid  3 and name hb#  ) 1.80 0.00 2.20
assign (resid  3  and name hb# ) (resid 25 and name hg2# ) 1.80 0.00 4.20
assign (resid  3  and name ha  ) (resid 54 and name ha   ) 1.80 0.00 2.70
assign (resid  3  and name ha  ) (resid 55 and name hd*  ) 1.80 0.00 3.20
assign (resid  3  and name hb# ) (resid 55 and name hg   ) 1.80 0.00 2.70
assign (resid  3  and name hb# ) (resid 52 and name ha   ) 1.80 0.00 4.20
assign (resid  3  and name hb# ) (resid 52 and name hb#  ) 1.80 0.00 2.70
assign (resid  3  and name hb# ) (resid 54 and name ha   ) 1.80 0.00 2.20
assign (resid  3  and name hb# ) (resid 56 and name hg#  ) 1.80 0.00 3.20
assign (resid  3  and name hb# ) (resid 57 and name hd1# ) 1.80 0.00 3.20
assign (resid  3  and name hb# ) (resid 27 and name hd#  ) 1.80 0.00 4.20
!R4
assign (resid  4  and name ha  ) (resid  4  and name hn  ) 1.80 0.00 2.70
assign (resid  4  and name hb1 ) (resid  4  and name hn  ) 1.80 0.00 2.20
assign (resid  4  and name hb2 ) (resid  4  and name hn  ) 1.80 0.00 2.20
assign (resid  4  and name hd# ) (resid  4  and name hn  ) 1.80 0.00 4.20
assign (resid  4  and name ha  ) (resid  5  and name hn  ) 1.80 0.00 1.20
assign (resid  4  and name hn  ) (resid  5  and name hn  ) 1.80 0.00 4.20
assign (resid  4  and name hg# ) (resid  5  and name hn  ) 1.80 0.00 3.20
assign (resid  4  and name hb# ) (resid  22 and name hn  ) 1.80 0.00 4.20
assign (resid  4  and name hg# ) (resid  23 and name hn  ) 1.80 0.00 3.20
assign (resid  4  and name hn  ) (resid  54 and name ha  ) 1.80 0.00 3.20
assign (resid  4  and name hn  ) (resid  55 and name hn  ) 1.80 0.00 4.20
assign (resid  4  and name hn  ) (resid  55 and name hd* ) 1.80 0.00 3.20
assign (resid  4  and name ha  ) (resid  25 and name hn  ) 1.80 0.00 3.20
assign (resid  4  and name hb1 ) (resid  4  and name hd* ) 1.80 0.00 3.20
assign (resid  4  and name hb2 ) (resid  4  and name hd* ) 1.80 0.00 3.20
assign (resid  4  and name hg# ) (resid  5  and name hd* ) 1.80 0.00 3.70
assign (resid  4  and name hd# ) (resid 22  and name ha# ) 1.80 0.00 4.20
assign (resid  4  and name hg# ) (resid 22  and name ha1 ) 1.80 0.00 4.20
assign (resid  4  and name hg# ) (resid 22  and name ha2 ) 1.80 0.00 4.20
assign (resid  4  and name ha  ) (resid 24  and name ha  ) 1.80 0.00 3.20
assign (resid  4  and name ha  ) (resid 24  and name hd1#) 1.80 0.00 4.20
assign (resid  4  and name ha  ) (resid 24  and name hg2#) 1.80 0.00 3.20
assign (resid  4  and name hb# ) (resid 24  and name hg2#) 1.80 0.00 3.20
!L5
assign (resid  5  and name ha  ) (resid  5  and name hn  ) 1.80 0.00 3.20
assign (resid  5  and name hb1 ) (resid  5  and name hn  ) 1.80 0.00 2.20
assign (resid  5  and name hb2 ) (resid  5  and name hn  ) 1.80 0.00 2.20
assign (resid  5  and name hd1#) (resid  5  and name hn  ) 1.80 0.00 4.20
assign (resid  5  and name hd2#) (resid  5  and name hn  ) 1.80 0.00 4.20
assign (resid  5  and name hd* ) (resid  5  and name hn  ) 1.80 0.00 2.70
assign (resid  5  and name ha  ) (resid  6  and name hn  ) 1.80 0.00 1.20
assign (resid  5  and name hn  ) (resid  6  and name hn  ) 1.80 0.00 4.20
assign (resid  5  and name hb1 ) (resid  6  and name hn  ) 1.80 0.00 4.20
assign (resid  5  and name hb2 ) (resid  6  and name hn  ) 1.80 0.00 4.20
assign (resid  5  and name hb# ) (resid  6  and name hn  ) 1.80 0.00 3.20
assign (resid  5  and name hd1#) (resid  6  and name hn  ) 1.80 0.00 4.20
assign (resid  5  and name hd2#) (resid  6  and name hn  ) 1.80 0.00 4.20
assign (resid  23 and name hn  ) (resid  5  and name hn  ) 1.80 0.00 4.20
assign (resid  24 and name ha  ) (resid  5  and name hn  ) 1.80 0.00 4.20
assign (resid  7  and name hn  ) (resid  5  and name hb# ) 1.80 0.00 3.20
assign (resid  22 and name hn  ) (resid  5  and name hb1 ) 1.80 0.00 3.20
assign (resid  22 and name hn  ) (resid  5  and name hb2 ) 1.80 0.00 3.20
assign (resid  22 and name hn  ) (resid  5  and name hb# ) 1.80 0.00 2.70
assign (resid  23 and name hn  ) (resid  5  and name hb1 ) 1.80 0.00 1.70
assign (resid  23 and name hn  ) (resid  5  and name hb2 ) 1.80 0.00 1.70
assign (resid  23 and name hn  ) (resid  5  and name hb# ) 1.80 0.00 1.20
assign (resid  23 and name hn  ) (resid  5  and name hd1#) 1.80 0.00 4.20
assign (resid  23 and name hn  ) (resid  5  and name hd2#) 1.80 0.00 4.20
assign (resid  7  and name hn  ) (resid  5  and name ha  ) 1.80 0.00 4.20
assign (resid  7  and name hn  ) (resid  5  and name hb# ) 1.80 0.00 4.20
assign (resid  7  and name hn  ) (resid  5  and name hd# ) 1.80 0.00 3.20
assign (resid  53 and name hn  ) (resid  5  and name ha  ) 1.80 0.00 3.20
assign (resid  53 and name hn  ) (resid  5  and name hb# ) 1.80 0.00 4.20
assign (resid  53 and name hn  ) (resid  5  and name hd* ) 1.80 0.00 4.20
assign (resid  5  and name hb# ) (resid  5  and name hd* ) 1.80 0.00 3.20
assign (resid  5  and name hd1#) (resid  5  and name hd2#) 1.80 0.00 2.20
assign (resid  5  and name ha  ) (resid  5  and name hd* ) 1.80 0.00 3.20
assign (resid  5  and name ha  ) (resid  5  and name hd* ) 1.80 0.00 3.20
assign (resid  5  and name ha  ) (resid  6  and name hb# ) 1.80 0.00 3.20
assign (resid  5  and name ha  ) (resid  6  and name hg# ) 1.80 0.00 3.20
assign (resid  5  and name hb1 ) (resid 21  and name ha  ) 1.80 0.00 4.20
assign (resid  5  and name hb2 ) (resid 21  and name ha  ) 1.80 0.00 3.20
assign (resid  5  and name hd* ) (resid 23  and name hb# ) 1.80 0.00 4.20
assign (resid  5  and name ha  ) (resid 52  and name ha  ) 1.80 0.00 2.20
assign (resid  5  and name ha  ) (resid 52  and name hb  ) 1.80 0.00 4.20
assign (resid  5  and name ha  ) (resid 52  and name hg* ) 1.80 0.00 2.20
assign (resid  5  and name hd1#) (resid 52  and name hg* ) 1.80 0.00 3.20
assign (resid  5  and name hd2#) (resid 52  and name hg* ) 1.80 0.00 3.20
assign (resid  5  and name hd* ) (resid 52  and name hg* ) 1.80 0.00 2.70
assign (resid  5  and name hd1#) (resid 52  and name ha  ) 1.80 0.00 4.20
assign (resid  5  and name hd2#) (resid 52  and name ha  ) 1.80 0.00 4.20
assign (resid  5  and name hg  ) (resid 52  and name ha  ) 1.80 0.00 3.20
assign (resid  5  and name hg  ) (resid 19  and name hd* ) 1.80 0.00 4.20
assign (resid  5  and name hd* ) (resid 19  and name hd* ) 1.80 0.00 3.20
!K6
assign (resid  6  and name ha  ) (resid  6  and name hn  ) 1.80 0.00 2.70
assign (resid  6  and name hn  ) (resid  6  and name hd# ) 1.80 0.00 4.20
assign (resid  6  and name ha  ) (resid  7  and name hn  ) 1.80 0.00 3.20
assign (resid  6  and name hn  ) (resid  7  and name hn  ) 1.80 0.00 1.70
assign (resid  6  and name hb1 ) (resid  7  and name hn  ) 1.80 0.00 3.20
assign (resid  6  and name hb2 ) (resid  7  and name hn  ) 1.80 0.00 3.20
assign (resid  6  and name hg# ) (resid  7  and name hn  ) 1.80 0.00 4.20
assign (resid  6  and name hn  ) (resid  51 and name hb# ) 1.80 0.00 4.20
assign (resid  6  and name hn  ) (resid  52 and name ha  ) 1.80 0.00 3.20
assign (resid  6  and name hn  ) (resid  53 and name hn  ) 1.80 0.00 3.20
assign (resid  6  and name hb# ) (resid  53 and name hn  ) 1.80 0.00 3.70
assign (resid  6  and name hb# ) (resid  6  and name hd# ) 1.80 0.00 3.20
assign (resid  6  and name hb# ) (resid 52  and name ha  ) 1.80 0.00 3.70
assign (resid  6  and name ha  ) (resid 21  and name hg# ) 1.80 0.00 3.20
assign (resid  6  and name hd# ) (resid 21  and name hg# ) 1.80 0.00 2.70
assign (resid  6  and name hg# ) (resid 21  and name hb1 ) 1.80 0.00 4.20
assign (resid  6  and name hg# ) (resid 21  and name hb2 ) 1.80 0.00 4.20
assign (resid  6  and name hd# ) (resid 52  and name hg* ) 1.80 0.00 4.20
!F7
assign (resid  7  and name ha  ) (resid  7  and name hn  ) 1.80 0.00 2.70
assign (resid  7  and name hb1 ) (resid  7  and name hn  ) 1.80 0.00 2.70
assign (resid  7  and name hb2 ) (resid  7  and name hn  ) 1.80 0.00 2.70
assign (resid  7  and name he2 ) (resid  7  and name hn  ) 1.80 0.00 3.20
assign (resid  7  and name ha  ) (resid  8  and name hn  ) 1.80 0.00 1.20
assign (resid  7  and name hn  ) (resid  8  and name hn  ) 1.80 0.00 4.20
assign (resid  7  and name hb1 ) (resid  8  and name hn  ) 1.80 0.00 3.20
assign (resid  7  and name hb2 ) (resid  8  and name hn  ) 1.80 0.00 3.20
assign (resid  7  and name hb# ) (resid  8  and name hn  ) 1.80 0.00 2.70
assign (resid  7  and name hn  ) (resid  19 and name hg# ) 1.80 0.00 4.20
assign (resid  7  and name hn  ) (resid  52 and name ha  ) 1.80 0.00 4.20
assign (resid  7  and name ha  ) (resid 21  and name hb# ) 1.80 0.00 4.20
assign (resid  7  and name hb# ) (resid 21  and name hg# ) 1.80 0.00 4.20
assign (resid  7  and name hb# ) (resid 51  and name ha  ) 1.80 0.00 4.20
assign (resid  7  and name hd# ) (resid 51  and name ha  ) 1.80 0.00 2.20
assign (resid  7  and name he# ) (resid 51  and name ha  ) 1.80 0.00 3.20
!D8
assign (resid  8  and name ha  ) (resid  8  and name hn  ) 1.80 0.00 2.20
assign (resid  8  and name hb1 ) (resid  8  and name hn  ) 1.80 0.00 2.20
assign (resid  8  and name hb2 ) (resid  8  and name hn  ) 1.80 0.00 2.20
assign (resid  8  and name hb# ) (resid  8  and name hn  ) 1.80 0.00 1.20
assign (resid  8  and name ha  ) (resid  9  and name hn  ) 1.80 0.00 1.20
assign (resid  8  and name hn  ) (resid  9  and name hn  ) 1.80 0.00 3.20
assign (resid  8  and name hb# ) (resid  9  and name hn  ) 1.80 0.00 3.20
assign (resid  8  and name hn  ) (resid  20 and name hg# ) 1.80 0.00 2.20
assign (resid  8  and name hn  ) (resid  21 and name hb1 ) 1.80 0.00 4.20
assign (resid  8  and name hn  ) (resid  21 and name hb2 ) 1.80 0.00 4.20
assign (resid  8  and name hn  ) (resid  21 and name hb# ) 1.80 0.00 3.20
assign (resid  8  and name hn  ) (resid  21 and name hg# ) 1.80 0.00 2.20
assign (resid  8  and name hn  ) (resid  21 and name hn  ) 1.80 0.00 3.20
assign (resid  8  and name ha  ) (resid 20  and name ha  ) 1.80 0.00 2.20
assign (resid  8  and name hb# ) (resid 20  and name ha  ) 1.80 0.00 3.20
assign (resid  8  and name ha  ) (resid 20  and name hg# ) 1.80 0.00 4.20
!F9
assign (resid  9  and name ha  ) (resid  9  and name hn  ) 1.80 0.00 2.70
assign (resid  9  and name hb2 ) (resid  9  and name hn  ) 1.80 0.00 2.70
assign (resid  9  and name hn  ) (resid  10 and name hn  ) 1.80 0.00 3.20
assign (resid  9  and name ha  ) (resid  10 and name hn  ) 1.80 0.00 1.20
assign (resid  9  and name hb1 ) (resid  10 and name hn  ) 1.80 0.00 4.20
assign (resid  9  and name hb2 ) (resid  10 and name hn  ) 1.80 0.00 3.70
assign (resid  9  and name hd# ) (resid  10 and name hn  ) 1.80 0.00 3.20
assign (resid  9  and name hn  ) (resid  19 and name hn  ) 1.80 0.00 2.70
assign (resid  9  and name hn  ) (resid  20 and name ha  ) 1.80 0.00 3.20
assign (resid  9  and name hb1 ) (resid  19 and name hn  ) 1.80 0.00 3.20
assign (resid  9  and name hb2 ) (resid  19 and name hn  ) 1.80 0.00 3.20
assign (resid  9  and name ha  ) (resid  9  and name hd# ) 1.80 0.00 3.70
assign (resid  9  and name ha  ) (resid  9  and name he# ) 1.80 0.00 4.20
!Q10
assign (resid  10 and name ha  ) (resid  10 and name hn  ) 1.80 0.00 3.20
assign (resid  10 and name hb1 ) (resid  10 and name hn  ) 1.80 0.00 1.20
assign (resid  10 and name hg2 ) (resid  10 and name hn  ) 1.80 0.00 4.20
assign (resid  10 and name ha  ) (resid  11 and name hn  ) 1.80 0.00 1.20
assign (resid  10 and name hb1 ) (resid  11 and name hn  ) 1.80 0.00 3.70
assign (resid  10 and name hg2 ) (resid  11 and name hn  ) 1.80 0.00 4.20
assign (resid  10 and name ha  ) (resid  19 and name hn  ) 1.80 0.00 3.20
assign (resid  10 and name ha  ) (resid  18 and name ha  ) 1.80 0.00 4.20
assign (resid  10 and name ha  ) (resid  18 and name hg2#) 1.80 0.00 3.20
!A11
assign (resid  11 and name ha  ) (resid  11 and name hn  ) 1.80 0.00 2.70
assign (resid  11 and name hb# ) (resid  11 and name hn  ) 1.80 0.00 1.20
assign (resid  11 and name ha  ) (resid  12 and name hn  ) 1.80 0.00 1.20
assign (resid  11 and name hb# ) (resid  12 and name hn  ) 1.80 0.00 1.70
assign (resid  11 and name hb# ) (resid  13 and name hn  ) 1.80 0.00 1.70
assign (resid  11 and name hb# ) (resid  16 and name hn  ) 1.80 0.00 2.70
assign (resid  11 and name hn  ) (resid  18 and name ha  ) 1.80 0.00 3.20
assign (resid  11 and name hn  ) (resid  19 and name hn  ) 1.80 0.00 3.20
assign (resid  11 and name ha  ) (resid  11 and name hb# ) 1.80 0.00 2.20
assign (resid  11 and name ha  ) (resid  12 and name hb# ) 1.80 0.00 3.20
assign (resid  11 and name ha  ) (resid  12 and name hg# ) 1.80 0.00 3.20
assign (resid  11 and name hb# ) (resid  16 and name hb1 ) 1.80 0.00 3.20
assign (resid  11 and name hb# ) (resid  16 and name hb2 ) 1.80 0.00 4.20
assign (resid  11 and name hb# ) (resid  16 and name hg# ) 1.80 0.00 4.20
assign (resid  11 and name hb# ) (resid  18 and name ha  ) 1.80 0.00 4.20
assign (resid  11 and name hb# ) (resid  18 and name hb  ) 1.80 0.00 2.20
!Q12
assign (resid  12 and name ha  ) (resid  12 and name hn  ) 1.80 0.00 2.70
assign (resid  12 and name hb1 ) (resid  12 and name hn  ) 1.80 0.00 1.70
assign (resid  12 and name hb2 ) (resid  12 and name hn  ) 1.80 0.00 1.70
assign (resid  12 and name hb# ) (resid  12 and name hn  ) 1.80 0.00 1.20
assign (resid  12 and name hb1 ) (resid  13 and name hn  ) 1.80 0.00 3.20
assign (resid  12 and name hb2 ) (resid  13 and name hn  ) 1.80 0.00 1.70
assign (resid  12 and name hg# ) (resid  13 and name hn  ) 1.80 0.00 1.70
assign (resid  12 and name ha  ) (resid  13 and name hn  ) 1.80 0.00 2.20
assign (resid  12 and name hn  ) (resid  13 and name hn  ) 1.80 0.00 1.20
assign (resid  12 and name hn  ) (resid  16 and name hb1 ) 1.80 0.00 3.70
assign (resid  12 and name hn  ) (resid  16 and name hb2 ) 1.80 0.00 3.20
assign (resid  12 and name hn  ) (resid  16 and name hb# ) 1.80 0.00 3.20
assign (resid  12 and name ha  ) (resid  12 and name hb# ) 1.80 0.00 3.20
!S13
assign (resid  13 and name ha  ) (resid  13 and name hn  ) 1.80 0.00 2.20
assign (resid  13 and name hb1 ) (resid  13 and name hn  ) 1.80 0.00 3.20
assign (resid  13 and name hb2 ) (resid  13 and name hn  ) 1.80 0.00 3.20
assign (resid  13 and name hb# ) (resid  13 and name hn  ) 1.80 0.00 2.20
assign (resid  13 and name hb# ) (resid  15 and name hn  ) 1.80 0.00 3.20
assign (resid  13 and name ha  ) (resid  14 and name hd1 ) 1.80 0.00 3.20
assign (resid  13 and name ha  ) (resid  14 and name hd2 ) 1.80 0.00 2.20
assign (resid  13 and name hb1 ) (resid  16 and name hg2 ) 1.80 0.00 4.20
assign (resid  13 and name hb2 ) (resid  16 and name hg2 ) 1.80 0.00 4.20
!P14
assign (resid  14 and name ha  ) (resid  15 and name hn  ) 1.80 0.00 3.20
assign (resid  14 and name hb# ) (resid  15 and name hn  ) 1.80 0.00 3.20
assign (resid  14 and name hd# ) (resid  15 and name hn  ) 1.80 0.00 3.20
assign (resid  14 and name ha  ) (resid  16 and name hn  ) 1.80 0.00 3.20
assign (resid  14 and name ha  ) (resid  14 and name hb1 ) 1.80 0.00 2.70
assign (resid  14 and name ha  ) (resid  14 and name hb2 ) 1.80 0.00 2.70
assign (resid  14 and name ha  ) (resid  14 and name hd2 ) 1.80 0.00 4.20
assign (resid  14 and name ha  ) (resid  16 and name hb# ) 1.80 0.00 4.20
assign (resid  14 and name hb# ) (resid  16 and name hb# ) 1.80 0.00 4.20
!K15
assign (resid  15 and name hn ) (resid  16 and name hn  ) 1.80 0.00 1.20
assign (resid  15 and name ha ) (resid  16 and name hn  ) 1.80 0.00 3.20
assign (resid  15 and name hb1) (resid  16 and name hn  ) 1.80 0.00 3.20
assign (resid  15 and name hb2) (resid  16 and name hn  ) 1.80 0.00 3.20
assign (resid  15 and name ha ) (resid  15 and name hn  ) 1.80 0.00 1.70
assign (resid  15 and name hb#) (resid  15 and name hn  ) 1.80 0.00 1.70
assign (resid  15 and name he#) (resid  46 and name hb  ) 1.80 0.00 4.20
assign (resid  15 and name he#) (resid  46 and name hg2#) 1.80 0.00 4.20
!E16
assign (resid  16 and name ha ) (resid  17 and name hn  ) 1.80 0.00 1.20
assign (resid  16 and name hb1) (resid  17 and name hn  ) 1.80 0.00 3.20
assign (resid  16 and name hb2) (resid  17 and name hn  ) 1.80 0.00 3.20
assign (resid  16 and name hg2) (resid  17 and name hn  ) 1.80 0.00 4.20
assign (resid  16 and name hn ) (resid  17 and name hn  ) 1.80 0.00 3.20
assign (resid  16 and name ha ) (resid  16 and name hn  ) 1.80 0.00 2.70
assign (resid  16 and name hb1) (resid  16 and name hn  ) 1.80 0.00 1.70
assign (resid  16 and name hb2) (resid  16 and name hn  ) 1.80 0.00 1.70
assign (resid  16 and name hg2) (resid  16 and name hn  ) 1.80 0.00 2.20
assign (resid  16 and name hn ) (resid  46 and name hd1#) 1.80 0.00 4.20
assign (resid  16 and name ha ) (resid  46 and name hn  ) 1.80 0.00 2.20
assign (resid  16 and name hb1) (resid  46 and name hn  ) 1.80 0.00 4.20
assign (resid  16 and name hg1) (resid  46 and name hn  ) 1.80 0.00 4.20
assign (resid  16 and name hg#) (resid  46 and name hd1#) 1.80 0.00 3.20
assign (resid  16 and name hg#) (resid  46 and name hg2#) 1.80 0.00 4.20
!L17
assign (resid  17 and name ha ) (resid  17 and name hn  ) 1.80 0.00 3.20
assign (resid  17 and name hb1) (resid  17 and name hn  ) 1.80 0.00 1.70
assign (resid  17 and name hb2) (resid  17 and name hn  ) 1.80 0.00 2.20
assign (resid  17 and name hd*) (resid  17 and name hn  ) 1.80 0.00 2.70
assign (resid  17 and name ha ) (resid  18 and name hn  ) 1.80 0.00 1.70
assign (resid  17 and name hb#) (resid  18 and name hn  ) 1.80 0.00 3.20
assign (resid  17 and name hd*) (resid  18 and name hn  ) 1.80 0.00 2.70
assign (resid  17 and name hn ) (resid  18 and name hn  ) 1.80 0.00 4.20
assign (resid  46 and name hn ) (resid  17 and name hn  ) 1.80 0.00 2.20
assign (resid  46 and name hb#) (resid  17 and name hn  ) 1.80 0.00 4.20
assign (resid  47 and name ha ) (resid  17 and name hn  ) 1.80 0.00 4.20
assign (resid  47 and name hd#) (resid  17 and name hn  ) 1.80 0.00 4.20
assign (resid  40 and name hn ) (resid  17 and name hd* ) 1.80 0.00 3.20
assign (resid  46 and name hn ) (resid  17 and name hb# ) 1.80 0.00 3.20
assign (resid  17 and name ha ) (resid  17 and name hd# ) 1.80 0.00 2.20
assign (resid  17 and name hd*) (resid  19 and name hd* ) 1.80 0.00 4.20
assign (resid  17 and name hd*) (resid  25 and name hg* ) 1.80 0.00 2.70
assign (resid  17 and name hd*) (resid  39 and name ha  ) 1.80 0.00 4.20
assign (resid  17 and name hd*) (resid  40 and name hb1 ) 1.80 0.00 4.20
assign (resid  17 and name hd*) (resid  40 and name hb2 ) 1.80 0.00 4.20
assign (resid  17 and name hd*) (resid  43 and name hb# ) 1.80 0.00 4.20
assign (resid  17 and name hd*) (resid  44 and name ha  ) 1.80 0.00 4.20
assign (resid  17 and name hd*) (resid  45 and name ha# ) 1.80 0.00 4.20
!T18
assign (resid  18 and name hb ) (resid  18 and name hn  ) 1.80 0.00 1.20
assign (resid  18 and name hg#) (resid  18 and name hn  ) 1.80 0.00 1.70
assign (resid  18 and name hn ) (resid  19 and name hn  ) 1.80 0.00 3.20
assign (resid  18 and name ha ) (resid  19 and name hn  ) 1.80 0.00 1.20
assign (resid  18 and name hb ) (resid  19 and name hn  ) 1.80 0.00 4.20
assign (resid  18 and name hg#) (resid  19 and name hn  ) 1.80 0.00 1.70
assign (resid  18 and name hg2#)(resid  20 and name ha  ) 1.80 0.00 3.20
!L19
assign (resid  19 and name ha ) (resid  20 and name hn  ) 1.80 0.00 1.20
assign (resid  19 and name hn ) (resid  19 and name hd* ) 1.80 0.00 4.20
assign (resid  19 and name hg#) (resid  19 and name hn  ) 1.80 0.00 2.70
assign (resid  19 and name hn ) (resid  20 and name hn  ) 1.80 0.00 4.20
assign (resid  40 and name hb1) (resid  19 and name hd* ) 1.80 0.00 4.20
assign (resid  40 and name hb2) (resid  19 and name hd* ) 1.80 0.00 4.20
assign (resid  40 and name hb#) (resid  19 and name hd* ) 1.80 0.00 3.20
assign (resid  48 and name hd#) (resid  19 and name hd* ) 1.80 0.00 4.20
assign (resid  47 and name hb1) (resid  19 and name hd* ) 1.80 0.00 4.20
assign (resid  47 and name hb1) (resid  19 and name hd* ) 1.80 0.00 4.20
!Q20
assign (resid  20 and name hb#) (resid  20 and name hn  ) 1.80 0.00 1.20
assign (resid  20 and name hg#) (resid  20 and name hn  ) 1.80 0.00 2.70
assign (resid  20 and name ha ) (resid  21 and name hn  ) 1.80 0.00 1.20
assign (resid  23 and name hb#) (resid  20 and name hn  ) 1.80 0.00 4.20
assign (resid  23 and name hn ) (resid  20 and name hn  ) 1.80 0.00 4.20
!K21
assign (resid  21 and name ha ) (resid  21 and name hn  ) 1.80 0.00 2.20
assign (resid  21 and name hb1) (resid  21 and name hn  ) 1.80 0.00 2.20
assign (resid  21 and name hb2) (resid  21 and name hn  ) 1.80 0.00 1.70
assign (resid  21 and name hb#) (resid  21 and name hn  ) 1.80 0.00 1.20
assign (resid  21 and name he#) (resid  21 and name hn  ) 1.80 0.00 4.20
assign (resid  21 and name hg#) (resid  21 and name hn  ) 1.80 0.00 3.20
assign (resid  21 and name ha ) (resid  22 and name hn  ) 1.80 0.00 1.20
assign (resid  21 and name hb2) (resid  22 and name hn  ) 1.80 0.00 3.20
assign (resid  21 and name hg#) (resid  22 and name hn  ) 1.80 0.00 2.20
assign (resid  21 and name hn ) (resid  22 and name hn  ) 1.80 0.00 4.20
assign (resid  21 and name ha ) (resid  23 and name hn  ) 1.80 0.00 3.20
assign (resid  21 and name ha ) (resid  21 and name he# ) 1.80 0.00 4.20
!G22
assign (resid  22 and name ha1) (resid  22 and name hn  ) 1.80 0.00 2.20
assign (resid  22 and name ha2) (resid  22 and name hn  ) 1.80 0.00 2.20
assign (resid  22 and name ha#) (resid  23 and name hn  ) 1.80 0.00 3.20
assign (resid  22 and name hn ) (resid  23 and name hn  ) 1.80 0.00 1.70
assign (resid  22 and name ha1) (resid  22 and name ha2 ) 1.80 0.00 2.20
!D23
assign (resid  23 and name ha ) (resid  23 and name hn  ) 1.80 0.00 2.20
assign (resid  23 and name hb2) (resid  23 and name hn  ) 1.80 0.00 2.20
assign (resid  23 and name ha ) (resid  24 and name hn  ) 1.80 0.00 1.20
assign (resid  23 and name hb#) (resid  24 and name hn  ) 1.80 0.00 3.20
assign (resid  23 and name hb1) (resid  25 and name hg2#) 1.80 0.00 4.20
!I24
assign (resid  24 and name ha ) (resid  24 and name hn  ) 1.80 0.00 3.20
assign (resid  24 and name hb#) (resid  24 and name hn  ) 1.80 0.00 2.20
assign (resid  24 and name hd1#)(resid  24 and name hn  ) 1.80 0.00 3.20
assign (resid  24 and name hg11)(resid  24 and name hn  ) 1.80 0.00 3.20
assign (resid  24 and name hg12)(resid  24 and name hn  ) 1.80 0.00 3.20
assign (resid  24 and name hg1#)(resid  24 and name hn  ) 1.80 0.00 2.70
assign (resid  24 and name hg2#)(resid  24 and name hn  ) 1.80 0.00 4.20
assign (resid  24 and name ha ) (resid  25 and name hn  ) 1.80 0.00 1.20
assign (resid  24 and name hb ) (resid  25 and name hn  ) 1.80 0.00 4.20
assign (resid  24 and name hd1#) (resid  25 and name hn ) 1.80 0.00 2.20
assign (resid  24 and name hg2#) (resid  25 and name hn ) 1.80 0.00 3.20
!V25
assign (resid  25 and name hb ) (resid  25 and name hn  ) 1.80 0.00 3.20
assign (resid  25 and name hg1#)(resid  25 and name hn  ) 1.80 0.00 1.20
assign (resid  25 and name ha ) (resid  26 and name hn  ) 1.80 0.00 1.20
assign (resid  25 and name hb ) (resid  26 and name hn  ) 1.80 0.00 1.70
assign (resid  25 and name hg1#) (resid  26 and name hn ) 1.80 0.00 2.70
assign (resid  25 and name hg1#) (resid  39 and name hn ) 1.80 0.00 3.20
assign (resid  25 and name ha ) (resid  25 and name hb  ) 1.80 0.00 2.70
assign (resid  25 and name ha ) (resid  25 and name hg2#) 1.80 0.00 2.70
assign (resid  25 and name hg2#)(resid  40 and name hb# ) 1.80 0.00 3.20
assign (resid  25 and name hg*) (resid  27 and name hd# ) 1.80 0.00 2.70
assign (resid  25 and name hg*) (resid 27 and name hg1# ) 1.80 0.00 3.20
!Y26
assign (resid  26 and name ha ) (resid  27 and name hn  ) 1.80 0.00 1.20
assign (resid  26 and name hb1) (resid  27 and name hn  ) 1.80 0.00 4.20
assign (resid  26 and name hb2) (resid  27 and name hn  ) 1.80 0.00 4.20
assign (resid  26 and name hb1) (resid  26 and name hn  ) 1.80 0.00 2.70
assign (resid  26 and name hb2) (resid  26 and name hn  ) 1.80 0.00 2.20
assign (resid  26 and name hb#) (resid  26 and name hn  ) 1.80 0.00 1.70
assign (resid  26 and name ha ) (resid  26 and name hn  ) 1.80 0.00 3.20
assign (resid  26 and name hn ) (resid  38 and name ha# ) 1.80 0.00 4.20
assign (resid  26 and name hn ) (resid  39 and name hn  ) 1.80 0.00 3.20
assign (resid  26 and name hb1) (resid  39 and name hn  ) 1.80 0.00 4.20
assign (resid  26 and name hb2) (resid  39 and name hn  ) 1.80 0.00 4.20
assign (resid  26 and name hb#) (resid  39 and name hn  ) 1.80 0.00 3.20
assign (resid  26 and name hb2) (resid  27 and name hd1#) 1.80 0.00 3.20
!I27
assign (resid  27 and name ha ) (resid  28 and name hn  ) 1.80 0.00 1.70
assign (resid  27 and name hg2#)(resid  28 and name hn  ) 1.80 0.00 3.20
assign (resid  27 and name ha ) (resid  27 and name hn  ) 1.80 0.00 3.20
assign (resid  26 and name hn ) (resid  27 and name hn  ) 1.80 0.00 4.20
assign (resid  27 and name hb ) (resid  27 and name hn  ) 1.80 0.00 1.20
assign (resid  27 and name hg1#)(resid  27 and name hn  ) 1.80 0.00 2.20
assign (resid  27 and name ha ) (resid  29 and name hn  ) 1.80 0.00 4.20
assign (resid  27 and name hg2#) (resid  29 and name hn ) 1.80 0.00 3.20
assign (resid  27 and name hb#) (resid  37 and name hn  ) 1.80 0.00 4.20
assign (resid  27 and name hg2#) (resid  37 and name hn ) 1.80 0.00 2.20
assign (resid  27 and name ha ) (resid  39 and name hn  ) 1.80 0.00 4.20
assign (resid  27 and name hd1#)(resid  28 and name hb# ) 1.80 0.00 4.20
assign (resid  27 and name hg2#)(resid  29 and name hg# ) 1.80 0.00 3.20
assign (resid  27 and name hg2#)(resid  30 and name ha  ) 1.80 0.00 4.20
!H28
assign (resid  28 and name hb#) (resid  28 and name hn  ) 1.80 0.00 3.20
assign (resid  28 and name hn ) (resid  29 and name hn  ) 1.80 0.00 2.70
assign (resid  28 and name ha ) (resid  29 and name hn  ) 1.80 0.00 3.20
assign (resid  28 and name hn ) (resid  37 and name hb# ) 1.80 0.00 2.70
assign (resid  28 and name hn ) (resid  38 and name ha# ) 1.80 0.00 3.20
!K29
assign (resid  29 and name ha ) (resid  30 and name hn  ) 1.80 0.00 1.20
assign (resid  29 and name hb2) (resid  30 and name hn  ) 1.80 0.00 2.20
assign (resid  29 and name hb1) (resid  30 and name hn  ) 1.80 0.00 2.20
assign (resid  29 and name ha ) (resid  29 and name hn  ) 1.80 0.00 2.20
assign (resid  29 and name hb1) (resid  29 and name hn  ) 1.80 0.00 2.20
assign (resid  29 and name hb2) (resid  29 and name hn  ) 1.80 0.00 3.20
assign (resid  29 and name hn ) (resid  36 and name hg# ) 1.80 0.00 4.20
assign (resid  29 and name hn ) (resid  37 and name hn  ) 1.80 0.00 3.70
assign (resid  29 and name hn ) (resid  38 and name ha2 ) 1.80 0.00 4.20
assign (resid  29 and name hd#) (resid  31 and name hg2#) 1.80 0.00 3.20
assign (resid  29 and name he#) (resid  31 and name hg1#) 1.80 0.00 3.20
assign (resid  29 and name he#) (resid  36 and name hg# ) 1.80 0.00 3.20
assign (resid  29 and name hg2) (resid  37 and name hg1 ) 1.80 0.00 4.20
assign (resid  29 and name hg2) (resid  37 and name hg2 ) 1.80 0.00 3.20
!E30
assign (resid  30 and name hb#) (resid  30 and name hn  ) 1.80 0.00 2.20
assign (resid  30 and name ha ) (resid  31 and name hn  ) 1.80 0.00 1.20
assign (resid  30 and name ha ) (resid  32 and name hn  ) 1.80 0.00 3.20
assign (resid  30 and name ha ) (resid  37 and name hn  ) 1.80 0.00 3.20
assign (resid  30 and name ha ) (resid  36 and name hg  ) 1.80 0.00 4.20
assign (resid  30 and name ha ) (resid  36 and name hd1#) 1.80 0.00 3.20
assign (resid  30 and name hb#) (resid  36 and name ha  ) 1.80 0.00 3.20
assign (resid  30 and name hb#) (resid  36 and name hd1#) 1.80 0.00 4.20
assign (resid  30 and name hg1) (resid  36 and name hd1#) 1.80 0.00 3.20
assign (resid  30 and name hg2) (resid  36 and name hd2#) 1.80 0.00 3.20
!V31
assign (resid  31 and name ha ) (resid  32 and name hn  ) 1.80 0.00 2.20
assign (resid  31 and name hb#) (resid  32 and name hn  ) 1.80 0.00 2.20
assign (resid  31 and name hg#) (resid  32 and name hn  ) 1.80 0.00 3.20
assign (resid  31 and name ha ) (resid  31 and name hn  ) 1.80 0.00 2.70
assign (resid  31 and name hb ) (resid  31 and name hn  ) 1.80 0.00 1.70
assign (resid  31 and name hg1#) (resid  31 and name hn ) 1.80 0.00 2.20 
assign (resid  31 and name hn ) (resid  35 and name hb# ) 1.80 0.00 4.20 
assign (resid  31 and name hn ) (resid  36 and name ha  ) 1.80 0.00 2.20
assign (resid  31 and name hn ) (resid  37 and name hn  ) 1.80 0.00 4.20
assign (resid  31 and name ha ) (resid  31 and name hg1#) 1.80 0.00 2.20
assign (resid  31 and name hb ) (resid  35 and name hb# ) 1.80 0.00 2.70
assign (resid  31 and name hg1#)(resid  36 and name ha  ) 1.80 0.00 4.20
assign (resid  31 and name hg2#)(resid  36 and name hg  ) 1.80 0.00 3.20
!D32
assign (resid  32 and name hb#) (resid  34 and name hn  ) 1.80 0.00 4.20
assign (resid  32 and name ha ) (resid  33 and name hn  ) 1.80 0.00 2.20
assign (resid  32 and name hb#) (resid  33 and name hn  ) 1.80 0.00 4.20
assign (resid  32 and name ha ) (resid  32 and name hn  ) 1.80 0.00 2.20
assign (resid  32 and name hb#) (resid  32 and name hn  ) 1.80 0.00 2.70
assign (resid  33 and name hn ) (resid  32 and name hn  ) 1.80 0.00 2.20
!K33
assign (resid  33 and name ha ) (resid  34 and name hn  ) 1.80 0.00 2.20
assign (resid  33 and name hb#) (resid  34 and name hn  ) 1.80 0.00 3.20
assign (resid  33 and name hg#) (resid  34 and name hn  ) 1.80 0.00 4.20
assign (resid  33 and name ha ) (resid  33 and name hn  ) 1.80 0.00 1.20
assign (resid  33 and name hb#) (resid  33 and name hn  ) 1.80 0.00 5.20
assign (resid  33 and name hg#) (resid  33 and name hn  ) 1.80 0.00 2.70
assign (resid  35 and name hn ) (resid  33 and name hn  ) 1.80 0.00 5.20
!N34
assign (resid  34 and name ha ) (resid  34 and name hn  ) 1.80 0.00 2.20
assign (resid  34 and name hb#) (resid  34 and name hn  ) 1.80 0.00 1.70
assign (resid  35 and name hn ) (resid  34 and name hn  ) 1.80 0.00 2.20
assign (resid  34 and name hb#) (resid  34 and name hd21) 1.80 0.00 3.20
assign (resid  34 and name hb#) (resid  34 and name hd22) 1.80 0.00 2.20
assign (resid  35 and name hn ) (resid  34 and name ha  ) 1.80 0.00 1.20
assign (resid  34 and name ha ) (resid  34 and name hb1 ) 1.80 0.00 3.20
assign (resid  34 and name ha ) (resid  34 and name hb2 ) 1.80 0.00 3.20
assign (resid  34 and name hb2) (resid  48 and name hb# ) 1.80 0.00 4.20
assign (resid  34 and name ha ) (resid  49 and name hb# ) 1.80 0.00 3.20
!W35
assign (resid  35 and name ha ) (resid  35 and name hn  ) 1.80 0.00 3.20
assign (resid  35 and name hb1) (resid  35 and name hn  ) 1.80 0.00 1.70
assign (resid  35 and name hb2) (resid  35 and name hn  ) 1.80 0.00 1.70
assign (resid  35 and name ha ) (resid  36 and name hn  ) 1.80 0.00 1.20
assign (resid  35 and name hb1) (resid  36 and name hn  ) 1.80 0.00 3.20
assign (resid  35 and name hb#) (resid  47 and name hn  ) 1.80 0.00 4.20
assign (resid  35 and name hd#) (resid  47 and name hn  ) 1.80 0.00 3.20
assign (resid  35 and name ha ) (resid  49 and name hn  ) 1.80 0.00 2.20
assign (resid  35 and name ha ) (resid  35 and name hd# ) 1.80 0.00 4.20
assign (resid  35 and name hn ) (resid  49 and name hb# ) 1.80 0.00 4.20
assign (resid  35 and name ha ) (resid  48 and name ha  ) 1.80 0.00 3.20
!L36
assign (resid  36 and name hb#) (resid  36 and name hn  ) 1.80 0.00 2.20
assign (resid  36 and name hd1#) (resid  36 and name hn ) 1.80 0.00 2.20
assign (resid  36 and name hd2#) (resid  36 and name hn ) 1.80 0.00 2.20
assign (resid  36 and name ha ) (resid  37 and name hn  ) 1.80 0.00 1.20
assign (resid  36 and name hg ) (resid  36 and name hn  ) 1.80 0.00 3.20
assign (resid  36 and name hg ) (resid  37 and name hn  ) 1.80 0.00 4.20
assign (resid  36 and name hn ) (resid  48 and name ha  ) 1.80 0.00 3.20
assign (resid  46 and name ha ) (resid  36 and name hn  ) 1.80 0.00 4.20
assign (resid  47 and name hn ) (resid  36 and name hn  ) 1.80 0.00 3.20
assign (resid  47 and name hn ) (resid  36 and name hd* ) 1.80 0.00 3.20
assign (resid  49 and name hn ) (resid  36 and name hn  ) 1.80 0.00 3.20
assign (resid  49 and name hb#) (resid  36 and name hn  ) 1.80 0.00 3.20
assign (resid  36 and name ha ) (resid  36 and name hd*) 1.80 0.00 2.70
assign (resid  36 and name hg ) (resid  46 and name hd*) 1.80 0.00 4.20
assign (resid  36 and name hd1#)(resid  49 and name ha  ) 1.80 0.00 3.20
assign (resid  36 and name hd2#)(resid  49 and name ha  ) 1.80 0.00 2.20
assign (resid  36 and name hg ) (resid  49 and name ha  ) 1.80 0.00 4.20
!E37
assign (resid  37 and name ha ) (resid  38 and name hn  ) 1.80 0.00 1.20
assign (resid  37 and name hg#) (resid  38 and name hn  ) 1.80 0.00 2.20
assign (resid  37 and name ha ) (resid  37 and name hn  ) 1.80 0.00 2.70
assign (resid  37 and name hb1) (resid  37 and name hn  ) 1.80 0.00 2.70
assign (resid  37 and name hb2) (resid  37 and name hn  ) 1.80 0.00 2.70
assign (resid  37 and name hb#) (resid  37 and name hn  ) 1.80 0.00 1.70
assign (resid  37 and name hg#) (resid  44 and name hg* ) 1.80 0.00 4.20
assign (resid  37 and name hg#) (resid  44 and name hd* ) 1.80 0.00 3.20
assign (resid  37 and name ha ) (resid  46 and name ha  ) 1.80 0.00 3.20
assign (resid  37 and name ha ) (resid  46 and name hd* ) 1.80 0.00 4.20
assign (resid  37 and name ha ) (resid  46 and name hg1#) 1.80 0.00 2.20
!G38
assign (resid  38 and name ha#) (resid  38 and name hn  ) 1.80 0.00 2.20
assign (resid  38 and name hn ) (resid  39 and name hb# ) 1.80 0.00 4.20
assign (resid  38 and name ha1) (resid  39 and name hn  ) 1.80 0.00 1.70
assign (resid  38 and name ha2) (resid  39 and name hn  ) 1.80 0.00 1.70
assign (resid  38 and name hn ) (resid  39 and name hn  ) 1.80 0.00 3.20
assign (resid  38 and name hn ) (resid  44 and name ha  ) 1.80 0.00 4.20
assign (resid  38 and name hn ) (resid  44 and name hg# ) 1.80 0.00 4.20
assign (resid  38 and name hn ) (resid  45 and name hn  ) 1.80 0.00 3.20
assign (resid  38 and name hn ) (resid  46 and name ha  ) 1.80 0.00 2.20
assign (resid  38 and name hn ) (resid  46 and name hg1#) 1.80 0.00 2.20
assign (resid  38 and name hn ) (resid  46 and name hg2#) 1.80 0.00 3.20
assign (resid  38 and name hn ) (resid  46 and name hn  ) 1.80 0.00 4.20
assign (resid  38 and name hn ) (resid  47 and name he# ) 1.80 0.00 4.20
!E39
assign (resid  39 and name ha ) (resid  40 and name hn  ) 1.80 0.00 1.20
assign (resid  39 and name hb#) (resid  40 and name hn  ) 1.80 0.00 2.70
assign (resid  39 and name hg#) (resid  40 and name hn  ) 1.80 0.00 3.20
assign (resid  39 and name ha ) (resid  39 and name hn  ) 1.80 0.00 3.20
assign (resid  39 and name hb1) (resid  39 and name hn  ) 1.80 0.00 2.70
assign (resid  39 and name hb2) (resid  39 and name hn  ) 1.80 0.00 2.70
assign (resid  39 and name hg#) (resid  39 and name hn  ) 1.80 0.00 2.20
assign (resid  39 and name hg#) (resid  42 and name hn  ) 1.80 0.00 3.20
assign (resid  39 and name ha ) (resid  43 and name hn  ) 1.80 0.00 4.20
assign (resid  39 and name ha ) (resid  45 and name hn  ) 1.80 0.00 2.70
assign (resid  39 and name hb1) (resid  45 and name hn  ) 1.80 0.00 3.70
assign (resid  39 and name hb2) (resid  45 and name hn  ) 1.80 0.00 3.70
assign (resid  39 and name ha ) (resid  44 and name ha  ) 1.80 0.00 2.20
assign (resid  39 and name ha ) (resid  44 and name hd1#) 1.80 0.00 4.20
assign (resid  39 and name ha ) (resid  44 and name hd2#) 1.80 0.00 4.20
assign (resid  39 and name hb1) (resid  44 and name ha  ) 1.80 0.00 4.20
assign (resid  39 and name hb1) (resid  44 and name hd* ) 1.80 0.00 4.20
assign (resid  39 and name hb2) (resid  44 and name hd* ) 1.80 0.00 4.20
assign (resid  39 and name hb#) (resid  44 and name hd* ) 1.80 0.00 3.20
assign (resid  39 and name hg#) (resid  44 and name hd2#) 1.80 0.00 4.20
assign (resid  39 and name hb#) (resid  46 and name hg1#) 1.80 0.00 4.20
assign (resid  39 and name hg#) (resid  46 and name hg1#) 1.80 0.00 4.20
!H40
assign (resid  40 and name ha ) (resid  40 and name hn  ) 1.80 0.00 3.20
assign (resid  40 and name hb1) (resid  40 and name hn  ) 1.80 0.00 2.70
assign (resid  40 and name hb2) (resid  40 and name hn  ) 1.80 0.00 2.70
assign (resid  40 and name hn ) (resid  43 and name hn  ) 1.80 0.00 2.20
assign (resid  40 and name hn ) (resid  44 and name ha  ) 1.80 0.00 4.20
assign (resid  40 and name ha ) (resid  40 and name hb# ) 1.80 0.00 3.20
!H41
assign (resid  41 and name ha ) (resid  41 and name hn  ) 1.80 0.00 3.20
!G42
assign (resid  42 and name ha1) (resid  42 and name hn  ) 1.80 0.00 1.70
assign (resid  42 and name ha2) (resid  42 and name hn  ) 1.80 0.00 1.70
assign (resid  42 and name ha1) (resid  43 and name hn  ) 1.80 0.00 3.20
assign (resid  42 and name ha2) (resid  43 and name hn  ) 1.80 0.00 3.20
assign (resid  42 and name hn ) (resid  43 and name hn  ) 1.80 0.00 2.20
!R43
assign (resid  43 and name ha ) (resid  44 and name hn  ) 1.80 0.00 1.20
assign (resid  43 and name ha ) (resid  43 and name hn  ) 1.80 0.00 2.20
assign (resid  43 and name hd#) (resid  43 and name hn  ) 1.80 0.00 3.20
assign (resid  43 and name hg#) (resid  43 and name hn  ) 1.80 0.00 2.20
assign (resid  43 and name hd#) (resid  44 and name hg  ) 1.80 0.00 3.20
!L44
assign (resid  44 and name ha ) (resid  44 and name hn  ) 1.80 0.00 2.70
assign (resid  44 and name hb1) (resid  44 and name hn  ) 1.80 0.00 2.20
assign (resid  44 and name hb2) (resid  44 and name hn  ) 1.80 0.00 2.20
assign (resid  44 and name hg ) (resid  44 and name hn  ) 1.80 0.00 3.20
assign (resid  44 and name ha ) (resid  45 and name hn  ) 1.80 0.00 1.20
assign (resid  44 and name hb2) (resid  45 and name hn  ) 1.80 0.00 3.20
assign (resid  44 and name hd*) (resid  45 and name hn  ) 1.80 0.00 3.20
assign (resid  44 and name hg#) (resid  45 and name hn  ) 1.80 0.00 2.20
!G45
assign (resid  45 and name ha#) (resid  45 and name hn  ) 1.80 0.00 1.20
assign (resid  45 and name ha#) (resid  45 and name hn  ) 1.80 0.00 1.70
assign (resid  45 and name ha#) (resid  46 and name hn  ) 1.80 0.00 1.70
assign (resid  45 and name ha1) (resid  46 and name hd* ) 1.80 0.00 4.20
assign (resid  45 and name ha2) (resid  46 and name hd* ) 1.80 0.00 4.20
!I46
assign (resid  46 and name ha ) (resid  46 and name hn  ) 1.80 0.00 3.20
assign (resid  46 and name hb ) (resid  46 and name hn  ) 1.80 0.00 3.20
assign (resid  46 and name hd1#) (resid  46 and name hn ) 1.80 0.00 2.20
assign (resid  46 and name hg11)(resid  46 and name hn  ) 1.80 0.00 3.20
assign (resid  46 and name hg12)(resid  46 and name hn  ) 1.80 0.00 3.20
assign (resid  46 and name ha ) (resid  47 and name hn  ) 1.80 0.00 1.20
assign (resid  46 and name hb ) (resid  47 and name hn  ) 1.80 0.00 2.20
assign (resid  46 and name hg1#)(resid  47 and name hn  ) 1.80 0.00 2.20
assign (resid  46 and name hg2#)(resid  47 and name hn  ) 1.80 0.00 4.20
!F47
assign (resid  47 and name ha ) (resid  47 and name hn  ) 1.80 0.00 2.20
assign (resid  47 and name hb1) (resid  47 and name hn  ) 1.80 0.00 4.20
assign (resid  47 and name hb2) (resid  47 and name hn  ) 1.80 0.00 4.20
assign (resid  47 and name hd#) (resid  47 and name hn  ) 1.80 0.00 3.20
assign (resid  47 and name ha ) (resid  48 and name hd1 ) 1.80 0.00 4.20
assign (resid  47 and name ha ) (resid  48 and name hd2 ) 1.80 0.00 4.20
assign (resid  47 and name hb#) (resid  48 and name hd1 ) 1.80 0.00 4.20
assign (resid  47 and name hb#) (resid  48 and name hd2 ) 1.80 0.00 4.20
assign (resid  47 and name hb#) (resid  52 and name hg1#) 1.80 0.00 4.20
!P48
assign (resid  48 and name ha ) (resid  49 and name hn  ) 1.80 0.00 1.20
assign (resid  48 and name hb#) (resid  49 and name hn  ) 1.80 0.00 3.20
assign (resid  48 and name ha ) (resid  50 and name hn  ) 1.80 0.00 3.20
assign (resid  48 and name hb#) (resid  50 and name hn  ) 1.80 0.00 3.20
assign (resid  48 and name ha ) (resid  48 and name hb# ) 1.80 0.00 4.20
assign (resid  48 and name hg#) (resid  50 and name hb# ) 1.80 0.00 3.20
!A49
assign (resid  49 and name hb1) (resid  49 and name hn  ) 1.80 0.00 2.70
assign (resid  49 and name hb2) (resid  49 and name hn  ) 1.80 0.00 2.70
assign (resid  49 and name hb#) (resid  49 and name hn  ) 1.80 0.00 1.70
assign (resid  49 and name hn ) (resid  50 and name hn  ) 1.80 0.00 2.20
assign (resid  49 and name hb#) (resid  50 and name hn  ) 1.80 0.00 1.70
assign (resid  49 and name hn ) (resid  51 and name hn  ) 1.80 0.00 3.20
assign (resid  49 and name ha ) (resid  51 and name hn  ) 1.80 0.00 3.20
!N50
assign (resid  50 and name ha ) (resid  50 and name hn  ) 1.80 0.00 3.20
assign (resid  50 and name hb1) (resid  50 and name hn  ) 1.80 0.00 1.70
assign (resid  50 and name hb2) (resid  50 and name hn  ) 1.80 0.00 2.20
assign (resid  50 and name hb#) (resid  50 and name hn  ) 1.80 0.00 2.70
assign (resid  50 and name hb#) (resid  50 and name hd21) 1.80 0.00 2.20
assign (resid  50 and name hb#) (resid  50 and name hd22) 1.80 0.00 3.20
assign (resid  50 and name ha ) (resid  51 and name hn  ) 1.80 0.00 3.20
assign (resid  50 and name hn ) (resid  51 and name hn  ) 1.80 0.00 2.20
assign (resid  50 and name ha ) (resid  52 and name hn  ) 1.80 0.00 3.20
!Y51
assign (resid  51 and name ha ) (resid  51 and name hn  ) 1.80 0.00 3.20
assign (resid  51 and name hb1) (resid  51 and name hn  ) 1.80 0.00 3.20
assign (resid  51 and name hb2) (resid  51 and name hn  ) 1.80 0.00 3.20
assign (resid  51 and name hb#) (resid  51 and name hn  ) 1.80 0.00 2.20
assign (resid  51 and name ha ) (resid  52 and name hn  ) 1.80 0.00 3.20
assign (resid  51 and name hn ) (resid  52 and name hn  ) 1.80 0.00 1.20
assign (resid  51 and name hb#) (resid  52 and name hn  ) 1.80 0.00 3.20
!V52
assign (resid  52 and name ha ) (resid  52 and name hn  ) 1.80 0.00 2.70
assign (resid  52 and name hb ) (resid  52 and name hn  ) 1.80 0.00 3.20
assign (resid  52 and name hg*) (resid  52 and name hn  ) 1.80 0.00 2.20
assign (resid  52 and name ha ) (resid  53 and name hn  ) 1.80 0.00 1.20
assign (resid  52 and name hb ) (resid  53 and name hn  ) 1.80 0.00 3.20
assign (resid  52 and name hn ) (resid  53 and name hn  ) 1.80 0.00 3.20
assign (resid  54 and name hn ) (resid  52 and name hg* ) 1.80 0.00 4.20
assign (resid  52 and name ha ) (resid  52 and name hb  ) 1.80 0.00 3.20
assign (resid  54 and name ha ) (resid  52 and name hg1#) 1.80 0.00 3.20
assign (resid  54 and name ha ) (resid  52 and name hg2#) 1.80 0.00 4.20
assign (resid  52 and name ha ) (resid  52 and name hg* ) 1.80 0.00 2.70
!E53
assign (resid  53 and name ha ) (resid  54 and name hn  ) 1.80 0.00 2.20
assign (resid  53 and name hb#) (resid  54 and name hn  ) 1.80 0.00 2.70
assign (resid  53 and name hn ) (resid  55 and name hn  ) 1.80 0.00 4.20
!V54
assign (resid  54 and name ha ) (resid  54 and name hn  ) 1.80 0.00 2.70
assign (resid  54 and name hb ) (resid  54 and name hn  ) 1.80 0.00 1.20
assign (resid  54 and name hg*) (resid  54 and name hn  ) 1.80 0.00 2.20
assign (resid  54 and name ha ) (resid  55 and name hn  ) 1.80 0.00 2.20
assign (resid  54 and name hb ) (resid  55 and name hn  ) 1.80 0.00 4.20
assign (resid  54 and name hn ) (resid  55 and name hn  ) 1.80 0.00 4.20
!L55
assign (resid  55 and name ha ) (resid  55 and name hn  ) 1.80 0.00 3.20
assign (resid  55 and name hd*) (resid  55 and name hn  ) 1.80 0.00 2.70
assign (resid  55 and name ha ) (resid  55 and name hb# ) 1.80 0.00 2.70
assign (resid  55 and name ha ) (resid  56 and name hd1 ) 1.80 0.00 2.70
assign (resid  55 and name ha ) (resid  56 and name hd2 ) 1.80 0.00 2.70
assign (resid  55 and name ha ) (resid  56 and name hg# ) 1.80 0.00 3.20
assign (resid  55 and name hd*) (resid  56 and name hd# ) 1.80 0.00 3.20
assign (resid  55 and name ha ) (resid  55 and name hd1#) 1.80 0.00 2.70
!P56
assign (resid  56 and name ha ) (resid  57 and name hn  ) 1.80 0.00 1.20
assign (resid  56 and name hb1) (resid  57 and name hn  ) 1.80 0.00 3.20
assign (resid  56 and name hb2) (resid  57 and name hn  ) 1.80 0.00 3.20
assign (resid  56 and name hb#) (resid  57 and name hn  ) 1.80 0.00 2.20
!L57
assign (resid  57 and name hb#) (resid  58 and name hn  ) 1.80 0.00 2.70
assign (resid  57 and name ha ) (resid  57 and name hd* ) 1.80 0.00 2.70
assign (resid  57 and name ha ) (resid  57 and name hg  ) 1.80 0.00 2.70
assign (resid  57 and name hg ) (resid  57 and name hd1#) 1.80 0.00 2.20
assign (resid  57 and name hb#) (resid  57 and name hd2#) 1.80 0.00 2.70
!E58
assign (resid  58 and name ha ) (resid  58 and name hn  ) 1.80 0.00 1.20

!dihed_rama
!
assign (resid 1 and name c)  (resid 2 and name n)
         (resid 2 and name ca) (resid 2 and name c)     1.0  -125.4 24.77 2
assign (resid 2 and name n)  (resid 2 and name ca)
         (resid 2 and name c)  (resid 3 and name n)     1.0  135.14 17.20 2
!
assign (resid 2 and name c)  (resid 3 and name n)
         (resid 3 and name ca) (resid 3 and name c)     1.0  -135.59 20.85 2
assign (resid 3 and name n)  (resid 3 and name ca)
         (resid 3 and name c)  (resid 4 and name n)     1.0  146.52 21.95 2

!
assign (resid 3 and name c)  (resid 4 and name n)
         (resid 4 and name ca) (resid 4 and name c)     1.0  -109.93 8.66 2
assign (resid 4 and name n)  (resid 4 and name ca)
         (resid 4 and name c)  (resid 5 and name n)     1.0  121.53 11.81 2

!
assign (resid 8 and name c)  (resid 9 and name n)
         (resid 9 and name ca) (resid 9 and name c)     1.0  -119.02 22.18 2
assign (resid 9 and name n)  (resid 9 and name ca)
         (resid 9 and name c)  (resid 10 and name n)     1.0  133.80 10.86 2

!
assign (resid 9 and name c)  (resid 10 and name n)
         (resid 10 and name ca) (resid 10 and name c)     1.0  -109.39 24.60 2
assign (resid 10 and name n)  (resid 10 and name ca)
         (resid 10 and name c)  (resid 11 and name n)     1.0  125.19 17.64 2

!
assign (resid 12 and name c)  (resid 13 and name n)
         (resid 13 and name ca) (resid 13 and name c)     1.0  -100.23 24.97 2
assign (resid 13 and name n)  (resid 13 and name ca)
         (resid 13 and name c)  (resid 14 and name n)     1.0  128.85 31.48 2

!
assign (resid 13 and name c)  (resid 14 and name n)
         (resid 14 and name ca) (resid 14 and name c)     1.0  -61.71 6.19 2
assign (resid 14 and name n)  (resid 14 and name ca)
         (resid 14 and name c)  (resid 15 and name n)     1.0  -19.56 8.56 2

!
assign (resid 14 and name c)  (resid 15 and name n)
         (resid 15 and name ca) (resid 15 and name c)     1.0  -89.48 17.13 2
assign (resid 15 and name n)  (resid 15 and name ca)
         (resid 15 and name c)  (resid 16 and name n)     1.0  -12.68 16.13 2

!
assign (resid 16 and name c)  (resid 17 and name n)
         (resid 17 and name ca) (resid 17 and name c)     1.0  -112.47 18.94 2
assign (resid 17 and name n)  (resid 17 and name ca)
         (resid 17 and name c)  (resid 18 and name n)     1.0  129.03 6.96 2

!
assign (resid 17 and name c)  (resid 18 and name n)
         (resid 18 and name ca) (resid 18 and name c)     1.0  -99.84 13.99 2
assign (resid 18 and name n)  (resid 18 and name ca)
         (resid 18 and name c)  (resid 19 and name n)     1.0  129.23 6.5 2

!
assign (resid 18 and name c)  (resid 19 and name n)
         (resid 19 and name ca) (resid 19 and name c)     1.0  -131.78 14.63 2
assign (resid 19 and name n)  (resid 19 and name ca)
         (resid 19 and name c)  (resid 20 and name n)     1.0  148.23 11.49 2

!
assign (resid 19 and name c)  (resid 20 and name n)
         (resid 20 and name ca) (resid 20 and name c)     1.0  -103.14 26.16 2
assign (resid 20 and name n)  (resid 20 and name ca)
         (resid 20 and name c)  (resid 21 and name n)     1.0  150.55 14.36 2

!
assign (resid 21 and name c)  (resid 22 and name n)
         (resid 22 and name ca) (resid 22 and name c)     1.0  93.60 5.37 2
assign (resid 22 and name n)  (resid 22 and name ca)
         (resid 22 and name c)  (resid 23 and name n)     1.0  -13.93 8.20 2

!
assign (resid 22 and name c)  (resid 23 and name n)
         (resid 23 and name ca) (resid 23 and name c)     1.0  -73.10 24.88 2
assign (resid 23 and name n)  (resid 23 and name ca)
         (resid 23 and name c)  (resid 24 and name n)     1.0  140.35 9.20 2

!
assign (resid 23 and name c)  (resid 24 and name n)
         (resid 24 and name ca) (resid 24 and name c)     1.0  -106.75 8.08 2
assign (resid 24 and name n)  (resid 24 and name ca)
         (resid 24 and name c)  (resid 25 and name n)     1.0  134.06 9.00 2

!
assign (resid 24 and name c)  (resid 25 and name n)
         (resid 25 and name ca) (resid 25 and name c)     1.0  -132.86 8.43 2
assign (resid 25 and name n)  (resid 25 and name ca)
         (resid 25 and name c)  (resid 26 and name n)     1.0  154.76 13.17 2

!
assign (resid 26 and name c)  (resid 27 and name n)
         (resid 27 and name ca) (resid 27 and name c)     1.0  -71.54 9.97 2
assign (resid 27 and name n)  (resid 27 and name ca)
         (resid 27 and name c)  (resid 28 and name n)     1.0  132.19 7.42 2

!
assign (resid 28 and name c)  (resid 29 and name n)
         (resid 29 and name ca) (resid 29 and name c)     1.0  -139.84 32.45 2
assign (resid 29 and name n)  (resid 29 and name ca)
         (resid 29 and name c)  (resid 30 and name n)     1.0  154.19 11.98 2

!
assign (resid 29 and name c)  (resid 30 and name n)
         (resid 30 and name ca) (resid 30 and name c)     1.0  -92.62 22.26 2
assign (resid 30 and name n)  (resid 30 and name ca)
         (resid 30 and name c)  (resid 31 and name n)     1.0  129.86 27.53 2

!
assign (resid 31 and name c)  (resid 32 and name n)
         (resid 32 and name ca) (resid 32 and name c)     1.0  -84.50 21.28 2
assign (resid 32 and name n)  (resid 32 and name ca)
         (resid 32 and name c)  (resid 33 and name n)     1.0  -12.86 23.42 2

!
assign (resid 32 and name c)  (resid 33 and name n)
         (resid 33 and name ca) (resid 33 and name c)     1.0  -65.46 18.00 2
assign (resid 33 and name n)  (resid 33 and name ca)
         (resid 33 and name c)  (resid 34 and name n)     1.0  -36.20 16.00 2

!
assign (resid 34 and name c)  (resid 35 and name n)
         (resid 35 and name ca) (resid 35 and name c)     1.0  -113.45 45.36 2
assign (resid 35 and name n)  (resid 35 and name ca)
         (resid 35 and name c)  (resid 36 and name n)     1.0  145.23 29.24 2

!
assign (resid 36 and name c)  (resid 37 and name n)
         (resid 37 and name ca) (resid 37 and name c)     1.0  -116.87 16.35 2
assign (resid 37 and name n)  (resid 37 and name ca)
         (resid 37 and name c)  (resid 38 and name n)     1.0  135.15 13.15 2

!
assign (resid 38 and name c)  (resid 39 and name n)
         (resid 39 and name ca) (resid 39 and name c)     1.0  -134.89 15.50 2
assign (resid 39 and name n)  (resid 39 and name ca)
         (resid 39 and name c)  (resid 40 and name n)     1.0  154.71 10.16 2

!
assign (resid 39 and name c)  (resid 40 and name n)
         (resid 40 and name ca) (resid 40 and name c)     1.0  -139.88 10.54 2
assign (resid 40 and name n)  (resid 40 and name ca)
         (resid 40 and name c)  (resid 41 and name n)     1.0  123.72 10.29 2

!
assign (resid 40 and name c)  (resid 41 and name n)
         (resid 41 and name ca) (resid 41 and name c)     1.0  51.64 4.22 2
assign (resid 41 and name n)  (resid 41 and name ca)
         (resid 41 and name c)  (resid 42 and name n)     1.0  44.46 6.43 2

!
assign (resid 41 and name c)  (resid 42 and name n)
         (resid 42 and name ca) (resid 42 and name c)     1.0  77.74 8.17 2
assign (resid 42 and name n)  (resid 42 and name ca)
         (resid 42 and name c)  (resid 43 and name n)     1.0  2.07 13.01 2

!
assign (resid 42 and name c)  (resid 43 and name n)
         (resid 43 and name ca) (resid 43 and name c)     1.0  -101.22 20.17 2
assign (resid 43 and name n)  (resid 43 and name ca)
         (resid 43 and name c)  (resid 44 and name n)     1.0  139.74 15.72 2

!
assign (resid 43 and name c)  (resid 44 and name n)
         (resid 44 and name ca) (resid 44 and name c)     1.0  -115.05 17.22 2
assign (resid 44 and name n)  (resid 44 and name ca)
         (resid 44 and name c)  (resid 45 and name n)     1.0  140.60 12.21 2

!
assign (resid 45 and name c)  (resid 46 and name n)
         (resid 46 and name ca) (resid 46 and name c)     1.0  -123.76 20.52 2
assign (resid 46 and name n)  (resid 46 and name ca)
         (resid 46 and name c)  (resid 47 and name n)     1.0  156.55 8.27 2

!
assign (resid 46 and name c)  (resid 47 and name n)
         (resid 47 and name ca) (resid 47 and name c)     1.0  -125.26 35.05 2
assign (resid 47 and name n)  (resid 47 and name ca)
         (resid 47 and name c)  (resid 48 and name n)     1.0  152.62 6.89 2

!
assign (resid 47 and name c)  (resid 48 and name n)
         (resid 48 and name ca) (resid 48 and name c)     1.0  -67.05 13.66 2
assign (resid 48 and name n)  (resid 48 and name ca)
         (resid 48 and name c)  (resid 49 and name n)     1.0  146.56 12.78 2

!
assign (resid 48 and name c)  (resid 49 and name n)
         (resid 49 and name ca) (resid 49 and name c)     1.0  -60.22 6.75 2
assign (resid 49 and name n)  (resid 49 and name ca)
         (resid 49 and name c)  (resid 50 and name n)     1.0  -25.29 13.72 2

!
assign (resid 49 and name c)  (resid 50 and name n)
         (resid 50 and name ca) (resid 50 and name c)     1.0  -80.12 21.38 2
assign (resid 50 and name n)  (resid 50 and name ca)
         (resid 50 and name c)  (resid 51 and name n)     1.0  -8.53 22.74 2

!
assign (resid 51 and name c)  (resid 52 and name n)
         (resid 52 and name ca) (resid 52 and name c)     1.0  -137.16 17.97 2
assign (resid 52 and name n)  (resid 52 and name ca)
         (resid 52 and name c)  (resid 53 and name n)     1.0  156.22 10.57 2

!
assign (resid 52 and name c)  (resid 53 and name n)
         (resid 53 and name ca) (resid 53 and name c)     1.0  -128.2 25.52 2
assign (resid 53 and name n)  (resid 53 and name ca)
         (resid 53 and name c)  (resid 54 and name n)     1.0  138.80 17.89 2

!
assign (resid 53 and name c)  (resid 54 and name n)
         (resid 54 and name ca) (resid 54 and name c)     1.0  -82.55 14.25 2
assign (resid 54 and name n)  (resid 54 and name ca)
         (resid 54 and name c)  (resid 55 and name n)     1.0  124.31 9.66 2


!hbond
assign (resid  3 and name hn ) (resid 25 and name o ) 2.00 0.60 0.70
assign (resid  3 and name n  ) (resid 25 and name o ) 3.00 0.60 0.70
assign (resid 25 and name hn ) (resid  3 and name o ) 2.00 0.60 0.70
assign (resid 25 and name n  ) (resid  3 and name o ) 3.00 0.60 0.70
assign (resid  5 and name hn ) (resid 23 and name o ) 2.00 0.60 0.70
assign (resid  5 and name n  ) (resid 23 and name o ) 3.00 0.60 0.70
assign (resid  9 and name hn ) (resid 19 and name o ) 2.00 0.60 0.70
assign (resid  9 and name n  ) (resid 19 and name o ) 3.00 0.60 0.70
assign (resid 19 and name hn ) (resid  9 and name o ) 2.00 0.60 0.70
assign (resid 19 and name n  ) (resid  9 and name o ) 3.00 0.60 0.70
assign (resid 17 and name hn ) (resid 46 and name o ) 2.00 0.60 0.70
assign (resid 17 and name n  ) (resid 46 and name o ) 3.00 0.60 0.70
assign (resid 28 and name hn ) (resid 37 and name o ) 2.00 0.60 0.70
assign (resid 28 and name n  ) (resid 37 and name o ) 3.00 0.60 0.70
assign (resid 36 and name hn ) (resid 47 and name o ) 2.00 0.60 0.70
assign (resid 36 and name n  ) (resid 47 and name o ) 3.00 0.60 0.70
assign (resid 47 and name hn ) (resid 36 and name o ) 2.00 0.60 0.70
assign (resid 47 and name n  ) (resid 36 and name o ) 3.00 0.60 0.70
assign (resid 38 and name hn ) (resid 45 and name o ) 2.00 0.60 0.70
assign (resid 38 and name  n ) (resid 45 and name o ) 3.00 0.60 0.70
assign (resid 45 and name hn ) (resid 38 and name o ) 1.80 0.20 0.60
assign (resid 45 and name  n ) (resid 38 and name o ) 2.70 0.30 0.60
assign (resid 40 and name hn ) (resid 43 and name o ) 1.80 0.20 0.60
assign (resid 40 and name  n ) (resid 43 and name o ) 2.70 0.30 0.60
assign (resid 43 and name hn ) (resid 40 and name o ) 1.80 0.20 0.60
assign (resid 43 and name  n ) (resid 40 and name o ) 2.70 0.30 0.60

                                            
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   0          HT1       MET   0   5.027  -8.604 -10.153
    2   2H    MET   0          HT2       MET   0   3.860  -7.671  -9.310
    3   3H    MET   0          HT3       MET   0   3.812  -9.385  -9.230
    4    HA   MET   0           HA       MET   0   5.854  -9.446  -8.070
    5   1HB   MET   0          HB2       MET   0   5.821  -6.569  -8.838
    6   2HB   MET   0          HB1       MET   0   6.554  -6.984  -7.296
    7   1HG   MET   0          HG2       MET   0   7.392  -8.630  -9.583
    8   2HG   MET   0          HG1       MET   0   7.874  -6.936  -9.639
    9   1HE   MET   0          HE1       MET   0  10.134  -6.719  -9.373
   10   2HE   MET   0          HE2       MET   0  10.546  -8.423  -9.568
   11   3HE   MET   0          HE3       MET   0  11.208  -7.505  -8.215
   12    H    LYS   1           HN       LYS   1   3.368  -9.929  -7.307
   13    HA   LYS   1           HA       LYS   1   1.968  -9.995  -5.516
   14   1HB   LYS   1          HB2       LYS   1   4.432  -9.872  -4.447
   15   2HB   LYS   1          HB1       LYS   1   3.767  -8.380  -3.797
   16   1HG   LYS   1          HG2       LYS   1   3.318  -9.955  -2.152
   17   2HG   LYS   1          HG1       LYS   1   1.792  -9.820  -3.029
   18   1HD   LYS   1          HD2       LYS   1   2.216 -12.142  -2.661
   19   2HD   LYS   1          HD1       LYS   1   2.486 -11.813  -4.374
   20   1HE   LYS   1          HE2       LYS   1   4.850 -11.530  -2.646
   21   2HE   LYS   1          HE1       LYS   1   4.211 -13.167  -2.783
   22   1HZ   LYS   1          HZ1       LYS   1   4.474 -11.693  -5.272
   23   2HZ   LYS   1          HZ2       LYS   1   4.812 -13.315  -4.933
   24   3HZ   LYS   1          HZ3       LYS   1   5.927 -12.115  -4.513
   25    H    ALA   2           HN       ALA   2   0.209  -8.798  -5.887
   26    HA   ALA   2           HA       ALA   2   0.394  -5.884  -5.489
   27   1HB   ALA   2          HB1       ALA   2  -1.212  -5.544  -7.111
   28   2HB   ALA   2          HB2       ALA   2  -1.881  -7.167  -6.938
   29   3HB   ALA   2          HB3       ALA   2  -0.338  -6.933  -7.759
   30    H    ALA   3           HN       ALA   3  -1.306  -4.819  -4.373
   31    HA   ALA   3           HA       ALA   3  -3.140  -6.523  -2.851
   32   1HB   ALA   3          HB1       ALA   3  -1.766  -4.351  -1.355
   33   2HB   ALA   3          HB2       ALA   3  -0.899  -5.862  -1.629
   34   3HB   ALA   3          HB3       ALA   3  -2.441  -5.873  -0.774
   35    H    ARG   4           HN       ARG   4  -5.124  -5.671  -2.618
   36    HA   ARG   4           HA       ARG   4  -5.542  -2.944  -3.621
   37   1HB   ARG   4          HB2       ARG   4  -6.773  -4.735  -4.770
   38   2HB   ARG   4          HB1       ARG   4  -7.522  -5.199  -3.249
   39   1HG   ARG   4          HG2       ARG   4  -8.871  -3.322  -3.187
   40   2HG   ARG   4          HG1       ARG   4  -7.828  -2.413  -4.282
   41   1HD   ARG   4          HD2       ARG   4  -9.887  -3.073  -5.398
   42   2HD   ARG   4          HD1       ARG   4  -8.495  -3.871  -6.128
   43    HE   ARG   4           HE       ARG   4  -9.360  -5.684  -4.321
   44   1HH1  ARG   4          HH11      ARG   4 -10.964  -3.907  -6.862
   45   2HH1  ARG   4          HH12      ARG   4 -12.133  -5.149  -7.163
   46   1HH2  ARG   4          HH21      ARG   4 -10.897  -7.317  -4.717
   47   2HH2  ARG   4          HH22      ARG   4 -12.095  -7.085  -5.946
   48    H    LEU   5           HN       LEU   5  -6.149  -1.359  -2.299
   49    HA   LEU   5           HA       LEU   5  -6.224  -1.671   0.486
   50   1HB   LEU   5          HB2       LEU   5  -5.947   0.440  -1.135
   51   2HB   LEU   5          HB1       LEU   5  -7.641   0.637  -0.727
   52    HG   LEU   5           HG       LEU   5  -6.710   0.345   1.743
   53   1HD1  LEU   5          HD11      LEU   5  -4.469   0.109   1.653
   54   2HD1  LEU   5          HD12      LEU   5  -4.508   1.869   1.552
   55   3HD1  LEU   5          HD13      LEU   5  -4.338   0.905   0.085
   56   1HD2  LEU   5          HD21      LEU   5  -6.357   2.895   1.705
   57   2HD2  LEU   5          HD22      LEU   5  -7.936   2.258   1.246
   58   3HD2  LEU   5          HD23      LEU   5  -6.800   2.780   0.002
   59    H    LYS   6           HN       LYS   6  -7.861  -1.822   1.960
   60    HA   LYS   6           HA       LYS   6 -10.597  -2.081   0.909
   61   1HB   LYS   6          HB2       LYS   6  -8.982  -4.037   2.393
   62   2HB   LYS   6          HB1       LYS   6 -10.592  -3.785   3.054
   63   1HG   LYS   6          HG2       LYS   6 -10.475  -4.139   0.139
   64   2HG   LYS   6          HG1       LYS   6 -10.007  -5.545   1.098
   65   1HD   LYS   6          HD2       LYS   6 -12.532  -4.010   1.648
   66   2HD   LYS   6          HD1       LYS   6 -12.474  -5.317   0.465
   67   1HE   LYS   6          HE2       LYS   6 -12.379  -6.910   2.049
   68   2HE   LYS   6          HE1       LYS   6 -11.282  -5.973   3.063
   69   1HZ   LYS   6          HZ1       LYS   6 -13.010  -4.926   4.120
   70   2HZ   LYS   6          HZ2       LYS   6 -13.691  -6.451   3.851
   71   3HZ   LYS   6          HZ3       LYS   6 -14.097  -5.155   2.844
   72    H    PHE   7           HN       PHE   7  -8.833  -0.093   2.593
   73    HA   PHE   7           HA       PHE   7 -11.024   0.732   4.288
   74   1HB   PHE   7          HB2       PHE   7  -8.328   0.272   5.568
   75   2HB   PHE   7          HB1       PHE   7  -9.834   0.722   6.361
   76    HD1  PHE   7           HD2      PHE   7  -7.999  -2.011   4.730
   77    HD2  PHE   7           HD1      PHE   7 -11.467  -0.914   6.938
   78    HE1  PHE   7           HE2      PHE   7  -8.484  -4.387   5.138
   79    HE2  PHE   7           HE1      PHE   7 -11.959  -3.289   7.353
   80    HZ   PHE   7           HZ       PHE   7 -10.467  -5.030   6.451
   81    H    ASP   8           HN       ASP   8 -11.180   2.879   4.224
   82    HA   ASP   8           HA       ASP   8  -9.455   4.489   2.734
   83   1HB   ASP   8          HB2       ASP   8 -10.703   6.392   3.662
   84   2HB   ASP   8          HB1       ASP   8 -11.789   5.093   3.178
   85    H    PHE   9           HN       PHE   9  -7.444   5.076   3.179
   86    HA   PHE   9           HA       PHE   9  -6.714   5.574   5.991
   87   1HB   PHE   9          HB2       PHE   9  -5.636   3.558   4.930
   88   2HB   PHE   9          HB1       PHE   9  -4.836   4.655   3.810
   89    HD1  PHE   9           HD2      PHE   9  -5.391   4.463   7.500
   90    HD2  PHE   9           HD1      PHE   9  -2.652   5.101   4.307
   91    HE1  PHE   9           HE2      PHE   9  -3.576   4.791   9.128
   92    HE2  PHE   9           HE1      PHE   9  -0.831   5.429   5.929
   93    HZ   PHE   9           HZ       PHE   9  -1.293   5.275   8.343
   94    H    GLN  10           HN       GLN  10  -5.568   7.403   6.478
   95    HA   GLN  10           HA       GLN  10  -5.173   9.308   4.263
   96   1HB   GLN  10          HB2       GLN  10  -6.945   9.779   6.092
   97   2HB   GLN  10          HB1       GLN  10  -5.567  10.126   7.128
   98   1HG   GLN  10          HG2       GLN  10  -4.948  11.989   5.899
   99   2HG   GLN  10          HG1       GLN  10  -5.845  11.469   4.473
  100   1HE2  GLN  10          HE21      GLN  10  -6.160  14.000   5.273
  101   2HE2  GLN  10          HE22      GLN  10  -7.710  14.235   5.997
  102    H    ALA  11           HN       ALA  11  -3.157   9.949   3.888
  103    HA   ALA  11           HA       ALA  11  -0.957   8.955   5.336
  104   1HB   ALA  11          HB1       ALA  11  -0.528   9.439   3.098
  105   2HB   ALA  11          HB2       ALA  11   0.311  10.724   3.966
  106   3HB   ALA  11          HB3       ALA  11  -1.248  11.046   3.208
  107    H    GLN  12           HN       GLN  12   0.166   9.727   7.023
  108    HA   GLN  12           HA       GLN  12  -0.712  12.271   8.183
  109   1HB   GLN  12          HB2       GLN  12   0.706  11.269  10.171
  110   2HB   GLN  12          HB1       GLN  12  -0.950  10.758   9.890
  111   1HG   GLN  12          HG2       GLN  12  -0.156   8.771   8.737
  112   2HG   GLN  12          HG1       GLN  12   1.513   9.296   8.962
  113   1HE2  GLN  12          HE21      GLN  12   1.683  10.068  11.483
  114   2HE2  GLN  12          HE22      GLN  12   1.283   8.789  12.574
  115    H    SER  13           HN       SER  13   2.111  10.521   7.059
  116    HA   SER  13           HA       SER  13   3.792  12.860   7.638
  117   1HB   SER  13          HB2       SER  13   4.355   9.941   7.317
  118   2HB   SER  13          HB1       SER  13   5.625  11.095   6.909
  119    HG   SER  13           HG       SER  13   5.342  10.236   9.210
  120    HA   PRO  14           HA       PRO  14   4.117  14.156   3.447
  121   1HB   PRO  14          HB2       PRO  14   7.070  14.130   3.796
  122   2HB   PRO  14          HB1       PRO  14   6.009  15.447   3.284
  123   1HG   PRO  14          HG2       PRO  14   7.067  15.419   5.730
  124   2HG   PRO  14          HG1       PRO  14   5.409  15.985   5.457
  125   1HD   PRO  14          HD2       PRO  14   6.367  13.390   6.584
  126   2HD   PRO  14          HD1       PRO  14   4.955  14.366   7.037
  127    H    LYS  15           HN       LYS  15   6.136  11.513   4.556
  128    HA   LYS  15           HA       LYS  15   6.791  10.603   1.905
  129   1HB   LYS  15          HB2       LYS  15   8.210  10.283   3.997
  130   2HB   LYS  15          HB1       LYS  15   7.064   9.034   4.464
  131   1HG   LYS  15          HG2       LYS  15   7.721   8.360   1.873
  132   2HG   LYS  15          HG1       LYS  15   9.243   8.944   2.550
  133   1HD   LYS  15          HD2       LYS  15   7.530   6.989   4.047
  134   2HD   LYS  15          HD1       LYS  15   8.658   6.445   2.803
  135   1HE   LYS  15          HE2       LYS  15   9.711   6.320   4.976
  136   2HE   LYS  15          HE1       LYS  15  10.488   7.570   4.006
  137   1HZ   LYS  15          HZ1       LYS  15   9.977   8.151   6.390
  138   2HZ   LYS  15          HZ2       LYS  15   8.344   8.185   5.952
  139   3HZ   LYS  15          HZ3       LYS  15   9.435   9.256   5.228
  140    H    GLU  16           HN       GLU  16   4.322   9.967   4.278
  141    HA   GLU  16           HA       GLU  16   3.424   7.497   3.180
  142   1HB   GLU  16          HB2       GLU  16   2.384   9.452   5.176
  143   2HB   GLU  16          HB1       GLU  16   1.255   8.293   4.487
  144   1HG   GLU  16          HG2       GLU  16   3.399   6.722   5.166
  145   2HG   GLU  16          HG1       GLU  16   3.356   7.916   6.462
  146    H    LEU  17           HN       LEU  17   1.296   7.167   2.184
  147    HA   LEU  17           HA       LEU  17   0.478   9.435   0.491
  148   1HB   LEU  17          HB2       LEU  17   1.779   7.882  -0.848
  149   2HB   LEU  17          HB1       LEU  17   0.777   6.544  -0.319
  150    HG   LEU  17           HG       LEU  17  -1.110   8.154  -1.408
  151   1HD1  LEU  17          HD11      LEU  17   0.945   8.404  -3.502
  152   2HD1  LEU  17          HD12      LEU  17   1.100   9.508  -2.136
  153   3HD1  LEU  17          HD13      LEU  17  -0.389   9.478  -3.081
  154   1HD2  LEU  17          HD21      LEU  17   0.374   6.424  -3.304
  155   2HD2  LEU  17          HD22      LEU  17  -1.351   6.493  -2.941
  156   3HD2  LEU  17          HD23      LEU  17  -0.248   5.676  -1.833
  157    H    THR  18           HN       THR  18  -1.667   9.792   0.303
  158    HA   THR  18           HA       THR  18  -3.428   8.171   1.962
  159    HB   THR  18           HB       THR  18  -3.959  10.768   0.505
  160    HG1  THR  18           HG1      THR  18  -3.602  11.730   2.462
  161   1HG2  THR  18          HG21      THR  18  -5.748   8.990   1.850
  162   2HG2  THR  18          HG22      THR  18  -6.086  10.514   1.030
  163   3HG2  THR  18          HG23      THR  18  -5.629  10.512   2.733
  164    H    LEU  19           HN       LEU  19  -4.736   6.670   1.168
  165    HA   LEU  19           HA       LEU  19  -5.802   6.935  -1.531
  166   1HB   LEU  19          HB2       LEU  19  -5.146   4.704  -2.196
  167   2HB   LEU  19          HB1       LEU  19  -3.726   5.653  -1.800
  168    HG   LEU  19           HG       LEU  19  -4.990   3.657   0.077
  169   1HD1  LEU  19          HD11      LEU  19  -2.845   2.367  -0.516
  170   2HD1  LEU  19          HD12      LEU  19  -2.816   3.374  -1.964
  171   3HD1  LEU  19          HD13      LEU  19  -4.194   2.320  -1.651
  172   1HD2  LEU  19          HD21      LEU  19  -3.768   4.946   1.490
  173   2HD2  LEU  19          HD22      LEU  19  -2.685   5.512   0.218
  174   3HD2  LEU  19          HD23      LEU  19  -2.470   3.903   0.908
  175    H    GLN  20           HN       GLN  20  -7.823   6.124  -1.744
  176    HA   GLN  20           HA       GLN  20  -9.064   5.052   0.670
  177   1HB   GLN  20          HB2       GLN  20  -9.906   6.955  -1.093
  178   2HB   GLN  20          HB1       GLN  20 -10.756   5.537  -1.691
  179   1HG   GLN  20          HG2       GLN  20 -11.437   5.211   0.787
  180   2HG   GLN  20          HG1       GLN  20 -10.995   6.910   0.948
  181   1HE2  GLN  20          HE21      GLN  20 -12.798   8.043   1.015
  182   2HE2  GLN  20          HE22      GLN  20 -14.141   7.879  -0.059
  183    H    LYS  21           HN       LYS  21 -10.742   3.334   0.380
  184    HA   LYS  21           HA       LYS  21  -9.678   0.957  -0.464
  185   1HB   LYS  21          HB2       LYS  21 -12.617   1.667  -0.439
  186   2HB   LYS  21          HB1       LYS  21 -11.949   0.041  -0.398
  187   1HG   LYS  21          HG2       LYS  21 -12.036   0.164   1.811
  188   2HG   LYS  21          HG1       LYS  21 -10.724   1.340   1.726
  189   1HD   LYS  21          HD2       LYS  21 -12.077   3.060   2.241
  190   2HD   LYS  21          HD1       LYS  21 -13.377   2.468   1.205
  191   1HE   LYS  21          HE2       LYS  21 -12.886   0.861   3.614
  192   2HE   LYS  21          HE1       LYS  21 -13.452   2.502   3.923
  193   1HZ   LYS  21          HZ1       LYS  21 -15.129   1.770   2.003
  194   2HZ   LYS  21          HZ2       LYS  21 -15.447   1.527   3.646
  195   3HZ   LYS  21          HZ3       LYS  21 -14.841   0.258   2.707
  196    H    GLY  22           HN       GLY  22 -10.004  -0.418  -2.260
  197   1HA   GLY  22          HA2       GLY  22 -10.667  -0.930  -4.458
  198   2HA   GLY  22          HA1       GLY  22 -11.207   0.736  -4.658
  199    H    ASP  23           HN       ASP  23  -8.424   1.426  -3.408
  200    HA   ASP  23           HA       ASP  23  -7.135   1.787  -5.957
  201   1HB   ASP  23          HB2       ASP  23  -6.734   2.762  -3.187
  202   2HB   ASP  23          HB1       ASP  23  -5.293   2.670  -4.195
  203    H    ILE  24           HN       ILE  24  -5.527   0.625  -6.812
  204    HA   ILE  24           HA       ILE  24  -4.335  -1.500  -5.152
  205    HB   ILE  24           HB       ILE  24  -5.741  -2.362  -6.983
  206   1HG1  ILE  24          HG12      ILE  24  -3.583  -3.506  -8.197
  207   2HG1  ILE  24          HG11      ILE  24  -2.852  -2.898  -6.715
  208   1HG2  ILE  24          HG21      ILE  24  -3.790  -0.911  -8.765
  209   2HG2  ILE  24          HG22      ILE  24  -5.510  -0.569  -8.579
  210   3HG2  ILE  24          HG23      ILE  24  -4.987  -2.083  -9.319
  211   1HD1  ILE  24          HD11      ILE  24  -4.393  -5.239  -7.102
  212   2HD1  ILE  24          HD12      ILE  24  -5.286  -4.166  -6.023
  213   3HD1  ILE  24          HD13      ILE  24  -3.637  -4.646  -5.623
  214    H    VAL  25           HN       VAL  25  -2.161  -1.632  -5.007
  215    HA   VAL  25           HA       VAL  25  -0.547   0.082  -6.771
  216    HB   VAL  25           HB       VAL  25   0.921   0.620  -4.848
  217   1HG1  VAL  25          HG11      VAL  25  -0.850   2.163  -5.617
  218   2HG1  VAL  25          HG12      VAL  25  -0.499   2.324  -3.896
  219   3HG1  VAL  25          HG13      VAL  25  -1.943   1.461  -4.424
  220   1HG2  VAL  25          HG21      VAL  25  -1.255  -0.278  -3.004
  221   2HG2  VAL  25          HG22      VAL  25   0.444   0.044  -2.658
  222   3HG2  VAL  25          HG23      VAL  25  -0.017  -1.416  -3.533
  223    H    TYR  26           HN       TYR  26   1.671  -0.563  -7.001
  224    HA   TYR  26           HA       TYR  26   1.995  -3.462  -6.741
  225   1HB   TYR  26          HB2       TYR  26   3.599  -1.476  -8.364
  226   2HB   TYR  26          HB1       TYR  26   3.781  -3.226  -8.403
  227    HD1  TYR  26           HD2      TYR  26   1.195  -0.586  -8.939
  228    HD2  TYR  26           HD1      TYR  26   2.656  -4.430 -10.029
  229    HE1  TYR  26           HE2      TYR  26  -0.494  -0.715 -10.721
  230    HE2  TYR  26           HE1      TYR  26   0.972  -4.569 -11.816
  231    HH   TYR  26           HH       TYR  26  -1.222  -3.591 -12.359
  232    H    ILE  27           HN       ILE  27   2.871  -3.991  -4.837
  233    HA   ILE  27           HA       ILE  27   4.812  -2.304  -3.529
  234    HB   ILE  27           HB       ILE  27   4.232  -5.099  -2.633
  235   1HG1  ILE  27          HG12      ILE  27   2.016  -4.343  -3.075
  236   2HG1  ILE  27          HG11      ILE  27   2.270  -4.134  -1.346
  237   1HG2  ILE  27          HG21      ILE  27   4.849  -4.357  -0.553
  238   2HG2  ILE  27          HG22      ILE  27   4.368  -2.693  -0.883
  239   3HG2  ILE  27          HG23      ILE  27   5.854  -3.336  -1.582
  240   1HD1  ILE  27          HD11      ILE  27   2.108  -2.061  -3.491
  241   2HD1  ILE  27          HD12      ILE  27   2.904  -1.717  -1.955
  242   3HD1  ILE  27          HD13      ILE  27   1.203  -2.183  -1.983
  243    H    HIS  28           HN       HIS  28   6.979  -2.646  -3.311
  244    HA   HIS  28           HA       HIS  28   8.164  -4.554  -5.171
  245   1HB   HIS  28          HB2       HIS  28   8.850  -1.952  -4.269
  246   2HB   HIS  28          HB1       HIS  28  10.136  -3.036  -3.749
  247    HD1  HIS  28           HD1      HIS  28  11.949  -2.607  -5.396
  248    HD2  HIS  28           HD2      HIS  28   8.256  -3.125  -7.230
  249    HE1  HIS  28           HE1      HIS  28  12.421  -2.627  -7.866
  250    HE2  HIS  28           HE2      HIS  28  10.163  -2.868  -8.958
  251    H    LYS  29           HN       LYS  29   8.678  -3.581  -1.778
  252    HA   LYS  29           HA       LYS  29   9.413  -6.370  -1.190
  253   1HB   LYS  29          HB2       LYS  29  11.075  -5.545   0.430
  254   2HB   LYS  29          HB1       LYS  29  11.450  -5.038  -1.211
  255   1HG   LYS  29          HG2       LYS  29   9.882  -3.200   0.522
  256   2HG   LYS  29          HG1       LYS  29  11.615  -3.369   0.806
  257   1HD   LYS  29          HD2       LYS  29  12.091  -2.094  -0.957
  258   2HD   LYS  29          HD1       LYS  29  11.076  -3.081  -2.009
  259   1HE   LYS  29          HE2       LYS  29   9.101  -1.815  -1.001
  260   2HE   LYS  29          HE1       LYS  29  10.300  -0.692  -0.362
  261   1HZ   LYS  29          HZ1       LYS  29   9.154  -0.589  -2.836
  262   2HZ   LYS  29          HZ2       LYS  29  10.691  -1.224  -3.144
  263   3HZ   LYS  29          HZ3       LYS  29  10.534   0.257  -2.343
  264    H    GLU  30           HN       GLU  30   8.768  -7.178   0.809
  265    HA   GLU  30           HA       GLU  30   6.619  -5.652   2.079
  266   1HB   GLU  30          HB2       GLU  30   7.285  -8.520   2.665
  267   2HB   GLU  30          HB1       GLU  30   5.754  -7.682   2.876
  268   1HG   GLU  30          HG2       GLU  30   5.089  -8.402   0.899
  269   2HG   GLU  30          HG1       GLU  30   6.420  -7.534   0.135
  270    H    VAL  31           HN       VAL  31   7.184  -4.436   3.709
  271    HA   VAL  31           HA       VAL  31   9.364  -5.292   5.459
  272    HB   VAL  31           HB       VAL  31   8.206  -2.773   6.239
  273   1HG1  VAL  31          HG11      VAL  31  10.647  -3.986   6.286
  274   2HG1  VAL  31          HG12      VAL  31  10.350  -2.286   6.649
  275   3HG1  VAL  31          HG13      VAL  31  10.868  -2.765   5.033
  276   1HG2  VAL  31          HG21      VAL  31   9.098  -2.976   3.363
  277   2HG2  VAL  31          HG22      VAL  31   8.892  -1.463   4.245
  278   3HG2  VAL  31          HG23      VAL  31   7.501  -2.504   3.945
  279    H    ASP  32           HN       ASP  32   8.454  -6.824   6.688
  280    HA   ASP  32           HA       ASP  32   5.909  -6.766   7.861
  281   1HB   ASP  32          HB2       ASP  32   6.838  -8.542   9.386
  282   2HB   ASP  32          HB1       ASP  32   7.038  -8.860   7.665
  283    H    LYS  33           HN       LYS  33   8.590  -4.872   8.623
  284    HA   LYS  33           HA       LYS  33   8.622  -4.703  11.377
  285   1HB   LYS  33          HB2       LYS  33   9.502  -2.455  11.106
  286   2HB   LYS  33          HB1       LYS  33  10.195  -3.523   9.893
  287   1HG   LYS  33          HG2       LYS  33   8.636  -2.646   8.227
  288   2HG   LYS  33          HG1       LYS  33   7.944  -1.572   9.445
  289   1HD   LYS  33          HD2       LYS  33  10.156  -0.511   9.723
  290   2HD   LYS  33          HD1       LYS  33  10.791  -1.548   8.443
  291   1HE   LYS  33          HE2       LYS  33   9.681  -0.423   6.791
  292   2HE   LYS  33          HE1       LYS  33   8.364   0.063   7.858
  293   1HZ   LYS  33          HZ1       LYS  33  11.033   1.283   7.548
  294   2HZ   LYS  33          HZ2       LYS  33  10.133   1.527   8.959
  295   3HZ   LYS  33          HZ3       LYS  33   9.512   2.020   7.465
  296    H    ASN  34           HN       ASN  34   6.127  -3.780   9.219
  297    HA   ASN  34           HA       ASN  34   3.900  -3.543  10.167
  298   1HB   ASN  34          HB2       ASN  34   4.719  -3.096  12.470
  299   2HB   ASN  34          HB1       ASN  34   5.189  -1.475  11.966
  300   1HD2  ASN  34          HD21      ASN  34   3.694  -1.106  13.867
  301   2HD2  ASN  34          HD22      ASN  34   2.025  -0.863  13.496
  302    H    TRP  35           HN       TRP  35   5.664  -2.415   8.054
  303    HA   TRP  35           HA       TRP  35   3.855  -0.366   7.170
  304   1HB   TRP  35          HB2       TRP  35   6.140   0.457   8.575
  305   2HB   TRP  35          HB1       TRP  35   6.538   0.706   6.880
  306    HD1  TRP  35           HD1      TRP  35   2.898   1.223   7.390
  307    HE1  TRP  35           HE1      TRP  35   2.361   3.736   7.491
  308    HE3  TRP  35           HE3      TRP  35   7.646   3.052   7.891
  309    HZ2  TRP  35           HZ2      TRP  35   3.760   6.172   7.751
  310    HZ3  TRP  35           HZ3      TRP  35   7.960   5.486   8.061
  311    HH2  TRP  35           HH2      TRP  35   6.056   7.013   7.991
  312    H    LEU  36           HN       LEU  36   3.467  -1.001   5.141
  313    HA   LEU  36           HA       LEU  36   5.454  -2.484   3.652
  314   1HB   LEU  36          HB2       LEU  36   3.064  -3.128   3.748
  315   2HB   LEU  36          HB1       LEU  36   2.658  -1.641   2.912
  316    HG   LEU  36           HG       LEU  36   4.372  -2.600   1.129
  317   1HD1  LEU  36          HD11      LEU  36   4.951  -4.728   1.390
  318   2HD1  LEU  36          HD12      LEU  36   3.261  -5.210   1.543
  319   3HD1  LEU  36          HD13      LEU  36   4.170  -4.713   2.972
  320   1HD2  LEU  36          HD21      LEU  36   1.985  -4.025   0.631
  321   2HD2  LEU  36          HD22      LEU  36   2.467  -2.450   0.001
  322   3HD2  LEU  36          HD23      LEU  36   1.543  -2.553   1.499
  323    H    GLU  37           HN       GLU  37   6.497  -1.782   1.826
  324    HA   GLU  37           HA       GLU  37   6.227   1.078   1.218
  325   1HB   GLU  37          HB2       GLU  37   8.454   0.365   1.945
  326   2HB   GLU  37          HB1       GLU  37   8.510  -0.814   0.643
  327   1HG   GLU  37          HG2       GLU  37   8.865   0.769  -0.967
  328   2HG   GLU  37          HG1       GLU  37   8.064   2.042  -0.046
  329    H    GLY  38           HN       GLY  38   5.254   1.653  -0.601
  330   1HA   GLY  38          HA2       GLY  38   5.473  -0.103  -2.947
  331   2HA   GLY  38          HA1       GLY  38   3.876   0.383  -2.398
  332    H    GLU  39           HN       GLU  39   4.864   0.929  -4.962
  333    HA   GLU  39           HA       GLU  39   4.831   3.857  -4.892
  334   1HB   GLU  39          HB2       GLU  39   7.098   2.319  -5.575
  335   2HB   GLU  39          HB1       GLU  39   6.468   2.963  -7.084
  336   1HG   GLU  39          HG2       GLU  39   6.491   5.224  -6.052
  337   2HG   GLU  39          HG1       GLU  39   7.284   4.520  -4.645
  338    H    HIS  40           HN       HIS  40   3.760   4.827  -6.608
  339    HA   HIS  40           HA       HIS  40   2.777   3.175  -8.787
  340   1HB   HIS  40          HB2       HIS  40   1.166   3.089  -6.756
  341   2HB   HIS  40          HB1       HIS  40   0.756   4.740  -7.208
  342    HD1  HIS  40           HD1      HIS  40   1.311   1.769  -9.508
  343    HD2  HIS  40           HD2      HIS  40  -1.681   4.418  -8.367
  344    HE1  HIS  40           HE1      HIS  40  -0.644   1.261 -11.006
  345    HE2  HIS  40           HE2      HIS  40  -2.472   2.814 -10.235
  346    H    HIS  41           HN       HIS  41   2.570   4.284 -10.636
  347    HA   HIS  41           HA       HIS  41   2.768   5.983 -12.134
  348   1HB   HIS  41          HB2       HIS  41   0.528   6.484 -11.133
  349   2HB   HIS  41          HB1       HIS  41   1.322   7.609 -10.036
  350    HD1  HIS  41           HD1      HIS  41   1.706   7.164 -13.799
  351    HD2  HIS  41           HD2      HIS  41   0.713  10.062 -10.992
  352    HE1  HIS  41           HE1      HIS  41   1.389   9.287 -15.109
  353    HE2  HIS  41           HE2      HIS  41   0.703  11.007 -13.400
  354    H    GLY  42           HN       GLY  42   5.001   5.631 -10.420
  355   1HA   GLY  42          HA2       GLY  42   7.040   6.722 -10.251
  356   2HA   GLY  42          HA1       GLY  42   6.267   8.191 -10.819
  357    H    ARG  43           HN       ARG  43   4.254   7.445  -8.458
  358    HA   ARG  43           HA       ARG  43   5.765   9.003  -6.490
  359   1HB   ARG  43          HB2       ARG  43   3.010   8.968  -7.359
  360   2HB   ARG  43          HB1       ARG  43   3.106   8.728  -5.620
  361   1HG   ARG  43          HG2       ARG  43   4.444  10.986  -7.092
  362   2HG   ARG  43          HG1       ARG  43   2.867  11.098  -6.308
  363   1HD   ARG  43          HD2       ARG  43   4.367  10.069  -4.300
  364   2HD   ARG  43          HD1       ARG  43   5.569  11.047  -5.141
  365    HE   ARG  43           HE       ARG  43   3.475  12.735  -4.898
  366   1HH1  ARG  43          HH11      ARG  43   5.193  10.738  -2.609
  367   2HH1  ARG  43          HH12      ARG  43   4.907  11.803  -1.275
  368   1HH2  ARG  43          HH21      ARG  43   3.098  14.138  -3.144
  369   2HH2  ARG  43          HH22      ARG  43   3.716  13.732  -1.577
  370    H    LEU  44           HN       LEU  44   6.106   8.295  -4.421
  371    HA   LEU  44           HA       LEU  44   5.647   5.440  -3.986
  372   1HB   LEU  44          HB2       LEU  44   7.449   5.436  -2.517
  373   2HB   LEU  44          HB1       LEU  44   7.944   6.552  -3.773
  374    HG   LEU  44           HG       LEU  44   6.774   7.435  -1.136
  375   1HD1  LEU  44          HD11      LEU  44   8.761   6.424  -0.483
  376   2HD1  LEU  44          HD12      LEU  44   9.223   8.108  -0.732
  377   3HD1  LEU  44          HD13      LEU  44   9.602   6.899  -1.959
  378   1HD2  LEU  44          HD21      LEU  44   8.042   8.837  -3.464
  379   2HD2  LEU  44          HD22      LEU  44   8.024   9.557  -1.854
  380   3HD2  LEU  44          HD23      LEU  44   6.506   9.176  -2.667
  381    H    GLY  45           HN       GLY  45   4.230   4.692  -2.559
  382   1HA   GLY  45          HA2       GLY  45   3.203   6.538  -0.500
  383   2HA   GLY  45          HA1       GLY  45   2.105   5.579  -1.482
  384    H    ILE  46           HN       ILE  46   3.522   5.734   1.457
  385    HA   ILE  46           HA       ILE  46   3.528   2.805   1.776
  386    HB   ILE  46           HB       ILE  46   5.007   4.858   3.424
  387   1HG1  ILE  46          HG12      ILE  46   5.921   2.972   1.251
  388   2HG1  ILE  46          HG11      ILE  46   5.968   4.730   1.221
  389   1HG2  ILE  46          HG21      ILE  46   5.413   3.264   4.916
  390   2HG2  ILE  46          HG22      ILE  46   5.997   2.176   3.658
  391   3HG2  ILE  46          HG23      ILE  46   4.283   2.220   4.059
  392   1HD1  ILE  46          HD11      ILE  46   8.143   4.241   1.686
  393   2HD1  ILE  46          HD12      ILE  46   7.736   2.808   2.630
  394   3HD1  ILE  46          HD13      ILE  46   7.496   4.415   3.316
  395    H    PHE  47           HN       PHE  47   2.525   1.904   3.558
  396    HA   PHE  47           HA       PHE  47   1.214   3.503   5.548
  397   1HB   PHE  47          HB2       PHE  47  -1.073   2.862   5.006
  398   2HB   PHE  47          HB1       PHE  47  -0.359   3.732   3.653
  399    HD1  PHE  47           HD2      PHE  47   0.291   2.526   1.611
  400    HD2  PHE  47           HD1      PHE  47  -1.736   0.587   4.811
  401    HE1  PHE  47           HE2      PHE  47  -0.292   0.666   0.109
  402    HE2  PHE  47           HE1      PHE  47  -2.323  -1.277   3.316
  403    HZ   PHE  47           HZ       PHE  47  -1.601  -1.238   0.961
  404    HA   PRO  48           HA       PRO  48   1.581  -0.077   8.074
  405   1HB   PRO  48          HB2       PRO  48  -1.333   0.097   8.662
  406   2HB   PRO  48          HB1       PRO  48   0.040   0.041   9.774
  407   1HG   PRO  48          HG2       PRO  48  -1.260   2.324   9.329
  408   2HG   PRO  48          HG1       PRO  48   0.502   2.300   9.528
  409   1HD   PRO  48          HD2       PRO  48  -1.123   2.589   7.041
  410   2HD   PRO  48          HD1       PRO  48   0.424   3.344   7.474
  411    H    ALA  49           HN       ALA  49   1.535  -2.225   7.743
  412    HA   ALA  49           HA       ALA  49   0.290  -3.293   5.440
  413   1HB   ALA  49          HB1       ALA  49   2.422  -4.068   6.666
  414   2HB   ALA  49          HB2       ALA  49   1.376  -5.284   5.933
  415   3HB   ALA  49          HB3       ALA  49   1.316  -5.002   7.673
  416    H    ASN  50           HN       ASN  50  -0.928  -2.718   8.555
  417    HA   ASN  50           HA       ASN  50  -2.869  -4.876   8.470
  418   1HB   ASN  50          HB2       ASN  50  -1.659  -3.507  10.536
  419   2HB   ASN  50          HB1       ASN  50  -3.278  -2.813  10.505
  420   1HD2  ASN  50          HD21      ASN  50  -3.493  -3.813  12.600
  421   2HD2  ASN  50          HD22      ASN  50  -3.933  -5.480  12.708
  422    H    TYR  51           HN       TYR  51  -2.743  -2.360   6.619
  423    HA   TYR  51           HA       TYR  51  -5.573  -1.619   6.960
  424   1HB   TYR  51          HB2       TYR  51  -3.310   0.050   6.843
  425   2HB   TYR  51          HB1       TYR  51  -4.123   0.238   5.293
  426    HD1  TYR  51           HD1      TYR  51  -4.431   0.686   8.926
  427    HD2  TYR  51           HD2      TYR  51  -6.292   1.284   5.147
  428    HE1  TYR  51           HE1      TYR  51  -6.050   2.213   9.972
  429    HE2  TYR  51           HE2      TYR  51  -7.916   2.813   6.182
  430    HH   TYR  51           HH       TYR  51  -8.863   3.296   8.360
  431    H    VAL  52           HN       VAL  52  -3.990  -3.749   5.316
  432    HA   VAL  52           HA       VAL  52  -5.689  -3.537   2.988
  433    HB   VAL  52           HB       VAL  52  -3.726  -2.238   2.281
  434   1HG1  VAL  52          HG11      VAL  52  -1.986  -4.636   2.262
  435   2HG1  VAL  52          HG12      VAL  52  -2.226  -3.819   3.807
  436   3HG1  VAL  52          HG13      VAL  52  -1.568  -2.931   2.433
  437   1HG2  VAL  52          HG21      VAL  52  -3.779  -4.906   0.880
  438   2HG2  VAL  52          HG22      VAL  52  -3.357  -3.338   0.192
  439   3HG2  VAL  52          HG23      VAL  52  -5.018  -3.666   0.685
  440    H    GLU  53           HN       GLU  53  -5.676  -5.501   1.686
  441    HA   GLU  53           HA       GLU  53  -4.769  -7.835   3.240
  442   1HB   GLU  53          HB2       GLU  53  -7.310  -7.217   1.869
  443   2HB   GLU  53          HB1       GLU  53  -6.707  -8.852   1.631
  444   1HG   GLU  53          HG2       GLU  53  -6.410  -8.639   4.289
  445   2HG   GLU  53          HG1       GLU  53  -7.780  -7.556   4.048
  446    H    VAL  54           HN       VAL  54  -3.577  -9.376   2.252
  447    HA   VAL  54           HA       VAL  54  -2.362  -8.756  -0.257
  448    HB   VAL  54           HB       VAL  54  -2.178 -11.365   1.250
  449   1HG1  VAL  54          HG11      VAL  54  -1.317 -11.037  -1.183
  450   2HG1  VAL  54          HG12      VAL  54  -0.287 -11.832   0.008
  451   3HG1  VAL  54          HG13      VAL  54  -0.013 -10.140  -0.406
  452   1HG2  VAL  54          HG21      VAL  54  -1.041  -8.705   1.831
  453   2HG2  VAL  54          HG22      VAL  54   0.074 -10.066   1.937
  454   3HG2  VAL  54          HG23      VAL  54  -1.394 -10.052   2.913
  455    H    LEU  55           HN       LEU  55  -3.079  -9.246  -2.218
  456    HA   LEU  55           HA       LEU  55  -4.172 -11.742  -2.937
  457   1HB   LEU  55          HB2       LEU  55  -6.459 -10.908  -3.572
  458   2HB   LEU  55          HB1       LEU  55  -6.178 -11.120  -1.854
  459    HG   LEU  55           HG       LEU  55  -5.505  -8.449  -2.381
  460   1HD1  LEU  55          HD11      LEU  55  -8.266  -8.635  -3.357
  461   2HD1  LEU  55          HD12      LEU  55  -7.034  -9.180  -4.495
  462   3HD1  LEU  55          HD13      LEU  55  -6.960  -7.548  -3.831
  463   1HD2  LEU  55          HD21      LEU  55  -7.609  -9.946  -0.940
  464   2HD2  LEU  55          HD22      LEU  55  -7.916  -8.236  -1.244
  465   3HD2  LEU  55          HD23      LEU  55  -6.476  -8.728  -0.354
  466    HA   PRO  56           HA       PRO  56  -2.204  -9.030  -6.226
  467   1HB   PRO  56          HB2       PRO  56  -1.413 -11.792  -7.017
  468   2HB   PRO  56          HB1       PRO  56  -0.456 -10.307  -7.008
  469   1HG   PRO  56          HG2       PRO  56  -0.110 -12.152  -5.122
  470   2HG   PRO  56          HG1       PRO  56  -0.050 -10.424  -4.728
  471   1HD   PRO  56          HD2       PRO  56  -2.215 -12.413  -4.218
  472   2HD   PRO  56          HD1       PRO  56  -1.689 -11.037  -3.228
  473    H    LEU  57           HN       LEU  57  -3.938  -8.434  -7.426
  474    HA   LEU  57           HA       LEU  57  -5.674 -10.396  -8.644
  475   1HB   LEU  57          HB2       LEU  57  -5.595  -7.387  -8.862
  476   2HB   LEU  57          HB1       LEU  57  -6.824  -8.403  -9.590
  477    HG   LEU  57           HG       LEU  57  -6.902  -9.185  -6.952
  478   1HD1  LEU  57          HD11      LEU  57  -7.215  -6.817  -5.890
  479   2HD1  LEU  57          HD12      LEU  57  -6.065  -6.330  -7.135
  480   3HD1  LEU  57          HD13      LEU  57  -5.618  -7.563  -5.956
  481   1HD2  LEU  57          HD21      LEU  57  -8.918  -8.913  -8.046
  482   2HD2  LEU  57          HD22      LEU  57  -8.508  -7.297  -8.622
  483   3HD2  LEU  57          HD23      LEU  57  -8.922  -7.550  -6.926
  484    H    GLU  58           HN       GLU  58  -6.298  -9.688 -11.068
  485    HA   GLU  58           HA       GLU  58  -3.965 -10.339 -12.613
  486   1HB   GLU  58          HB2       GLU  58  -6.805  -9.731 -13.453
  487   2HB   GLU  58          HB1       GLU  58  -5.542 -10.299 -14.537
  488   1HG   GLU  58          HG2       GLU  58  -5.587 -12.419 -13.711
  489   2HG   GLU  58          HG1       GLU  58  -6.109 -11.903 -12.108
  Start of MODEL    2
    1   1H    MET   0          HT1       MET   0   6.369  -7.132  -9.005
    2   2H    MET   0          HT2       MET   0   5.477  -7.038  -7.542
    3   3H    MET   0          HT3       MET   0   4.827  -6.384  -8.990
    4    HA   MET   0           HA       MET   0   4.486  -8.441  -9.919
    5   1HB   MET   0          HB2       MET   0   6.768  -9.094  -8.423
    6   2HB   MET   0          HB1       MET   0   5.500 -10.144  -7.805
    7   1HG   MET   0          HG2       MET   0   6.120 -11.479  -9.486
    8   2HG   MET   0          HG1       MET   0   5.109 -10.414 -10.460
    9   1HE   MET   0          HE1       MET   0   7.887 -11.484 -12.674
   10   2HE   MET   0          HE2       MET   0   7.014 -12.311 -11.384
   11   3HE   MET   0          HE3       MET   0   8.738 -11.981 -11.212
   12    H    LYS   1           HN       LYS   1   4.644  -8.417  -6.353
   13    HA   LYS   1           HA       LYS   1   2.019  -9.588  -6.142
   14   1HB   LYS   1          HB2       LYS   1   4.186  -8.818  -4.264
   15   2HB   LYS   1          HB1       LYS   1   2.552  -8.846  -3.617
   16   1HG   LYS   1          HG2       LYS   1   3.504 -10.966  -3.188
   17   2HG   LYS   1          HG1       LYS   1   2.345 -11.184  -4.500
   18   1HD   LYS   1          HD2       LYS   1   4.152 -12.366  -5.298
   19   2HD   LYS   1          HD1       LYS   1   4.437 -10.780  -6.018
   20   1HE   LYS   1          HE2       LYS   1   5.718 -10.476  -3.667
   21   2HE   LYS   1          HE1       LYS   1   5.928 -12.209  -3.911
   22   1HZ   LYS   1          HZ1       LYS   1   7.088 -11.864  -5.883
   23   2HZ   LYS   1          HZ2       LYS   1   7.686 -10.656  -4.862
   24   3HZ   LYS   1          HZ3       LYS   1   6.548 -10.269  -6.052
   25    H    ALA   2           HN       ALA   2   0.202  -8.471  -6.304
   26    HA   ALA   2           HA       ALA   2   0.244  -5.590  -5.722
   27   1HB   ALA   2          HB1       ALA   2  -2.112  -5.902  -6.945
   28   2HB   ALA   2          HB2       ALA   2  -1.251  -7.274  -7.641
   29   3HB   ALA   2          HB3       ALA   2  -0.605  -5.643  -7.823
   30    H    ALA   3           HN       ALA   3  -1.466  -4.645  -4.515
   31    HA   ALA   3           HA       ALA   3  -3.152  -6.487  -2.982
   32   1HB   ALA   3          HB1       ALA   3  -2.514  -4.778  -1.011
   33   2HB   ALA   3          HB2       ALA   3  -0.995  -4.785  -1.907
   34   3HB   ALA   3          HB3       ALA   3  -1.663  -6.297  -1.294
   35    H    ARG   4           HN       ARG   4  -5.132  -5.691  -2.440
   36    HA   ARG   4           HA       ARG   4  -5.798  -3.050  -3.530
   37   1HB   ARG   4          HB2       ARG   4  -7.054  -5.070  -4.327
   38   2HB   ARG   4          HB1       ARG   4  -7.685  -5.259  -2.697
   39   1HG   ARG   4          HG2       ARG   4  -8.449  -2.773  -3.047
   40   2HG   ARG   4          HG1       ARG   4  -8.319  -3.207  -4.753
   41   1HD   ARG   4          HD2       ARG   4  -9.743  -5.106  -2.982
   42   2HD   ARG   4          HD1       ARG   4 -10.547  -3.575  -3.323
   43    HE   ARG   4           HE       ARG   4  -9.800  -4.431  -5.774
   44   1HH1  ARG   4          HH11      ARG   4 -11.554  -5.938  -3.161
   45   2HH1  ARG   4          HH12      ARG   4 -12.500  -6.941  -4.208
   46   1HH2  ARG   4          HH21      ARG   4 -11.044  -5.748  -7.153
   47   2HH2  ARG   4          HH22      ARG   4 -12.211  -6.834  -6.475
   48    H    LEU   5           HN       LEU   5  -6.485  -1.419  -2.266
   49    HA   LEU   5           HA       LEU   5  -6.161  -1.618   0.554
   50   1HB   LEU   5          HB2       LEU   5  -6.096   0.431  -1.241
   51   2HB   LEU   5          HB1       LEU   5  -7.652   0.697  -0.479
   52    HG   LEU   5           HG       LEU   5  -6.430   0.597   1.750
   53   1HD1  LEU   5          HD11      LEU   5  -3.947   1.445   1.230
   54   2HD1  LEU   5          HD12      LEU   5  -4.173   0.356  -0.139
   55   3HD1  LEU   5          HD13      LEU   5  -4.350  -0.250   1.508
   56   1HD2  LEU   5          HD21      LEU   5  -6.929   2.755   1.476
   57   2HD2  LEU   5          HD22      LEU   5  -6.523   2.722  -0.240
   58   3HD2  LEU   5          HD23      LEU   5  -5.253   2.952   0.962
   59    H    LYS   6           HN       LYS   6  -7.803  -0.971   2.132
   60    HA   LYS   6           HA       LYS   6 -10.575  -1.414   1.387
   61   1HB   LYS   6          HB2       LYS   6  -8.978  -3.495   2.500
   62   2HB   LYS   6          HB1       LYS   6 -10.135  -2.992   3.724
   63   1HG   LYS   6          HG2       LYS   6 -11.594  -3.171   1.345
   64   2HG   LYS   6          HG1       LYS   6 -10.537  -4.585   1.368
   65   1HD   LYS   6          HD2       LYS   6 -11.366  -5.229   3.538
   66   2HD   LYS   6          HD1       LYS   6 -12.316  -3.746   3.655
   67   1HE   LYS   6          HE2       LYS   6 -13.807  -4.442   1.978
   68   2HE   LYS   6          HE1       LYS   6 -12.721  -5.716   1.426
   69   1HZ   LYS   6          HZ1       LYS   6 -14.613  -5.718   3.624
   70   2HZ   LYS   6          HZ2       LYS   6 -13.129  -6.461   3.949
   71   3HZ   LYS   6          HZ3       LYS   6 -14.076  -6.997   2.655
   72    H    PHE   7           HN       PHE   7  -9.072   0.852   2.348
   73    HA   PHE   7           HA       PHE   7 -10.759   1.577   4.573
   74   1HB   PHE   7          HB2       PHE   7  -8.820   2.222   6.025
   75   2HB   PHE   7          HB1       PHE   7  -9.005   0.482   5.811
   76    HD1  PHE   7           HD2      PHE   7  -7.171   3.410   4.447
   77    HD2  PHE   7           HD1      PHE   7  -7.207  -0.792   5.100
   78    HE1  PHE   7           HE2      PHE   7  -4.859   3.268   3.626
   79    HE2  PHE   7           HE1      PHE   7  -4.891  -0.943   4.278
   80    HZ   PHE   7           HZ       PHE   7  -3.713   1.090   3.541
   81    H    ASP   8           HN       ASP   8 -10.963   3.787   4.821
   82    HA   ASP   8           HA       ASP   8  -9.745   5.408   2.710
   83   1HB   ASP   8          HB2       ASP   8 -11.944   6.237   4.610
   84   2HB   ASP   8          HB1       ASP   8 -11.496   6.999   3.088
   85    H    PHE   9           HN       PHE   9  -7.677   5.271   3.949
   86    HA   PHE   9           HA       PHE   9  -7.621   7.164   6.204
   87   1HB   PHE   9          HB2       PHE   9  -6.161   4.667   5.619
   88   2HB   PHE   9          HB1       PHE   9  -5.180   5.967   6.287
   89    HD1  PHE   9           HD1      PHE   9  -8.646   4.734   6.929
   90    HD2  PHE   9           HD2      PHE   9  -4.815   5.673   8.524
   91    HE1  PHE   9           HE1      PHE   9  -9.454   4.180   9.186
   92    HE2  PHE   9           HE2      PHE   9  -5.615   5.120  10.784
   93    HZ   PHE   9           HZ       PHE   9  -7.938   4.371  11.117
   94    H    GLN  10           HN       GLN  10  -6.153   8.837   6.248
   95    HA   GLN  10           HA       GLN  10  -4.815   9.411   3.688
   96   1HB   GLN  10          HB2       GLN  10  -5.061  11.786   4.221
   97   2HB   GLN  10          HB1       GLN  10  -6.625  10.982   4.202
   98   1HG   GLN  10          HG2       GLN  10  -7.016  11.431   6.351
   99   2HG   GLN  10          HG1       GLN  10  -5.368  11.035   6.835
  100   1HE2  GLN  10          HE21      GLN  10  -7.146  13.525   5.036
  101   2HE2  GLN  10          HE22      GLN  10  -6.253  14.862   5.668
  102    H    ALA  11           HN       ALA  11  -2.696  10.059   3.685
  103    HA   ALA  11           HA       ALA  11  -1.138   9.355   5.993
  104   1HB   ALA  11          HB1       ALA  11  -0.487  10.275   3.219
  105   2HB   ALA  11          HB2       ALA  11  -0.116   8.739   4.002
  106   3HB   ALA  11          HB3       ALA  11   0.763  10.198   4.460
  107    H    GLN  12           HN       GLN  12  -0.196  10.661   7.458
  108    HA   GLN  12           HA       GLN  12  -0.810  13.511   7.300
  109   1HB   GLN  12          HB2       GLN  12   0.093  13.390   9.731
  110   2HB   GLN  12          HB1       GLN  12  -1.498  12.741   9.377
  111   1HG   GLN  12          HG2       GLN  12  -0.865  10.606   9.773
  112   2HG   GLN  12          HG1       GLN  12   0.778  10.867   9.189
  113   1HE2  GLN  12          HE21      GLN  12  -0.983  12.685  11.642
  114   2HE2  GLN  12          HE22      GLN  12   0.083  12.305  12.948
  115    H    SER  13           HN       SER  13   1.907  11.289   7.602
  116    HA   SER  13           HA       SER  13   3.824  13.460   7.718
  117   1HB   SER  13          HB2       SER  13   4.469  11.614   9.035
  118   2HB   SER  13          HB1       SER  13   4.059  10.458   7.768
  119    HG   SER  13           HG       SER  13   6.365  10.954   8.085
  120    HA   PRO  14           HA       PRO  14   4.457  13.980   3.377
  121   1HB   PRO  14          HB2       PRO  14   7.347  14.136   4.055
  122   2HB   PRO  14          HB1       PRO  14   6.334  15.284   3.175
  123   1HG   PRO  14          HG2       PRO  14   7.093  15.780   5.679
  124   2HG   PRO  14          HG1       PRO  14   5.467  16.210   5.115
  125   1HD   PRO  14          HD2       PRO  14   6.337  13.925   6.833
  126   2HD   PRO  14          HD1       PRO  14   4.864  14.913   6.927
  127    H    LYS  15           HN       LYS  15   6.386  11.682   5.197
  128    HA   LYS  15           HA       LYS  15   7.435  10.326   2.908
  129   1HB   LYS  15          HB2       LYS  15   8.432  10.347   5.248
  130   2HB   LYS  15          HB1       LYS  15   7.178   9.197   5.692
  131   1HG   LYS  15          HG2       LYS  15   9.019   7.865   5.217
  132   2HG   LYS  15          HG1       LYS  15   8.051   7.784   3.742
  133   1HD   LYS  15          HD2       LYS  15   9.474   9.621   2.811
  134   2HD   LYS  15          HD1       LYS  15  10.507   9.463   4.233
  135   1HE   LYS  15          HE2       LYS  15   9.923   6.959   2.799
  136   2HE   LYS  15          HE1       LYS  15  10.897   8.131   1.912
  137   1HZ   LYS  15          HZ1       LYS  15  12.633   7.870   3.301
  138   2HZ   LYS  15          HZ2       LYS  15  11.921   6.367   3.606
  139   3HZ   LYS  15          HZ3       LYS  15  11.668   7.654   4.674
  140    H    GLU  16           HN       GLU  16   4.550  10.078   4.836
  141    HA   GLU  16           HA       GLU  16   3.811   7.491   3.784
  142   1HB   GLU  16          HB2       GLU  16   2.605   9.452   5.688
  143   2HB   GLU  16          HB1       GLU  16   1.568   8.236   4.955
  144   1HG   GLU  16          HG2       GLU  16   2.446   7.584   7.165
  145   2HG   GLU  16          HG1       GLU  16   2.886   6.464   5.877
  146    H    LEU  17           HN       LEU  17   1.684   7.193   2.704
  147    HA   LEU  17           HA       LEU  17   1.082   9.439   0.892
  148   1HB   LEU  17          HB2       LEU  17   2.342   7.612  -0.216
  149   2HB   LEU  17          HB1       LEU  17   1.042   6.506   0.185
  150    HG   LEU  17           HG       LEU  17   0.250   8.928  -1.314
  151   1HD1  LEU  17          HD11      LEU  17   2.528   7.794  -2.202
  152   2HD1  LEU  17          HD12      LEU  17   1.324   8.540  -3.252
  153   3HD1  LEU  17          HD13      LEU  17   1.332   6.792  -3.023
  154   1HD2  LEU  17          HD21      LEU  17  -0.386   5.993  -1.591
  155   2HD2  LEU  17          HD22      LEU  17  -1.170   7.309  -2.466
  156   3HD2  LEU  17          HD23      LEU  17  -1.348   7.185  -0.716
  157    H    THR  18           HN       THR  18  -1.018   9.939   0.563
  158    HA   THR  18           HA       THR  18  -2.964   8.665   2.291
  159    HB   THR  18           HB       THR  18  -3.153  11.044   0.431
  160    HG1  THR  18           HG1      THR  18  -3.113  12.210   2.343
  161   1HG2  THR  18          HG21      THR  18  -5.181  11.260   2.292
  162   2HG2  THR  18          HG22      THR  18  -5.266   9.583   1.753
  163   3HG2  THR  18          HG23      THR  18  -5.357  10.894   0.576
  164    H    LEU  19           HN       LEU  19  -4.258   7.077   1.670
  165    HA   LEU  19           HA       LEU  19  -5.113   6.911  -1.119
  166   1HB   LEU  19          HB2       LEU  19  -3.107   5.455  -0.757
  167   2HB   LEU  19          HB1       LEU  19  -4.041   4.547   0.418
  168    HG   LEU  19           HG       LEU  19  -5.694   4.074  -1.432
  169   1HD1  LEU  19          HD11      LEU  19  -5.401   5.413  -3.219
  170   2HD1  LEU  19          HD12      LEU  19  -4.232   4.182  -3.698
  171   3HD1  LEU  19          HD13      LEU  19  -3.685   5.652  -2.892
  172   1HD2  LEU  19          HD21      LEU  19  -4.658   2.108  -1.759
  173   2HD2  LEU  19          HD22      LEU  19  -3.461   2.741  -0.628
  174   3HD2  LEU  19          HD23      LEU  19  -3.188   2.870  -2.366
  175    H    GLN  20           HN       GLN  20  -7.150   6.060  -1.408
  176    HA   GLN  20           HA       GLN  20  -8.614   5.392   1.060
  177   1HB   GLN  20          HB2       GLN  20  -9.116   7.503  -0.588
  178   2HB   GLN  20          HB1       GLN  20 -10.193   6.286  -1.261
  179   1HG   GLN  20          HG2       GLN  20 -10.924   5.937   1.202
  180   2HG   GLN  20          HG1       GLN  20 -10.204   7.527   1.454
  181   1HE2  GLN  20          HE21      GLN  20 -11.897   8.827   1.710
  182   2HE2  GLN  20          HE22      GLN  20 -13.207   8.994   0.596
  183    H    LYS  21           HN       LYS  21 -10.561   4.022   0.698
  184    HA   LYS  21           HA       LYS  21  -9.922   1.541  -0.294
  185   1HB   LYS  21          HB2       LYS  21 -12.289   2.857   0.718
  186   2HB   LYS  21          HB1       LYS  21 -12.707   1.722  -0.555
  187   1HG   LYS  21          HG2       LYS  21 -10.825   0.488   1.185
  188   2HG   LYS  21          HG1       LYS  21 -12.127   1.185   2.150
  189   1HD   LYS  21          HD2       LYS  21 -13.538   0.037   0.141
  190   2HD   LYS  21          HD1       LYS  21 -12.167  -1.069   0.257
  191   1HE   LYS  21          HE2       LYS  21 -13.320  -2.050   1.903
  192   2HE   LYS  21          HE1       LYS  21 -12.828  -0.671   2.886
  193   1HZ   LYS  21          HZ1       LYS  21 -15.426  -1.307   1.751
  194   2HZ   LYS  21          HZ2       LYS  21 -14.985   0.325   1.705
  195   3HZ   LYS  21          HZ3       LYS  21 -15.039  -0.494   3.184
  196    H    GLY  22           HN       GLY  22 -10.438   0.362  -2.151
  197   1HA   GLY  22          HA2       GLY  22 -11.226   0.042  -4.332
  198   2HA   GLY  22          HA1       GLY  22 -11.653   1.749  -4.403
  199    H    ASP  23           HN       ASP  23  -8.618   1.843  -3.249
  200    HA   ASP  23           HA       ASP  23  -7.529   2.229  -5.938
  201   1HB   ASP  23          HB2       ASP  23  -7.408   3.827  -3.726
  202   2HB   ASP  23          HB1       ASP  23  -5.860   2.992  -3.638
  203    H    ILE  24           HN       ILE  24  -5.997   0.977  -6.784
  204    HA   ILE  24           HA       ILE  24  -4.744  -1.047  -5.045
  205    HB   ILE  24           HB       ILE  24  -6.260  -2.030  -6.710
  206   1HG1  ILE  24          HG12      ILE  24  -3.676  -2.838  -7.862
  207   2HG1  ILE  24          HG11      ILE  24  -3.714  -2.836  -6.102
  208   1HG2  ILE  24          HG21      ILE  24  -5.665  -1.915  -9.110
  209   2HG2  ILE  24          HG22      ILE  24  -4.452  -0.697  -8.718
  210   3HG2  ILE  24          HG23      ILE  24  -6.160  -0.361  -8.439
  211   1HD1  ILE  24          HD11      ILE  24  -4.650  -4.817  -7.838
  212   2HD1  ILE  24          HD12      ILE  24  -6.082  -4.079  -7.120
  213   3HD1  ILE  24          HD13      ILE  24  -4.820  -4.747  -6.084
  214    H    VAL  25           HN       VAL  25  -2.547  -1.305  -5.117
  215    HA   VAL  25           HA       VAL  25  -1.039   0.277  -7.078
  216    HB   VAL  25           HB       VAL  25   0.546   0.984  -5.318
  217   1HG1  VAL  25          HG11      VAL  25  -0.964   2.653  -5.929
  218   2HG1  VAL  25          HG12      VAL  25  -1.090   2.598  -4.170
  219   3HG1  VAL  25          HG13      VAL  25  -2.326   1.830  -5.168
  220   1HG2  VAL  25          HG21      VAL  25  -1.381   0.463  -3.151
  221   2HG2  VAL  25          HG22      VAL  25   0.382   0.413  -3.141
  222   3HG2  VAL  25          HG23      VAL  25  -0.536  -0.951  -3.781
  223    H    TYR  26           HN       TYR  26   1.027  -0.495  -7.575
  224    HA   TYR  26           HA       TYR  26   1.355  -3.328  -7.259
  225   1HB   TYR  26          HB2       TYR  26   2.764  -1.160  -8.744
  226   2HB   TYR  26          HB1       TYR  26   3.640  -2.656  -8.439
  227    HD1  TYR  26           HD1      TYR  26   1.620  -4.713  -8.746
  228    HD2  TYR  26           HD2      TYR  26   2.185  -1.140 -10.986
  229    HE1  TYR  26           HE1      TYR  26   0.515  -5.757 -10.679
  230    HE2  TYR  26           HE2      TYR  26   1.081  -2.174 -12.925
  231    HH   TYR  26           HH       TYR  26   0.768  -4.813 -13.675
  232    H    ILE  27           HN       ILE  27   2.079  -4.141  -5.408
  233    HA   ILE  27           HA       ILE  27   3.781  -2.620  -3.648
  234    HB   ILE  27           HB       ILE  27   3.075  -5.521  -3.300
  235   1HG1  ILE  27          HG12      ILE  27   0.950  -4.547  -3.690
  236   2HG1  ILE  27          HG11      ILE  27   1.112  -4.618  -1.939
  237   1HG2  ILE  27          HG21      ILE  27   3.338  -3.439  -1.167
  238   2HG2  ILE  27          HG22      ILE  27   4.760  -4.234  -1.841
  239   3HG2  ILE  27          HG23      ILE  27   3.511  -5.189  -1.043
  240   1HD1  ILE  27          HD11      ILE  27   1.838  -2.223  -2.006
  241   2HD1  ILE  27          HD12      ILE  27   0.167  -2.517  -2.487
  242   3HD1  ILE  27          HD13      ILE  27   1.397  -2.211  -3.714
  243    H    HIS  28           HN       HIS  28   5.918  -2.790  -3.374
  244    HA   HIS  28           HA       HIS  28   7.382  -4.592  -5.150
  245   1HB   HIS  28          HB2       HIS  28   7.806  -1.997  -4.704
  246   2HB   HIS  28          HB1       HIS  28   8.788  -2.638  -3.391
  247    HD1  HIS  28           HD1      HIS  28  10.790  -4.239  -4.120
  248    HD2  HIS  28           HD2      HIS  28   8.949  -2.134  -7.194
  249    HE1  HIS  28           HE1      HIS  28  12.376  -4.368  -6.067
  250    HE2  HIS  28           HE2      HIS  28  11.280  -3.015  -7.888
  251    H    LYS  29           HN       LYS  29   7.002  -3.805  -1.740
  252    HA   LYS  29           HA       LYS  29   8.005  -6.444  -1.033
  253   1HB   LYS  29          HB2       LYS  29   9.524  -5.599   0.670
  254   2HB   LYS  29          HB1       LYS  29   9.987  -4.990  -0.911
  255   1HG   LYS  29          HG2       LYS  29  10.034  -2.968  -0.001
  256   2HG   LYS  29          HG1       LYS  29   8.274  -3.054   0.083
  257   1HD   LYS  29          HD2       LYS  29   8.515  -4.153   2.317
  258   2HD   LYS  29          HD1       LYS  29  10.247  -3.824   2.228
  259   1HE   LYS  29          HE2       LYS  29   9.243  -1.374   1.684
  260   2HE   LYS  29          HE1       LYS  29   7.990  -2.003   2.755
  261   1HZ   LYS  29          HZ1       LYS  29  10.171  -2.680   4.108
  262   2HZ   LYS  29          HZ2       LYS  29   9.380  -1.200   4.319
  263   3HZ   LYS  29          HZ3       LYS  29  10.750  -1.292   3.334
  264    H    GLU  30           HN       GLU  30   7.173  -7.233   0.892
  265    HA   GLU  30           HA       GLU  30   5.086  -5.553   2.118
  266   1HB   GLU  30          HB2       GLU  30   5.084  -8.560   2.117
  267   2HB   GLU  30          HB1       GLU  30   3.755  -7.469   2.483
  268   1HG   GLU  30          HG2       GLU  30   3.681  -6.764   0.151
  269   2HG   GLU  30          HG1       GLU  30   5.022  -7.846  -0.222
  270    H    VAL  31           HN       VAL  31   5.713  -4.817   3.999
  271    HA   VAL  31           HA       VAL  31   7.437  -6.472   5.697
  272    HB   VAL  31           HB       VAL  31   6.685  -3.721   6.490
  273   1HG1  VAL  31          HG11      VAL  31   8.945  -5.601   6.881
  274   2HG1  VAL  31          HG12      VAL  31   8.087  -4.603   8.054
  275   3HG1  VAL  31          HG13      VAL  31   9.278  -3.872   6.977
  276   1HG2  VAL  31          HG21      VAL  31   8.274  -2.649   5.077
  277   2HG2  VAL  31          HG22      VAL  31   7.248  -3.627   4.031
  278   3HG2  VAL  31          HG23      VAL  31   8.861  -4.193   4.461
  279    H    ASP  32           HN       ASP  32   5.979  -7.860   6.526
  280    HA   ASP  32           HA       ASP  32   3.447  -7.232   7.562
  281   1HB   ASP  32          HB2       ASP  32   5.215  -9.529   8.421
  282   2HB   ASP  32          HB1       ASP  32   3.461  -9.439   8.542
  283    H    LYS  33           HN       LYS  33   6.630  -6.961   8.911
  284    HA   LYS  33           HA       LYS  33   5.817  -6.830  11.647
  285   1HB   LYS  33          HB2       LYS  33   8.110  -7.455  10.921
  286   2HB   LYS  33          HB1       LYS  33   8.358  -5.803  10.371
  287   1HG   LYS  33          HG2       LYS  33   7.713  -5.206  12.836
  288   2HG   LYS  33          HG1       LYS  33   8.198  -6.875  13.143
  289   1HD   LYS  33          HD2       LYS  33  10.287  -6.124  11.678
  290   2HD   LYS  33          HD1       LYS  33   9.829  -4.540  12.306
  291   1HE   LYS  33          HE2       LYS  33  10.456  -5.049  14.414
  292   2HE   LYS  33          HE1       LYS  33   9.903  -6.719  14.285
  293   1HZ   LYS  33          HZ1       LYS  33  11.896  -7.416  13.483
  294   2HZ   LYS  33          HZ2       LYS  33  12.443  -6.116  14.416
  295   3HZ   LYS  33          HZ3       LYS  33  12.263  -5.939  12.744
  296    H    ASN  34           HN       ASN  34   5.900  -4.580   9.029
  297    HA   ASN  34           HA       ASN  34   4.688  -2.555  10.671
  298   1HB   ASN  34          HB2       ASN  34   6.346  -0.815  10.221
  299   2HB   ASN  34          HB1       ASN  34   7.068  -2.151  11.107
  300   1HD2  ASN  34          HD21      ASN  34   8.739  -3.233  10.246
  301   2HD2  ASN  34          HD22      ASN  34   9.432  -2.893   8.701
  302    H    TRP  35           HN       TRP  35   5.711  -0.590   8.518
  303    HA   TRP  35           HA       TRP  35   3.453  -0.877   6.796
  304   1HB   TRP  35          HB2       TRP  35   5.771   1.053   6.683
  305   2HB   TRP  35          HB1       TRP  35   4.263   1.202   5.796
  306    HD1  TRP  35           HD1      TRP  35   2.147   2.114   7.103
  307    HE1  TRP  35           HE1      TRP  35   1.863   3.239   9.400
  308    HE3  TRP  35           HE3      TRP  35   6.726   1.038   9.105
  309    HZ2  TRP  35           HZ2      TRP  35   3.380   3.621  11.749
  310    HZ3  TRP  35           HZ3      TRP  35   7.231   1.821  11.383
  311    HH2  TRP  35           HH2      TRP  35   5.591   3.086  12.676
  312    H    LEU  36           HN       LEU  36   3.467  -1.131   4.534
  313    HA   LEU  36           HA       LEU  36   5.785  -2.621   3.515
  314   1HB   LEU  36          HB2       LEU  36   4.313  -3.624   1.929
  315   2HB   LEU  36          HB1       LEU  36   3.550  -3.723   3.506
  316    HG   LEU  36           HG       LEU  36   2.841  -1.383   1.842
  317   1HD1  LEU  36          HD11      LEU  36   2.782  -3.927   0.680
  318   2HD1  LEU  36          HD12      LEU  36   1.980  -2.466   0.106
  319   3HD1  LEU  36          HD13      LEU  36   1.121  -3.585   1.164
  320   1HD2  LEU  36          HD21      LEU  36   1.021  -1.338   3.157
  321   2HD2  LEU  36          HD22      LEU  36   1.964  -2.402   4.199
  322   3HD2  LEU  36          HD23      LEU  36   0.791  -3.084   3.073
  323    H    GLU  37           HN       GLU  37   5.817  -2.390   0.928
  324    HA   GLU  37           HA       GLU  37   6.072   0.497   0.433
  325   1HB   GLU  37          HB2       GLU  37   8.117  -0.926   0.238
  326   2HB   GLU  37          HB1       GLU  37   7.350  -1.771  -1.097
  327   1HG   GLU  37          HG2       GLU  37   7.377   0.158  -2.458
  328   2HG   GLU  37          HG1       GLU  37   7.803   1.196  -1.098
  329    H    GLY  38           HN       GLY  38   5.197   1.464  -1.361
  330   1HA   GLY  38          HA2       GLY  38   3.835  -0.105  -3.379
  331   2HA   GLY  38          HA1       GLY  38   2.766   0.808  -2.325
  332    H    GLU  39           HN       GLU  39   4.422   0.889  -5.193
  333    HA   GLU  39           HA       GLU  39   4.430   3.832  -5.230
  334   1HB   GLU  39          HB2       GLU  39   6.618   2.342  -5.535
  335   2HB   GLU  39          HB1       GLU  39   6.043   2.284  -7.197
  336   1HG   GLU  39          HG2       GLU  39   5.867   4.865  -6.922
  337   2HG   GLU  39          HG1       GLU  39   7.000   4.603  -5.599
  338    H    HIS  40           HN       HIS  40   3.526   4.879  -6.990
  339    HA   HIS  40           HA       HIS  40   2.450   3.323  -9.193
  340   1HB   HIS  40          HB2       HIS  40   0.730   3.294  -7.332
  341   2HB   HIS  40          HB1       HIS  40   0.582   5.035  -7.551
  342    HD1  HIS  40           HD1      HIS  40  -1.957   4.457  -8.167
  343    HD2  HIS  40           HD2      HIS  40   0.915   3.140 -10.866
  344    HE1  HIS  40           HE1      HIS  40  -3.213   3.927 -10.280
  345    HE2  HIS  40           HE2      HIS  40  -1.442   3.221 -11.927
  346    H    HIS  41           HN       HIS  41   2.415   4.443 -11.049
  347    HA   HIS  41           HA       HIS  41   2.861   6.110 -12.532
  348   1HB   HIS  41          HB2       HIS  41   0.992   7.266 -10.546
  349   2HB   HIS  41          HB1       HIS  41   1.806   8.415 -11.603
  350    HD1  HIS  41           HD1      HIS  41   0.051   9.035 -13.250
  351    HD2  HIS  41           HD2      HIS  41   0.265   4.927 -12.662
  352    HE1  HIS  41           HE1      HIS  41  -1.527   8.032 -14.932
  353    HE2  HIS  41           HE2      HIS  41  -1.429   5.549 -14.515
  354    H    GLY  42           HN       GLY  42   4.956   5.595 -10.690
  355   1HA   GLY  42          HA2       GLY  42   7.064   6.531 -10.419
  356   2HA   GLY  42          HA1       GLY  42   6.429   8.060 -11.002
  357    H    ARG  43           HN       ARG  43   4.248   7.436  -8.761
  358    HA   ARG  43           HA       ARG  43   5.711   8.928  -6.721
  359   1HB   ARG  43          HB2       ARG  43   3.122   9.130  -7.727
  360   2HB   ARG  43          HB1       ARG  43   2.908   8.403  -6.141
  361   1HG   ARG  43          HG2       ARG  43   4.616  10.834  -6.485
  362   2HG   ARG  43          HG1       ARG  43   2.861  10.968  -6.361
  363   1HD   ARG  43          HD2       ARG  43   3.118  10.949  -4.150
  364   2HD   ARG  43          HD1       ARG  43   3.569   9.251  -4.296
  365    HE   ARG  43           HE       ARG  43   5.753   9.824  -3.892
  366   1HH1  ARG  43          HH11      ARG  43   3.922  12.716  -4.575
  367   2HH1  ARG  43          HH12      ARG  43   5.204  13.786  -4.117
  368   1HH2  ARG  43          HH21      ARG  43   7.440  11.230  -3.289
  369   2HH2  ARG  43          HH22      ARG  43   7.201  12.943  -3.387
  370    H    LEU  44           HN       LEU  44   6.380   8.029  -4.873
  371    HA   LEU  44           HA       LEU  44   5.631   5.249  -4.370
  372   1HB   LEU  44          HB2       LEU  44   7.614   4.987  -3.191
  373   2HB   LEU  44          HB1       LEU  44   8.057   6.061  -4.503
  374    HG   LEU  44           HG       LEU  44   7.407   7.033  -1.722
  375   1HD1  LEU  44          HD11      LEU  44  10.040   7.380  -1.875
  376   2HD1  LEU  44          HD12      LEU  44   9.902   5.931  -2.871
  377   3HD1  LEU  44          HD13      LEU  44   9.313   5.918  -1.209
  378   1HD2  LEU  44          HD21      LEU  44   7.255   8.924  -2.961
  379   2HD2  LEU  44          HD22      LEU  44   8.258   8.284  -4.263
  380   3HD2  LEU  44          HD23      LEU  44   9.009   8.886  -2.786
  381    H    GLY  45           HN       GLY  45   4.365   4.652  -2.770
  382   1HA   GLY  45          HA2       GLY  45   3.922   6.507  -0.528
  383   2HA   GLY  45          HA1       GLY  45   2.552   5.809  -1.381
  384    H    ILE  46           HN       ILE  46   3.750   5.578   1.441
  385    HA   ILE  46           HA       ILE  46   3.857   2.635   1.509
  386    HB   ILE  46           HB       ILE  46   5.093   4.632   3.405
  387   1HG1  ILE  46          HG12      ILE  46   6.320   2.672   1.453
  388   2HG1  ILE  46          HG11      ILE  46   6.273   4.423   1.270
  389   1HG2  ILE  46          HG21      ILE  46   4.983   3.020   4.938
  390   2HG2  ILE  46          HG22      ILE  46   6.157   2.139   3.960
  391   3HG2  ILE  46          HG23      ILE  46   4.435   1.831   3.760
  392   1HD1  ILE  46          HD11      ILE  46   8.425   3.958   2.021
  393   2HD1  ILE  46          HD12      ILE  46   7.856   2.783   3.207
  394   3HD1  ILE  46          HD13      ILE  46   7.569   4.505   3.463
  395    H    PHE  47           HN       PHE  47   2.721   1.531   3.090
  396    HA   PHE  47           HA       PHE  47   1.038   2.957   4.962
  397   1HB   PHE  47          HB2       PHE  47  -0.999   1.617   4.073
  398   2HB   PHE  47          HB1       PHE  47  -0.528   3.091   3.234
  399    HD1  PHE  47           HD1      PHE  47   1.020   2.812   1.190
  400    HD2  PHE  47           HD2      PHE  47  -1.245  -0.359   2.899
  401    HE1  PHE  47           HE1      PHE  47   1.192   1.558  -0.920
  402    HE2  PHE  47           HE2      PHE  47  -1.076  -1.620   0.793
  403    HZ   PHE  47           HZ       PHE  47   0.144  -0.662  -1.120
  404    HA   PRO  48           HA       PRO  48   1.609  -0.648   7.409
  405   1HB   PRO  48          HB2       PRO  48  -1.232  -0.669   8.183
  406   2HB   PRO  48          HB1       PRO  48   0.203  -0.420   9.181
  407   1HG   PRO  48          HG2       PRO  48  -1.479   1.591   8.592
  408   2HG   PRO  48          HG1       PRO  48   0.267   1.846   8.761
  409   1HD   PRO  48          HD2       PRO  48  -1.386   1.626   6.275
  410   2HD   PRO  48          HD1       PRO  48  -0.022   2.707   6.631
  411    H    ALA  49           HN       ALA  49   1.691  -2.759   6.982
  412    HA   ALA  49           HA       ALA  49   0.256  -3.894   4.819
  413   1HB   ALA  49          HB1       ALA  49   1.500  -5.733   6.758
  414   2HB   ALA  49          HB2       ALA  49   2.565  -4.519   6.051
  415   3HB   ALA  49          HB3       ALA  49   1.682  -5.633   5.007
  416    H    ASN  50           HN       ASN  50  -0.097  -4.069   8.319
  417    HA   ASN  50           HA       ASN  50  -2.011  -6.116   8.435
  418   1HB   ASN  50          HB2       ASN  50  -1.141  -3.918  10.250
  419   2HB   ASN  50          HB1       ASN  50  -2.657  -4.735  10.616
  420   1HD2  ASN  50          HD21      ASN  50  -1.460  -5.332  12.568
  421   2HD2  ASN  50          HD22      ASN  50  -0.467  -6.746  12.527
  422    H    TYR  51           HN       TYR  51  -2.290  -2.716   7.716
  423    HA   TYR  51           HA       TYR  51  -5.149  -2.642   8.019
  424   1HB   TYR  51          HB2       TYR  51  -3.015  -0.729   7.284
  425   2HB   TYR  51          HB1       TYR  51  -4.606  -0.407   6.605
  426    HD1  TYR  51           HD1      TYR  51  -2.769  -0.899   9.785
  427    HD2  TYR  51           HD2      TYR  51  -6.328   0.516   7.932
  428    HE1  TYR  51           HE1      TYR  51  -3.457   0.135  11.908
  429    HE2  TYR  51           HE2      TYR  51  -7.025   1.555  10.049
  430    HH   TYR  51           HH       TYR  51  -5.927   2.399  12.135
  431    H    VAL  52           HN       VAL  52  -3.002  -3.627   5.544
  432    HA   VAL  52           HA       VAL  52  -5.203  -3.520   3.582
  433    HB   VAL  52           HB       VAL  52  -3.323  -2.098   2.911
  434   1HG1  VAL  52          HG11      VAL  52  -1.281  -3.720   2.137
  435   2HG1  VAL  52          HG12      VAL  52  -1.779  -4.477   3.650
  436   3HG1  VAL  52          HG13      VAL  52  -1.310  -2.777   3.627
  437   1HG2  VAL  52          HG21      VAL  52  -3.134  -2.857   0.680
  438   2HG2  VAL  52          HG22      VAL  52  -4.704  -3.420   1.253
  439   3HG2  VAL  52          HG23      VAL  52  -3.347  -4.542   1.157
  440    H    GLU  53           HN       GLU  53  -5.255  -5.278   2.009
  441    HA   GLU  53           HA       GLU  53  -4.334  -7.801   3.212
  442   1HB   GLU  53          HB2       GLU  53  -6.150  -8.852   1.851
  443   2HB   GLU  53          HB1       GLU  53  -6.727  -7.727   3.072
  444   1HG   GLU  53          HG2       GLU  53  -6.247  -6.508   0.459
  445   2HG   GLU  53          HG1       GLU  53  -7.496  -7.754   0.463
  446    H    VAL  54           HN       VAL  54  -3.249  -9.311   1.994
  447    HA   VAL  54           HA       VAL  54  -2.054  -8.295  -0.467
  448    HB   VAL  54           HB       VAL  54  -1.342 -10.817   1.029
  449   1HG1  VAL  54          HG11      VAL  54  -0.021  -9.243  -1.162
  450   2HG1  VAL  54          HG12      VAL  54  -0.472 -10.948  -1.151
  451   3HG1  VAL  54          HG13      VAL  54   0.870 -10.384  -0.155
  452   1HG2  VAL  54          HG21      VAL  54   0.609  -9.377   1.836
  453   2HG2  VAL  54          HG22      VAL  54  -0.960  -9.117   2.598
  454   3HG2  VAL  54          HG23      VAL  54  -0.379  -7.993   1.369
  455    H    LEU  55           HN       LEU  55  -2.996  -8.785  -2.327
  456    HA   LEU  55           HA       LEU  55  -3.684 -11.520  -2.937
  457   1HB   LEU  55          HB2       LEU  55  -5.992 -10.953  -3.670
  458   2HB   LEU  55          HB1       LEU  55  -5.756 -10.887  -1.934
  459    HG   LEU  55           HG       LEU  55  -5.488  -8.359  -3.491
  460   1HD1  LEU  55          HD11      LEU  55  -7.537  -9.404  -4.356
  461   2HD1  LEU  55          HD12      LEU  55  -7.875  -7.964  -3.396
  462   3HD1  LEU  55          HD13      LEU  55  -8.136  -9.565  -2.705
  463   1HD2  LEU  55          HD21      LEU  55  -6.437  -7.421  -1.435
  464   2HD2  LEU  55          HD22      LEU  55  -4.990  -8.375  -1.111
  465   3HD2  LEU  55          HD23      LEU  55  -6.585  -9.046  -0.767
  466    HA   PRO  56           HA       PRO  56  -1.728  -8.995  -6.366
  467   1HB   PRO  56          HB2       PRO  56  -0.892 -11.800  -6.944
  468   2HB   PRO  56          HB1       PRO  56   0.045 -10.305  -7.041
  469   1HG   PRO  56          HG2       PRO  56   0.394 -11.987  -5.011
  470   2HG   PRO  56          HG1       PRO  56   0.415 -10.233  -4.750
  471   1HD   PRO  56          HD2       PRO  56  -1.718 -12.220  -4.115
  472   2HD   PRO  56          HD1       PRO  56  -1.239 -10.755  -3.234
  473    H    LEU  57           HN       LEU  57  -2.900  -8.567  -8.120
  474    HA   LEU  57           HA       LEU  57  -4.690 -10.659  -9.162
  475   1HB   LEU  57          HB2       LEU  57  -4.890  -7.652  -9.315
  476   2HB   LEU  57          HB1       LEU  57  -5.962  -8.750 -10.163
  477    HG   LEU  57           HG       LEU  57  -6.061  -9.586  -7.497
  478   1HD1  LEU  57          HD11      LEU  57  -5.225  -7.748  -6.437
  479   2HD1  LEU  57          HD12      LEU  57  -6.912  -7.258  -6.592
  480   3HD1  LEU  57          HD13      LEU  57  -5.708  -6.645  -7.725
  481   1HD2  LEU  57          HD21      LEU  57  -8.137  -7.718  -8.456
  482   2HD2  LEU  57          HD22      LEU  57  -8.288  -9.347  -7.798
  483   3HD2  LEU  57          HD23      LEU  57  -7.806  -9.116  -9.478
  484    H    GLU  58           HN       GLU  58  -2.210  -8.340  -9.983
  485    HA   GLU  58           HA       GLU  58  -2.046  -9.550 -12.658
  486   1HB   GLU  58          HB2       GLU  58  -2.466  -6.748 -11.958
  487   2HB   GLU  58          HB1       GLU  58  -1.071  -6.979 -13.002
  488   1HG   GLU  58          HG2       GLU  58  -2.813  -8.495 -14.321
  489   2HG   GLU  58          HG1       GLU  58  -3.947  -7.385 -13.553
  Start of MODEL    3
    1   1H    MET   0          HT1       MET   0   6.433  -8.077 -10.352
    2   2H    MET   0          HT2       MET   0   5.055  -9.095 -10.468
    3   3H    MET   0          HT3       MET   0   5.806  -8.831  -8.947
    4    HA   MET   0           HA       MET   0   5.296  -6.421  -9.300
    5   1HB   MET   0          HB2       MET   0   4.154  -7.683 -11.664
    6   2HB   MET   0          HB1       MET   0   2.964  -6.725 -10.793
    7   1HG   MET   0          HG2       MET   0   3.765  -5.026 -11.991
    8   2HG   MET   0          HG1       MET   0   5.085  -5.034 -10.823
    9   1HE   MET   0          HE1       MET   0   6.337  -4.247 -14.478
   10   2HE   MET   0          HE2       MET   0   4.971  -3.768 -13.469
   11   3HE   MET   0          HE3       MET   0   4.732  -4.904 -14.797
   12    H    LYS   1           HN       LYS   1   4.921  -7.096  -7.122
   13    HA   LYS   1           HA       LYS   1   2.590  -8.592  -6.412
   14   1HB   LYS   1          HB2       LYS   1   4.801  -7.243  -4.989
   15   2HB   LYS   1          HB1       LYS   1   3.287  -7.352  -4.102
   16   1HG   LYS   1          HG2       LYS   1   4.729  -9.229  -3.583
   17   2HG   LYS   1          HG1       LYS   1   3.273  -9.775  -4.418
   18   1HD   LYS   1          HD2       LYS   1   4.858  -9.439  -6.537
   19   2HD   LYS   1          HD1       LYS   1   6.098  -9.759  -5.323
   20   1HE   LYS   1          HE2       LYS   1   4.777 -11.805  -4.679
   21   2HE   LYS   1          HE1       LYS   1   3.783 -11.518  -6.107
   22   1HZ   LYS   1          HZ1       LYS   1   5.588 -13.122  -6.490
   23   2HZ   LYS   1          HZ2       LYS   1   6.725 -11.915  -6.157
   24   3HZ   LYS   1          HZ3       LYS   1   5.706 -11.768  -7.499
   25    H    ALA   2           HN       ALA   2   0.672  -7.724  -6.936
   26    HA   ALA   2           HA       ALA   2   0.187  -4.887  -6.376
   27   1HB   ALA   2          HB1       ALA   2  -1.581  -4.960  -7.907
   28   2HB   ALA   2          HB2       ALA   2  -1.697  -6.718  -7.826
   29   3HB   ALA   2          HB3       ALA   2  -0.327  -5.962  -8.640
   30    H    ALA   3           HN       ALA   3  -1.683  -4.221  -5.229
   31    HA   ALA   3           HA       ALA   3  -3.226  -6.213  -3.793
   32   1HB   ALA   3          HB1       ALA   3  -1.429  -6.099  -2.273
   33   2HB   ALA   3          HB2       ALA   3  -2.697  -5.084  -1.586
   34   3HB   ALA   3          HB3       ALA   3  -1.323  -4.344  -2.407
   35    H    ARG   4           HN       ARG   4  -5.191  -5.454  -3.065
   36    HA   ARG   4           HA       ARG   4  -5.891  -2.755  -3.979
   37   1HB   ARG   4          HB2       ARG   4  -7.122  -4.906  -4.744
   38   2HB   ARG   4          HB1       ARG   4  -7.876  -4.855  -3.156
   39   1HG   ARG   4          HG2       ARG   4  -8.776  -2.649  -3.634
   40   2HG   ARG   4          HG1       ARG   4  -7.982  -2.654  -5.210
   41   1HD   ARG   4          HD2       ARG   4 -10.379  -3.243  -5.334
   42   2HD   ARG   4          HD1       ARG   4  -9.323  -4.522  -5.930
   43    HE   ARG   4           HE       ARG   4 -10.091  -5.876  -4.260
   44   1HH1  ARG   4          HH11      ARG   4 -10.853  -2.569  -3.448
   45   2HH1  ARG   4          HH12      ARG   4 -11.803  -2.995  -2.065
   46   1HH2  ARG   4          HH21      ARG   4 -11.341  -6.439  -2.441
   47   2HH2  ARG   4          HH22      ARG   4 -12.081  -5.193  -1.493
   48    H    LEU   5           HN       LEU   5  -6.360  -1.192  -2.575
   49    HA   LEU   5           HA       LEU   5  -6.081  -1.600   0.220
   50   1HB   LEU   5          HB2       LEU   5  -5.745   0.537  -1.300
   51   2HB   LEU   5          HB1       LEU   5  -7.417   0.835  -0.865
   52    HG   LEU   5           HG       LEU   5  -6.398   0.368   1.585
   53   1HD1  LEU   5          HD11      LEU   5  -4.110   0.374   0.100
   54   2HD1  LEU   5          HD12      LEU   5  -4.207   0.746   1.821
   55   3HD1  LEU   5          HD13      LEU   5  -4.205   2.052   0.636
   56   1HD2  LEU   5          HD21      LEU   5  -6.759   2.830  -0.044
   57   2HD2  LEU   5          HD22      LEU   5  -6.004   2.973   1.543
   58   3HD2  LEU   5          HD23      LEU   5  -7.623   2.289   1.395
   59    H    LYS   6           HN       LYS   6  -7.623  -1.423   1.869
   60    HA   LYS   6           HA       LYS   6 -10.436  -1.590   1.043
   61   1HB   LYS   6          HB2       LYS   6  -8.843  -3.687   2.235
   62   2HB   LYS   6          HB1       LYS   6 -10.198  -3.270   3.275
   63   1HG   LYS   6          HG2       LYS   6 -11.219  -3.420   0.659
   64   2HG   LYS   6          HG1       LYS   6 -10.167  -4.821   0.875
   65   1HD   LYS   6          HD2       LYS   6 -11.536  -4.761   3.242
   66   2HD   LYS   6          HD1       LYS   6 -12.756  -4.200   2.098
   67   1HE   LYS   6          HE2       LYS   6 -12.456  -6.169   0.742
   68   2HE   LYS   6          HE1       LYS   6 -11.112  -6.703   1.751
   69   1HZ   LYS   6          HZ1       LYS   6 -12.912  -7.934   2.505
   70   2HZ   LYS   6          HZ2       LYS   6 -13.991  -6.636   2.402
   71   3HZ   LYS   6          HZ3       LYS   6 -12.826  -6.671   3.628
   72    H    PHE   7           HN       PHE   7  -8.372   0.246   2.619
   73    HA   PHE   7           HA       PHE   7 -10.385   1.275   4.414
   74   1HB   PHE   7          HB2       PHE   7  -7.715   0.526   5.603
   75   2HB   PHE   7          HB1       PHE   7  -9.153   1.093   6.444
   76    HD1  PHE   7           HD2      PHE   7  -7.602  -1.760   4.733
   77    HD2  PHE   7           HD1      PHE   7 -10.921  -0.401   7.024
   78    HE1  PHE   7           HE2      PHE   7  -8.288  -4.091   5.114
   79    HE2  PHE   7           HE1      PHE   7 -11.612  -2.731   7.411
   80    HZ   PHE   7           HZ       PHE   7 -10.296  -4.580   6.455
   81    H    ASP   8           HN       ASP   8 -10.370   3.380   4.009
   82    HA   ASP   8           HA       ASP   8  -8.223   4.723   2.752
   83   1HB   ASP   8          HB2       ASP   8  -9.544   6.763   3.120
   84   2HB   ASP   8          HB1       ASP   8 -10.548   5.456   2.500
   85    H    PHE   9           HN       PHE   9  -6.323   4.945   3.766
   86    HA   PHE   9           HA       PHE   9  -6.327   5.803   6.579
   87   1HB   PHE   9          HB2       PHE   9  -4.915   3.767   5.318
   88   2HB   PHE   9          HB1       PHE   9  -3.728   5.055   5.496
   89    HD1  PHE   9           HD1      PHE   9  -6.293   3.186   7.441
   90    HD2  PHE   9           HD2      PHE   9  -2.589   5.280   7.490
   91    HE1  PHE   9           HE1      PHE   9  -5.972   2.553   9.796
   92    HE2  PHE   9           HE2      PHE   9  -2.260   4.651   9.846
   93    HZ   PHE   9           HZ       PHE   9  -3.952   3.285  11.002
   94    H    GLN  10           HN       GLN  10  -5.399   7.685   7.196
   95    HA   GLN  10           HA       GLN  10  -4.637   9.531   5.073
   96   1HB   GLN  10          HB2       GLN  10  -6.276  10.241   6.782
   97   2HB   GLN  10          HB1       GLN  10  -5.052  10.031   8.026
   98   1HG   GLN  10          HG2       GLN  10  -4.340  12.093   7.696
   99   2HG   GLN  10          HG1       GLN  10  -3.975  11.714   6.014
  100   1HE2  GLN  10          HE21      GLN  10  -4.897  13.027   4.629
  101   2HE2  GLN  10          HE22      GLN  10  -6.419  13.821   4.824
  102    H    ALA  11           HN       ALA  11  -2.630  10.336   4.776
  103    HA   ALA  11           HA       ALA  11  -0.436   9.010   6.069
  104   1HB   ALA  11          HB1       ALA  11  -0.542  11.192   3.996
  105   2HB   ALA  11          HB2       ALA  11  -0.216   9.477   3.742
  106   3HB   ALA  11          HB3       ALA  11   0.955  10.480   4.598
  107    H    GLN  12           HN       GLN  12  -0.250   9.587   8.186
  108    HA   GLN  12           HA       GLN  12  -0.605  12.167   9.226
  109   1HB   GLN  12          HB2       GLN  12   0.836  11.225  11.140
  110   2HB   GLN  12          HB1       GLN  12  -0.702  10.449  10.803
  111   1HG   GLN  12          HG2       GLN  12   1.387   9.226   9.261
  112   2HG   GLN  12          HG1       GLN  12   1.823   9.261  10.968
  113   1HE2  GLN  12          HE21      GLN  12   0.806   7.185   8.921
  114   2HE2  GLN  12          HE22      GLN  12  -0.410   6.332   9.804
  115    H    SER  13           HN       SER  13   2.257  10.495   8.019
  116    HA   SER  13           HA       SER  13   3.919  12.828   8.583
  117   1HB   SER  13          HB2       SER  13   4.652  10.110   7.467
  118   2HB   SER  13          HB1       SER  13   5.798  11.390   7.862
  119    HG   SER  13           HG       SER  13   5.741  10.116   9.636
  120    HA   PRO  14           HA       PRO  14   3.817  14.463   4.495
  121   1HB   PRO  14          HB2       PRO  14   6.400  15.274   4.149
  122   2HB   PRO  14          HB1       PRO  14   5.235  16.136   5.160
  123   1HG   PRO  14          HG2       PRO  14   7.372  14.199   5.962
  124   2HG   PRO  14          HG1       PRO  14   6.905  15.730   6.725
  125   1HD   PRO  14          HD2       PRO  14   6.112  13.345   7.699
  126   2HD   PRO  14          HD1       PRO  14   5.083  14.789   7.790
  127    H    LYS  15           HN       LYS  15   6.249  12.056   5.255
  128    HA   LYS  15           HA       LYS  15   6.963  11.540   2.525
  129   1HB   LYS  15          HB2       LYS  15   8.196  11.031   4.863
  130   2HB   LYS  15          HB1       LYS  15   7.443   9.466   4.589
  131   1HG   LYS  15          HG2       LYS  15   8.508   9.428   2.336
  132   2HG   LYS  15          HG1       LYS  15   9.374  10.900   2.781
  133   1HD   LYS  15          HD2       LYS  15  10.772   9.810   4.192
  134   2HD   LYS  15          HD1       LYS  15   9.536   8.656   4.696
  135   1HE   LYS  15          HE2       LYS  15   9.934   7.247   2.914
  136   2HE   LYS  15          HE1       LYS  15  10.610   8.533   1.914
  137   1HZ   LYS  15          HZ1       LYS  15  11.932   6.751   3.714
  138   2HZ   LYS  15          HZ2       LYS  15  12.312   8.366   4.043
  139   3HZ   LYS  15          HZ3       LYS  15  12.584   7.732   2.499
  140    H    GLU  16           HN       GLU  16   4.585  10.341   4.767
  141    HA   GLU  16           HA       GLU  16   3.962   7.952   3.339
  142   1HB   GLU  16          HB2       GLU  16   2.785   9.462   5.614
  143   2HB   GLU  16          HB1       GLU  16   1.727   8.352   4.753
  144   1HG   GLU  16          HG2       GLU  16   2.801   7.343   6.723
  145   2HG   GLU  16          HG1       GLU  16   3.188   6.508   5.220
  146    H    LEU  17           HN       LEU  17   1.675   7.586   2.510
  147    HA   LEU  17           HA       LEU  17   0.688   9.943   1.055
  148   1HB   LEU  17          HB2       LEU  17   2.102   8.515  -0.410
  149   2HB   LEU  17          HB1       LEU  17   0.999   7.183  -0.124
  150    HG   LEU  17           HG       LEU  17  -0.378   9.562  -1.091
  151   1HD1  LEU  17          HD11      LEU  17   0.471   9.414  -3.393
  152   2HD1  LEU  17          HD12      LEU  17   1.736   8.316  -2.841
  153   3HD1  LEU  17          HD13      LEU  17   1.698   9.981  -2.261
  154   1HD2  LEU  17          HD21      LEU  17  -1.179   7.852  -2.768
  155   2HD2  LEU  17          HD22      LEU  17  -1.514   7.488  -1.075
  156   3HD2  LEU  17          HD23      LEU  17  -0.189   6.673  -1.907
  157    H    THR  18           HN       THR  18  -1.483  10.162   0.968
  158    HA   THR  18           HA       THR  18  -3.068   8.323   2.552
  159    HB   THR  18           HB       THR  18  -3.853  10.890   1.157
  160    HG1  THR  18           HG1      THR  18  -2.376  11.296   2.786
  161   1HG2  THR  18          HG21      THR  18  -5.312   9.229   3.189
  162   2HG2  THR  18          HG22      THR  18  -5.846   9.671   1.567
  163   3HG2  THR  18          HG23      THR  18  -5.711  10.906   2.819
  164    H    LEU  19           HN       LEU  19  -4.195   6.696   1.731
  165    HA   LEU  19           HA       LEU  19  -5.043   6.842  -1.086
  166   1HB   LEU  19          HB2       LEU  19  -3.135   5.298  -0.767
  167   2HB   LEU  19          HB1       LEU  19  -4.091   4.383   0.384
  168    HG   LEU  19           HG       LEU  19  -5.692   3.817  -1.397
  169   1HD1  LEU  19          HD11      LEU  19  -4.377   4.325  -3.754
  170   2HD1  LEU  19          HD12      LEU  19  -4.142   5.817  -2.843
  171   3HD1  LEU  19          HD13      LEU  19  -5.772   5.211  -3.138
  172   1HD2  LEU  19          HD21      LEU  19  -3.216   2.736  -0.953
  173   2HD2  LEU  19          HD22      LEU  19  -3.209   2.993  -2.697
  174   3HD2  LEU  19          HD23      LEU  19  -4.479   2.021  -1.955
  175    H    GLN  20           HN       GLN  20  -6.966   5.660  -1.619
  176    HA   GLN  20           HA       GLN  20  -8.725   5.215   0.704
  177   1HB   GLN  20          HB2       GLN  20  -9.116   7.157  -1.069
  178   2HB   GLN  20          HB1       GLN  20  -9.866   5.851  -1.975
  179   1HG   GLN  20          HG2       GLN  20 -10.924   5.585   0.564
  180   2HG   GLN  20          HG1       GLN  20 -10.846   7.328   0.313
  181   1HE2  GLN  20          HE21      GLN  20 -12.211   8.283  -1.113
  182   2HE2  GLN  20          HE22      GLN  20 -13.458   7.443  -1.965
  183    H    LYS  21           HN       LYS  21 -10.511   3.669   0.310
  184    HA   LYS  21           HA       LYS  21  -9.560   1.176  -0.499
  185   1HB   LYS  21          HB2       LYS  21 -12.434   2.087  -0.263
  186   2HB   LYS  21          HB1       LYS  21 -11.892   0.415  -0.312
  187   1HG   LYS  21          HG2       LYS  21 -11.801   0.472   1.899
  188   2HG   LYS  21          HG1       LYS  21 -10.425   1.567   1.749
  189   1HD   LYS  21          HD2       LYS  21 -11.689   3.433   2.181
  190   2HD   LYS  21          HD1       LYS  21 -13.171   2.703   1.562
  191   1HE   LYS  21          HE2       LYS  21 -12.291   1.201   3.818
  192   2HE   LYS  21          HE1       LYS  21 -12.295   2.910   4.249
  193   1HZ   LYS  21          HZ1       LYS  21 -14.545   3.083   3.915
  194   2HZ   LYS  21          HZ2       LYS  21 -14.438   1.506   4.516
  195   3HZ   LYS  21          HZ3       LYS  21 -14.617   1.767   2.855
  196    H    GLY  22           HN       GLY  22 -10.009  -0.141  -2.290
  197   1HA   GLY  22          HA2       GLY  22 -10.799  -0.620  -4.445
  198   2HA   GLY  22          HA1       GLY  22 -11.367   1.042  -4.582
  199    H    ASP  23           HN       ASP  23  -8.352   1.438  -3.462
  200    HA   ASP  23           HA       ASP  23  -7.305   1.867  -6.152
  201   1HB   ASP  23          HB2       ASP  23  -6.451   2.835  -3.427
  202   2HB   ASP  23          HB1       ASP  23  -5.458   3.072  -4.862
  203    H    ILE  24           HN       ILE  24  -5.720   0.697  -7.036
  204    HA   ILE  24           HA       ILE  24  -4.379  -1.304  -5.336
  205    HB   ILE  24           HB       ILE  24  -5.865  -2.305  -7.024
  206   1HG1  ILE  24          HG12      ILE  24  -3.259  -3.028  -8.173
  207   2HG1  ILE  24          HG11      ILE  24  -3.288  -3.032  -6.413
  208   1HG2  ILE  24          HG21      ILE  24  -4.145  -1.619  -9.298
  209   2HG2  ILE  24          HG22      ILE  24  -5.092  -0.277  -8.655
  210   3HG2  ILE  24          HG23      ILE  24  -5.901  -1.748  -9.197
  211   1HD1  ILE  24          HD11      ILE  24  -5.379  -4.454  -8.015
  212   2HD1  ILE  24          HD12      ILE  24  -4.918  -4.695  -6.330
  213   3HD1  ILE  24          HD13      ILE  24  -3.832  -5.205  -7.623
  214    H    VAL  25           HN       VAL  25  -2.190  -1.452  -5.378
  215    HA   VAL  25           HA       VAL  25  -0.701   0.103  -7.363
  216    HB   VAL  25           HB       VAL  25   0.757   1.070  -5.641
  217   1HG1  VAL  25          HG11      VAL  25  -2.174   1.694  -5.302
  218   2HG1  VAL  25          HG12      VAL  25  -1.068   2.415  -6.471
  219   3HG1  VAL  25          HG13      VAL  25  -0.852   2.722  -4.748
  220   1HG2  VAL  25          HG21      VAL  25  -1.192  -0.204  -3.724
  221   2HG2  VAL  25          HG22      VAL  25  -0.024   1.037  -3.268
  222   3HG2  VAL  25          HG23      VAL  25   0.537  -0.524  -3.867
  223    H    TYR  26           HN       TYR  26   1.643  -0.396  -7.326
  224    HA   TYR  26           HA       TYR  26   2.023  -3.251  -6.874
  225   1HB   TYR  26          HB2       TYR  26   4.188  -2.819  -8.146
  226   2HB   TYR  26          HB1       TYR  26   2.693  -2.584  -9.045
  227    HD1  TYR  26           HD1      TYR  26   5.552  -0.897  -7.469
  228    HD2  TYR  26           HD2      TYR  26   2.031  -0.395  -9.804
  229    HE1  TYR  26           HE1      TYR  26   6.269   1.382  -8.050
  230    HE2  TYR  26           HE2      TYR  26   2.739   1.885 -10.393
  231    HH   TYR  26           HH       TYR  26   5.853   3.029  -9.898
  232    H    ILE  27           HN       ILE  27   2.982  -3.975  -5.105
  233    HA   ILE  27           HA       ILE  27   4.340  -2.166  -3.314
  234    HB   ILE  27           HB       ILE  27   4.253  -5.139  -2.930
  235   1HG1  ILE  27          HG12      ILE  27   1.982  -4.654  -3.511
  236   2HG1  ILE  27          HG11      ILE  27   2.048  -4.774  -1.756
  237   1HG2  ILE  27          HG21      ILE  27   3.918  -2.957  -0.896
  238   2HG2  ILE  27          HG22      ILE  27   5.504  -3.529  -1.413
  239   3HG2  ILE  27          HG23      ILE  27   4.375  -4.641  -0.640
  240   1HD1  ILE  27          HD11      ILE  27   1.579  -2.407  -3.483
  241   2HD1  ILE  27          HD12      ILE  27   2.369  -2.172  -1.923
  242   3HD1  ILE  27          HD13      ILE  27   0.768  -2.908  -1.999
  243    H    HIS  28           HN       HIS  28   6.463  -1.857  -3.135
  244    HA   HIS  28           HA       HIS  28   8.252  -3.356  -4.870
  245   1HB   HIS  28          HB2       HIS  28   8.309  -0.750  -3.490
  246   2HB   HIS  28          HB1       HIS  28   9.858  -1.586  -3.550
  247    HD1  HIS  28           HD1      HIS  28   7.213  -0.143  -5.816
  248    HD2  HIS  28           HD2      HIS  28  11.113  -1.565  -6.003
  249    HE1  HIS  28           HE1      HIS  28   8.036   0.451  -8.117
  250    HE2  HIS  28           HE2      HIS  28  10.366  -0.501  -8.238
  251    H    LYS  29           HN       LYS  29   8.685  -2.188  -1.538
  252    HA   LYS  29           HA       LYS  29   9.955  -4.761  -0.890
  253   1HB   LYS  29          HB2       LYS  29  11.056  -3.548   0.964
  254   2HB   LYS  29          HB1       LYS  29  11.456  -2.880  -0.611
  255   1HG   LYS  29          HG2       LYS  29  10.956  -0.904   0.274
  256   2HG   LYS  29          HG1       LYS  29   9.269  -1.400   0.134
  257   1HD   LYS  29          HD2       LYS  29   9.428  -2.376   2.414
  258   2HD   LYS  29          HD1       LYS  29  11.058  -1.711   2.542
  259   1HE   LYS  29          HE2       LYS  29   9.431   0.411   1.706
  260   2HE   LYS  29          HE1       LYS  29   8.516  -0.425   2.960
  261   1HZ   LYS  29          HZ1       LYS  29   9.958   0.203   4.544
  262   2HZ   LYS  29          HZ2       LYS  29  10.378   1.422   3.450
  263   3HZ   LYS  29          HZ3       LYS  29  11.319   0.021   3.554
  264    H    GLU  30           HN       GLU  30   9.502  -5.738   1.160
  265    HA   GLU  30           HA       GLU  30   6.867  -4.970   2.230
  266   1HB   GLU  30          HB2       GLU  30   8.092  -7.725   2.255
  267   2HB   GLU  30          HB1       GLU  30   6.455  -7.288   2.727
  268   1HG   GLU  30          HG2       GLU  30   5.811  -6.867   0.512
  269   2HG   GLU  30          HG1       GLU  30   7.480  -6.832  -0.053
  270    H    VAL  31           HN       VAL  31   7.113  -3.919   4.062
  271    HA   VAL  31           HA       VAL  31   9.207  -4.747   5.932
  272    HB   VAL  31           HB       VAL  31   7.470  -2.544   6.763
  273   1HG1  VAL  31          HG11      VAL  31  10.461  -2.682   6.476
  274   2HG1  VAL  31          HG12      VAL  31   9.571  -3.277   7.877
  275   3HG1  VAL  31          HG13      VAL  31   9.529  -1.562   7.469
  276   1HG2  VAL  31          HG21      VAL  31   9.244  -2.186   4.350
  277   2HG2  VAL  31          HG22      VAL  31   8.476  -0.883   5.254
  278   3HG2  VAL  31          HG23      VAL  31   7.487  -2.050   4.379
  279    H    ASP  32           HN       ASP  32   8.420  -6.556   6.809
  280    HA   ASP  32           HA       ASP  32   5.780  -7.041   7.608
  281   1HB   ASP  32          HB2       ASP  32   8.328  -8.288   8.656
  282   2HB   ASP  32          HB1       ASP  32   6.706  -8.934   8.884
  283    H    LYS  33           HN       LYS  33   8.128  -5.033   9.046
  284    HA   LYS  33           HA       LYS  33   7.702  -5.291  11.757
  285   1HB   LYS  33          HB2       LYS  33   8.789  -3.310  10.000
  286   2HB   LYS  33          HB1       LYS  33   7.793  -2.506  11.205
  287   1HG   LYS  33          HG2       LYS  33  10.142  -2.678  11.885
  288   2HG   LYS  33          HG1       LYS  33   9.058  -3.527  12.990
  289   1HD   LYS  33          HD2       LYS  33   9.921  -5.551  12.483
  290   2HD   LYS  33          HD1       LYS  33  10.132  -5.147  10.778
  291   1HE   LYS  33          HE2       LYS  33  11.973  -3.524  11.933
  292   2HE   LYS  33          HE1       LYS  33  12.004  -4.902  13.032
  293   1HZ   LYS  33          HZ1       LYS  33  13.584  -5.375  11.395
  294   2HZ   LYS  33          HZ2       LYS  33  12.583  -4.862  10.131
  295   3HZ   LYS  33          HZ3       LYS  33  12.239  -6.301  10.950
  296    H    ASN  34           HN       ASN  34   5.876  -3.229   9.503
  297    HA   ASN  34           HA       ASN  34   3.339  -3.742  10.263
  298   1HB   ASN  34          HB2       ASN  34   2.861  -1.787  11.880
  299   2HB   ASN  34          HB1       ASN  34   3.584  -3.251  12.537
  300   1HD2  ASN  34          HD21      ASN  34   4.216   0.035  11.507
  301   2HD2  ASN  34          HD22      ASN  34   5.666   0.246  12.422
  302    H    TRP  35           HN       TRP  35   5.069  -2.447   8.163
  303    HA   TRP  35           HA       TRP  35   3.085  -0.585   7.254
  304   1HB   TRP  35          HB2       TRP  35   5.205   0.472   8.744
  305   2HB   TRP  35          HB1       TRP  35   5.623   0.802   7.066
  306    HD1  TRP  35           HD1      TRP  35   3.229   1.825   5.673
  307    HE1  TRP  35           HE1      TRP  35   1.829   3.832   6.471
  308    HE3  TRP  35           HE3      TRP  35   4.582   1.852  10.603
  309    HZ2  TRP  35           HZ2      TRP  35   1.361   5.241   8.872
  310    HZ3  TRP  35           HZ3      TRP  35   3.614   3.562  12.083
  311    HH2  TRP  35           HH2      TRP  35   2.037   5.221  11.234
  312    H    LEU  36           HN       LEU  36   2.822  -1.187   5.198
  313    HA   LEU  36           HA       LEU  36   5.028  -2.344   3.718
  314   1HB   LEU  36          HB2       LEU  36   2.785  -3.378   3.759
  315   2HB   LEU  36          HB1       LEU  36   2.136  -1.948   2.977
  316    HG   LEU  36           HG       LEU  36   3.992  -2.536   1.175
  317   1HD1  LEU  36          HD11      LEU  36   4.868  -4.579   1.289
  318   2HD1  LEU  36          HD12      LEU  36   3.289  -5.315   1.572
  319   3HD1  LEU  36          HD13      LEU  36   4.221  -4.677   2.928
  320   1HD2  LEU  36          HD21      LEU  36   1.798  -4.336   0.727
  321   2HD2  LEU  36          HD22      LEU  36   2.146  -2.786  -0.040
  322   3HD2  LEU  36          HD23      LEU  36   1.215  -2.839   1.458
  323    H    GLU  37           HN       GLU  37   5.708  -1.579   1.676
  324    HA   GLU  37           HA       GLU  37   5.197   1.287   1.252
  325   1HB   GLU  37          HB2       GLU  37   7.510   0.913   1.678
  326   2HB   GLU  37          HB1       GLU  37   7.565  -0.454   0.575
  327   1HG   GLU  37          HG2       GLU  37   7.620   0.883  -1.296
  328   2HG   GLU  37          HG1       GLU  37   6.864   2.247  -0.474
  329    H    GLY  38           HN       GLY  38   4.498   2.041  -0.692
  330   1HA   GLY  38          HA2       GLY  38   4.257   0.144  -2.920
  331   2HA   GLY  38          HA1       GLY  38   2.803   0.935  -2.330
  332    H    GLU  39           HN       GLU  39   3.391   1.272  -4.919
  333    HA   GLU  39           HA       GLU  39   3.952   4.118  -5.048
  334   1HB   GLU  39          HB2       GLU  39   5.721   2.025  -6.191
  335   2HB   GLU  39          HB1       GLU  39   5.401   3.430  -7.198
  336   1HG   GLU  39          HG2       GLU  39   6.628   4.803  -5.909
  337   2HG   GLU  39          HG1       GLU  39   6.146   4.005  -4.412
  338    H    HIS  40           HN       HIS  40   3.236   5.098  -7.036
  339    HA   HIS  40           HA       HIS  40   1.734   3.443  -8.889
  340   1HB   HIS  40          HB2       HIS  40  -0.354   4.684  -8.601
  341   2HB   HIS  40          HB1       HIS  40   0.111   3.890  -7.100
  342    HD1  HIS  40           HD1      HIS  40   1.841   5.789  -5.684
  343    HD2  HIS  40           HD2      HIS  40  -1.372   7.095  -7.973
  344    HE1  HIS  40           HE1      HIS  40   1.277   8.077  -4.807
  345    HE2  HIS  40           HE2      HIS  40  -0.727   8.810  -6.147
  346    H    HIS  41           HN       HIS  41   1.967   4.186 -10.887
  347    HA   HIS  41           HA       HIS  41   2.600   5.496 -12.636
  348   1HB   HIS  41          HB2       HIS  41   1.355   7.686 -10.962
  349   2HB   HIS  41          HB1       HIS  41   1.664   7.757 -12.694
  350    HD1  HIS  41           HD1      HIS  41  -0.477   5.879 -10.198
  351    HD2  HIS  41           HD2      HIS  41  -0.340   6.750 -14.259
  352    HE1  HIS  41           HE1      HIS  41  -2.653   5.041 -11.139
  353    HE2  HIS  41           HE2      HIS  41  -2.585   5.658 -13.581
  354    H    GLY  42           HN       GLY  42   4.610   5.046 -10.686
  355   1HA   GLY  42          HA2       GLY  42   6.826   5.735 -10.549
  356   2HA   GLY  42          HA1       GLY  42   6.389   7.218 -11.380
  357    H    ARG  43           HN       ARG  43   4.157   7.193  -9.084
  358    HA   ARG  43           HA       ARG  43   5.694   8.957  -7.375
  359   1HB   ARG  43          HB2       ARG  43   3.140   9.074  -8.262
  360   2HB   ARG  43          HB1       ARG  43   2.886   8.335  -6.687
  361   1HG   ARG  43          HG2       ARG  43   4.581  10.780  -6.919
  362   2HG   ARG  43          HG1       ARG  43   2.821  10.917  -6.939
  363   1HD   ARG  43          HD2       ARG  43   3.316   9.211  -4.824
  364   2HD   ARG  43          HD1       ARG  43   4.629  10.383  -4.723
  365    HE   ARG  43           HE       ARG  43   1.837  10.855  -4.219
  366   1HH1  ARG  43          HH11      ARG  43   4.881  12.322  -5.093
  367   2HH1  ARG  43          HH12      ARG  43   4.427  13.895  -4.529
  368   1HH2  ARG  43          HH21      ARG  43   1.239  12.923  -3.477
  369   2HH2  ARG  43          HH22      ARG  43   2.360  14.237  -3.612
  370    H    LEU  44           HN       LEU  44   5.715   8.764  -5.058
  371    HA   LEU  44           HA       LEU  44   5.872   5.967  -4.217
  372   1HB   LEU  44          HB2       LEU  44   7.835   7.446  -3.898
  373   2HB   LEU  44          HB1       LEU  44   6.875   8.453  -2.831
  374    HG   LEU  44           HG       LEU  44   6.573   6.036  -1.632
  375   1HD1  LEU  44          HD11      LEU  44   8.435   5.405  -3.477
  376   2HD1  LEU  44          HD12      LEU  44   8.303   4.622  -1.902
  377   3HD1  LEU  44          HD13      LEU  44   9.468   5.924  -2.145
  378   1HD2  LEU  44          HD21      LEU  44   8.512   8.276  -1.261
  379   2HD2  LEU  44          HD22      LEU  44   8.603   6.856  -0.219
  380   3HD2  LEU  44          HD23      LEU  44   7.125   7.815  -0.275
  381    H    GLY  45           HN       GLY  45   4.456   5.083  -2.862
  382   1HA   GLY  45          HA2       GLY  45   2.898   6.794  -1.068
  383   2HA   GLY  45          HA1       GLY  45   2.015   5.804  -2.218
  384    H    ILE  46           HN       ILE  46   3.243   5.937   0.867
  385    HA   ILE  46           HA       ILE  46   3.260   3.002   1.106
  386    HB   ILE  46           HB       ILE  46   4.596   5.042   2.885
  387   1HG1  ILE  46          HG12      ILE  46   5.649   3.207   0.734
  388   2HG1  ILE  46          HG11      ILE  46   5.712   4.965   0.766
  389   1HG2  ILE  46          HG21      ILE  46   3.791   2.642   3.729
  390   2HG2  ILE  46          HG22      ILE  46   5.295   3.382   4.266
  391   3HG2  ILE  46          HG23      ILE  46   5.317   2.172   2.985
  392   1HD1  ILE  46          HD11      ILE  46   7.325   2.991   2.311
  393   2HD1  ILE  46          HD12      ILE  46   7.128   4.647   2.887
  394   3HD1  ILE  46          HD13      ILE  46   7.860   4.343   1.312
  395    H    PHE  47           HN       PHE  47   2.173   2.028   2.798
  396    HA   PHE  47           HA       PHE  47   0.631   3.588   4.677
  397   1HB   PHE  47          HB2       PHE  47  -1.498   2.302   3.933
  398   2HB   PHE  47          HB1       PHE  47  -1.008   3.722   3.015
  399    HD1  PHE  47           HD2      PHE  47   0.209   3.407   0.848
  400    HD2  PHE  47           HD1      PHE  47  -1.647   0.189   2.923
  401    HE1  PHE  47           HE2      PHE  47   0.242   2.064  -1.214
  402    HE2  PHE  47           HE1      PHE  47  -1.618  -1.160   0.866
  403    HZ   PHE  47           HZ       PHE  47  -0.673  -0.223  -1.207
  404    HA   PRO  48           HA       PRO  48   1.176   0.081   7.275
  405   1HB   PRO  48          HB2       PRO  48  -1.326  -0.240   8.393
  406   2HB   PRO  48          HB1       PRO  48  -0.128   0.940   8.935
  407   1HG   PRO  48          HG2       PRO  48  -2.485   1.319   7.135
  408   2HG   PRO  48          HG1       PRO  48  -1.866   2.382   8.413
  409   1HD   PRO  48          HD2       PRO  48  -1.402   2.888   5.818
  410   2HD   PRO  48          HD1       PRO  48  -0.182   3.231   7.063
  411    H    ALA  49           HN       ALA  49   1.262  -2.039   6.901
  412    HA   ALA  49           HA       ALA  49  -0.150  -3.223   4.752
  413   1HB   ALA  49          HB1       ALA  49   2.151  -3.815   5.983
  414   2HB   ALA  49          HB2       ALA  49   1.255  -4.977   5.004
  415   3HB   ALA  49          HB3       ALA  49   1.095  -4.995   6.760
  416    H    ASN  50           HN       ASN  50  -0.620  -3.208   8.228
  417    HA   ASN  50           HA       ASN  50  -2.431  -5.317   8.465
  418   1HB   ASN  50          HB2       ASN  50  -1.340  -3.413  10.169
  419   2HB   ASN  50          HB1       ASN  50  -3.068  -3.081  10.223
  420   1HD2  ASN  50          HD21      ASN  50  -0.609  -5.519  10.732
  421   2HD2  ASN  50          HD22      ASN  50  -1.547  -6.517  11.785
  422    H    TYR  51           HN       TYR  51  -2.840  -2.193   7.070
  423    HA   TYR  51           HA       TYR  51  -5.760  -2.518   7.081
  424   1HB   TYR  51          HB2       TYR  51  -4.013  -0.098   6.640
  425   2HB   TYR  51          HB1       TYR  51  -5.743  -0.100   6.310
  426    HD1  TYR  51           HD2      TYR  51  -7.328  -0.608   8.232
  427    HD2  TYR  51           HD1      TYR  51  -3.204   0.258   8.816
  428    HE1  TYR  51           HE2      TYR  51  -7.781  -0.071  10.589
  429    HE2  TYR  51           HE1      TYR  51  -3.645   0.796  11.174
  430    HH   TYR  51           HH       TYR  51  -6.206   1.627  12.426
  431    H    VAL  52           HN       VAL  52  -4.142  -4.108   5.352
  432    HA   VAL  52           HA       VAL  52  -5.390  -3.416   2.839
  433    HB   VAL  52           HB       VAL  52  -2.636  -4.071   2.229
  434   1HG1  VAL  52          HG11      VAL  52  -4.728  -2.827   1.013
  435   2HG1  VAL  52          HG12      VAL  52  -3.059  -2.790   0.445
  436   3HG1  VAL  52          HG13      VAL  52  -3.688  -1.462   1.420
  437   1HG2  VAL  52          HG21      VAL  52  -2.270  -2.800   4.359
  438   2HG2  VAL  52          HG22      VAL  52  -3.009  -1.403   3.575
  439   3HG2  VAL  52          HG23      VAL  52  -1.519  -2.092   2.929
  440    H    GLU  53           HN       GLU  53  -5.001  -5.121   1.175
  441    HA   GLU  53           HA       GLU  53  -4.604  -7.744   2.459
  442   1HB   GLU  53          HB2       GLU  53  -6.968  -6.964   1.562
  443   2HB   GLU  53          HB1       GLU  53  -6.294  -7.449   0.012
  444   1HG   GLU  53          HG2       GLU  53  -7.117  -9.457   0.533
  445   2HG   GLU  53          HG1       GLU  53  -5.674  -9.598   1.536
  446    H    VAL  54           HN       VAL  54  -2.898  -8.813   1.717
  447    HA   VAL  54           HA       VAL  54  -1.551  -7.919  -0.673
  448    HB   VAL  54           HB       VAL  54  -0.249  -8.555   1.308
  449   1HG1  VAL  54          HG11      VAL  54  -0.609 -11.444   0.903
  450   2HG1  VAL  54          HG12      VAL  54  -1.990 -10.604   1.609
  451   3HG1  VAL  54          HG13      VAL  54  -0.412 -10.520   2.392
  452   1HG2  VAL  54          HG21      VAL  54   0.369  -9.059  -1.269
  453   2HG2  VAL  54          HG22      VAL  54   0.561 -10.669  -0.576
  454   3HG2  VAL  54          HG23      VAL  54   1.481  -9.313   0.075
  455    H    LEU  55           HN       LEU  55  -2.008  -8.659  -2.639
  456    HA   LEU  55           HA       LEU  55  -2.185 -11.387  -3.294
  457   1HB   LEU  55          HB2       LEU  55  -4.544 -11.517  -3.966
  458   2HB   LEU  55          HB1       LEU  55  -4.351 -11.319  -2.235
  459    HG   LEU  55           HG       LEU  55  -4.619  -8.716  -3.229
  460   1HD1  LEU  55          HD11      LEU  55  -7.047  -9.293  -4.245
  461   2HD1  LEU  55          HD12      LEU  55  -6.116 -10.662  -4.851
  462   3HD1  LEU  55          HD13      LEU  55  -5.610  -9.016  -5.228
  463   1HD2  LEU  55          HD21      LEU  55  -7.012  -9.120  -2.200
  464   2HD2  LEU  55          HD22      LEU  55  -5.572  -9.079  -1.184
  465   3HD2  LEU  55          HD23      LEU  55  -6.272 -10.626  -1.659
  466    HA   PRO  56           HA       PRO  56  -1.089  -8.706  -6.834
  467   1HB   PRO  56          HB2       PRO  56   0.244 -11.181  -7.727
  468   2HB   PRO  56          HB1       PRO  56   0.918  -9.567  -7.492
  469   1HG   PRO  56          HG2       PRO  56   1.499 -11.576  -5.820
  470   2HG   PRO  56          HG1       PRO  56   1.304  -9.912  -5.237
  471   1HD   PRO  56          HD2       PRO  56  -0.633 -12.198  -5.125
  472   2HD   PRO  56          HD1       PRO  56  -0.233 -11.002  -3.873
  473    H    LEU  57           HN       LEU  57  -3.620  -9.416  -6.937
  474    HA   LEU  57           HA       LEU  57  -5.351 -10.163  -8.217
  475   1HB   LEU  57          HB2       LEU  57  -3.192  -9.619 -10.229
  476   2HB   LEU  57          HB1       LEU  57  -4.771 -10.187 -10.734
  477    HG   LEU  57           HG       LEU  57  -5.820  -8.217  -9.721
  478   1HD1  LEU  57          HD11      LEU  57  -3.102  -7.842  -8.658
  479   2HD1  LEU  57          HD12      LEU  57  -4.663  -7.372  -7.986
  480   3HD1  LEU  57          HD13      LEU  57  -3.906  -6.382  -9.234
  481   1HD2  LEU  57          HD21      LEU  57  -3.544  -7.587 -11.598
  482   2HD2  LEU  57          HD22      LEU  57  -4.923  -6.535 -11.279
  483   3HD2  LEU  57          HD23      LEU  57  -5.169  -8.101 -12.051
  484    H    GLU  58           HN       GLU  58  -5.806 -11.785 -10.228
  485    HA   GLU  58           HA       GLU  58  -4.371 -14.286  -9.630
  486   1HB   GLU  58          HB2       GLU  58  -7.342 -13.843  -9.903
  487   2HB   GLU  58          HB1       GLU  58  -6.605 -15.435 -10.018
  488   1HG   GLU  58          HG2       GLU  58  -6.824 -15.592  -7.823
  489   2HG   GLU  58          HG1       GLU  58  -5.567 -14.364  -7.680
  Start of MODEL    4
    1   1H    MET   0          HT1       MET   0   6.034  -9.669 -10.929
    2   2H    MET   0          HT2       MET   0   5.853 -11.036  -9.909
    3   3H    MET   0          HT3       MET   0   5.944  -9.462  -9.230
    4    HA   MET   0           HA       MET   0   3.913  -8.938 -10.556
    5   1HB   MET   0          HB2       MET   0   4.020 -11.951 -10.739
    6   2HB   MET   0          HB1       MET   0   2.548 -11.025 -11.001
    7   1HG   MET   0          HG2       MET   0   4.869 -10.143 -12.566
    8   2HG   MET   0          HG1       MET   0   4.271 -11.757 -12.947
    9   1HE   MET   0          HE1       MET   0   2.719 -11.392 -15.481
   10   2HE   MET   0          HE2       MET   0   1.149 -11.460 -14.680
   11   3HE   MET   0          HE3       MET   0   2.507 -12.384 -14.038
   12    H    LYS   1           HN       LYS   1   3.054  -8.072  -8.772
   13    HA   LYS   1           HA       LYS   1   1.653  -9.712  -6.910
   14   1HB   LYS   1          HB2       LYS   1   4.318  -9.345  -6.280
   15   2HB   LYS   1          HB1       LYS   1   3.517  -8.087  -5.349
   16   1HG   LYS   1          HG2       LYS   1   2.142  -9.697  -4.234
   17   2HG   LYS   1          HG1       LYS   1   2.733 -10.991  -5.278
   18   1HD   LYS   1          HD2       LYS   1   5.063 -10.021  -4.275
   19   2HD   LYS   1          HD1       LYS   1   3.969  -9.747  -2.918
   20   1HE   LYS   1          HE2       LYS   1   4.058 -11.899  -2.382
   21   2HE   LYS   1          HE1       LYS   1   3.470 -12.343  -3.984
   22   1HZ   LYS   1          HZ1       LYS   1   6.016 -11.811  -4.527
   23   2HZ   LYS   1          HZ2       LYS   1   5.463 -13.351  -4.098
   24   3HZ   LYS   1          HZ3       LYS   1   6.177 -12.355  -2.932
   25    H    ALA   2           HN       ALA   2  -0.164  -8.599  -6.708
   26    HA   ALA   2           HA       ALA   2   0.005  -5.684  -6.313
   27   1HB   ALA   2          HB1       ALA   2  -0.896  -6.569  -8.585
   28   2HB   ALA   2          HB2       ALA   2  -1.754  -5.270  -7.755
   29   3HB   ALA   2          HB3       ALA   2  -2.356  -6.925  -7.662
   30    H    ALA   3           HN       ALA   3  -1.613  -4.746  -4.980
   31    HA   ALA   3           HA       ALA   3  -3.234  -6.622  -3.410
   32   1HB   ALA   3          HB1       ALA   3  -2.554  -5.625  -1.321
   33   2HB   ALA   3          HB2       ALA   3  -1.514  -4.480  -2.167
   34   3HB   ALA   3          HB3       ALA   3  -1.129  -6.201  -2.185
   35    H    ARG   4           HN       ARG   4  -5.220  -5.888  -2.885
   36    HA   ARG   4           HA       ARG   4  -5.920  -3.189  -3.800
   37   1HB   ARG   4          HB2       ARG   4  -7.122  -5.313  -4.627
   38   2HB   ARG   4          HB1       ARG   4  -7.879  -5.344  -3.040
   39   1HG   ARG   4          HG2       ARG   4  -8.899  -3.207  -3.418
   40   2HG   ARG   4          HG1       ARG   4  -8.018  -3.009  -4.935
   41   1HD   ARG   4          HD2       ARG   4  -9.583  -5.480  -4.763
   42   2HD   ARG   4          HD1       ARG   4 -10.550  -4.007  -4.700
   43    HE   ARG   4           HE       ARG   4  -8.619  -3.978  -6.813
   44   1HH1  ARG   4          HH11      ARG   4 -11.800  -5.089  -5.904
   45   2HH1  ARG   4          HH12      ARG   4 -12.377  -5.163  -7.535
   46   1HH2  ARG   4          HH21      ARG   4  -9.377  -4.075  -8.959
   47   2HH2  ARG   4          HH22      ARG   4 -11.001  -4.590  -9.269
   48    H    LEU   5           HN       LEU   5  -5.826  -1.715  -2.236
   49    HA   LEU   5           HA       LEU   5  -5.964  -2.284   0.521
   50   1HB   LEU   5          HB2       LEU   5  -5.560   0.017  -1.156
   51   2HB   LEU   5          HB1       LEU   5  -6.656   0.420   0.151
   52    HG   LEU   5           HG       LEU   5  -4.580  -0.999   1.378
   53   1HD1  LEU   5          HD11      LEU   5  -3.561   0.808  -0.788
   54   2HD1  LEU   5          HD12      LEU   5  -3.075  -0.843  -0.402
   55   3HD1  LEU   5          HD13      LEU   5  -2.629   0.482   0.673
   56   1HD2  LEU   5          HD21      LEU   5  -4.075   1.743   1.710
   57   2HD2  LEU   5          HD22      LEU   5  -5.003   0.679   2.765
   58   3HD2  LEU   5          HD23      LEU   5  -5.817   1.587   1.493
   59    H    LYS   6           HN       LYS   6  -7.556  -1.142   2.000
   60    HA   LYS   6           HA       LYS   6 -10.233  -0.796   1.006
   61   1HB   LYS   6          HB2       LYS   6  -9.540  -3.177   2.727
   62   2HB   LYS   6          HB1       LYS   6 -11.178  -2.580   2.507
   63   1HG   LYS   6          HG2       LYS   6 -10.911  -2.947   0.058
   64   2HG   LYS   6          HG1       LYS   6  -9.356  -3.709   0.397
   65   1HD   LYS   6          HD2       LYS   6 -10.307  -5.589   1.217
   66   2HD   LYS   6          HD1       LYS   6 -11.643  -4.711   1.964
   67   1HE   LYS   6          HE2       LYS   6 -11.567  -4.792  -0.995
   68   2HE   LYS   6          HE1       LYS   6 -11.956  -6.297  -0.163
   69   1HZ   LYS   6          HZ1       LYS   6 -13.439  -3.753  -0.177
   70   2HZ   LYS   6          HZ2       LYS   6 -13.615  -4.823   1.121
   71   3HZ   LYS   6          HZ3       LYS   6 -14.009  -5.324  -0.445
   72    H    PHE   7           HN       PHE   7  -8.297   0.797   2.481
   73    HA   PHE   7           HA       PHE   7 -10.003   1.434   4.766
   74   1HB   PHE   7          HB2       PHE   7  -7.017   1.060   5.058
   75   2HB   PHE   7          HB1       PHE   7  -8.134   1.564   6.323
   76    HD1  PHE   7           HD2      PHE   7  -7.237  -1.248   4.094
   77    HD2  PHE   7           HD1      PHE   7  -9.310  -0.012   7.599
   78    HE1  PHE   7           HE2      PHE   7  -7.599  -3.603   4.705
   79    HE2  PHE   7           HE1      PHE   7  -9.676  -2.366   8.218
   80    HZ   PHE   7           HZ       PHE   7  -8.820  -4.165   6.770
   81    H    ASP   8           HN       ASP   8 -10.623   3.386   3.958
   82    HA   ASP   8           HA       ASP   8  -8.883   5.219   2.686
   83   1HB   ASP   8          HB2       ASP   8 -10.740   6.819   2.917
   84   2HB   ASP   8          HB1       ASP   8 -11.302   5.261   2.318
   85    H    PHE   9           HN       PHE   9  -7.139   5.062   4.331
   86    HA   PHE   9           HA       PHE   9  -7.632   6.757   6.678
   87   1HB   PHE   9          HB2       PHE   9  -6.163   4.352   6.308
   88   2HB   PHE   9          HB1       PHE   9  -5.007   5.619   6.704
   89    HD1  PHE   9           HD2      PHE   9  -6.322   7.300   8.588
   90    HD2  PHE   9           HD1      PHE   9  -6.579   3.073   8.163
   91    HE1  PHE   9           HE2      PHE   9  -6.920   7.101  10.966
   92    HE2  PHE   9           HE1      PHE   9  -7.178   2.867  10.541
   93    HZ   PHE   9           HZ       PHE   9  -7.349   4.883  11.946
   94    H    GLN  10           HN       GLN  10  -6.448   8.593   7.067
   95    HA   GLN  10           HA       GLN  10  -5.194   9.790   4.749
   96   1HB   GLN  10          HB2       GLN  10  -6.750  10.819   6.713
   97   2HB   GLN  10          HB1       GLN  10  -5.155  11.233   7.329
   98   1HG   GLN  10          HG2       GLN  10  -5.826  11.848   4.493
   99   2HG   GLN  10          HG1       GLN  10  -6.458  12.876   5.778
  100   1HE2  GLN  10          HE21      GLN  10  -4.316  13.092   3.586
  101   2HE2  GLN  10          HE22      GLN  10  -2.966  13.779   4.417
  102    H    ALA  11           HN       ALA  11  -3.072  10.420   4.564
  103    HA   ALA  11           HA       ALA  11  -1.135   8.861   5.912
  104   1HB   ALA  11          HB1       ALA  11  -1.207  10.386   3.603
  105   2HB   ALA  11          HB2       ALA  11   0.188   9.516   4.244
  106   3HB   ALA  11          HB3       ALA  11  -0.042  11.222   4.630
  107    H    GLN  12           HN       GLN  12   0.266   9.337   7.548
  108    HA   GLN  12           HA       GLN  12  -0.452  11.559   9.253
  109   1HB   GLN  12          HB2       GLN  12   1.411  10.504  10.702
  110   2HB   GLN  12          HB1       GLN  12  -0.100   9.632  10.507
  111   1HG   GLN  12          HG2       GLN  12   1.967   8.998   8.524
  112   2HG   GLN  12          HG1       GLN  12   2.360   8.558  10.185
  113   1HE2  GLN  12          HE21      GLN  12   2.101   6.606   8.335
  114   2HE2  GLN  12          HE22      GLN  12   0.657   5.700   8.612
  115    H    SER  13           HN       SER  13   2.294  10.514   7.307
  116    HA   SER  13           HA       SER  13   3.705  12.997   7.983
  117   1HB   SER  13          HB2       SER  13   5.039  10.969   6.282
  118   2HB   SER  13          HB1       SER  13   5.679  11.912   7.629
  119    HG   SER  13           HG       SER  13   5.172  10.354   8.952
  120    HA   PRO  14           HA       PRO  14   2.692  14.947   4.152
  121   1HB   PRO  14          HB2       PRO  14   5.525  15.847   4.120
  122   2HB   PRO  14          HB1       PRO  14   4.040  16.799   4.022
  123   1HG   PRO  14          HG2       PRO  14   5.485  16.751   6.261
  124   2HG   PRO  14          HG1       PRO  14   3.713  16.773   6.315
  125   1HD   PRO  14          HD2       PRO  14   5.599  14.500   6.766
  126   2HD   PRO  14          HD1       PRO  14   4.065  14.875   7.580
  127    H    LYS  15           HN       LYS  15   5.585  12.983   4.441
  128    HA   LYS  15           HA       LYS  15   5.960  12.753   1.591
  129   1HB   LYS  15          HB2       LYS  15   7.827  12.664   3.278
  130   2HB   LYS  15          HB1       LYS  15   7.223  11.087   3.768
  131   1HG   LYS  15          HG2       LYS  15   7.746  10.126   1.679
  132   2HG   LYS  15          HG1       LYS  15   8.014  11.706   0.938
  133   1HD   LYS  15          HD2       LYS  15  10.182  11.090   1.312
  134   2HD   LYS  15          HD1       LYS  15   9.837  11.887   2.848
  135   1HE   LYS  15          HE2       LYS  15   9.471   8.932   2.417
  136   2HE   LYS  15          HE1       LYS  15  10.983   9.635   2.988
  137   1HZ   LYS  15          HZ1       LYS  15   9.265  10.749   4.676
  138   2HZ   LYS  15          HZ2       LYS  15  10.035   9.275   4.982
  139   3HZ   LYS  15          HZ3       LYS  15   8.455   9.294   4.378
  140    H    GLU  16           HN       GLU  16   4.344  10.975   4.113
  141    HA   GLU  16           HA       GLU  16   4.111   8.481   2.863
  142   1HB   GLU  16          HB2       GLU  16   2.574   9.931   4.973
  143   2HB   GLU  16          HB1       GLU  16   1.881   8.471   4.282
  144   1HG   GLU  16          HG2       GLU  16   4.529   7.821   4.865
  145   2HG   GLU  16          HG1       GLU  16   3.963   8.765   6.241
  146    H    LEU  17           HN       LEU  17   1.775   7.628   2.296
  147    HA   LEU  17           HA       LEU  17   0.513   9.544   0.450
  148   1HB   LEU  17          HB2       LEU  17   1.988   7.919  -0.733
  149   2HB   LEU  17          HB1       LEU  17   0.985   6.619  -0.118
  150    HG   LEU  17           HG       LEU  17  -0.883   8.201  -1.325
  151   1HD1  LEU  17          HD11      LEU  17   1.459   8.233  -3.203
  152   2HD1  LEU  17          HD12      LEU  17   1.067   9.604  -2.166
  153   3HD1  LEU  17          HD13      LEU  17  -0.098   9.046  -3.367
  154   1HD2  LEU  17          HD21      LEU  17   0.579   5.739  -1.983
  155   2HD2  LEU  17          HD22      LEU  17  -0.227   6.519  -3.344
  156   3HD2  LEU  17          HD23      LEU  17  -1.155   6.051  -1.920
  157    H    THR  18           HN       THR  18  -1.669   9.581   0.423
  158    HA   THR  18           HA       THR  18  -3.049   8.038   2.452
  159    HB   THR  18           HB       THR  18  -4.064  10.172   0.562
  160    HG1  THR  18           HG1      THR  18  -3.325  11.524   1.965
  161   1HG2  THR  18          HG21      THR  18  -5.458   8.480   2.465
  162   2HG2  THR  18          HG22      THR  18  -6.092   9.541   1.206
  163   3HG2  THR  18          HG23      THR  18  -5.667  10.202   2.786
  164    H    LEU  19           HN       LEU  19  -4.383   6.359   2.110
  165    HA   LEU  19           HA       LEU  19  -4.897   5.574  -0.684
  166   1HB   LEU  19          HB2       LEU  19  -4.041   4.065   1.711
  167   2HB   LEU  19          HB1       LEU  19  -5.214   3.272   0.679
  168    HG   LEU  19           HG       LEU  19  -3.047   2.543   0.038
  169   1HD1  LEU  19          HD11      LEU  19  -3.219   4.315  -2.221
  170   2HD1  LEU  19          HD12      LEU  19  -4.826   3.793  -1.716
  171   3HD1  LEU  19          HD13      LEU  19  -3.594   2.595  -2.113
  172   1HD2  LEU  19          HD21      LEU  19  -1.524   4.094   0.826
  173   2HD2  LEU  19          HD22      LEU  19  -2.378   5.454   0.098
  174   3HD2  LEU  19          HD23      LEU  19  -1.450   4.350  -0.917
  175    H    GLN  20           HN       GLN  20  -6.881   4.466  -1.118
  176    HA   GLN  20           HA       GLN  20  -8.985   4.877   0.887
  177   1HB   GLN  20          HB2       GLN  20  -8.829   6.505  -1.232
  178   2HB   GLN  20          HB1       GLN  20  -9.729   5.185  -1.969
  179   1HG   GLN  20          HG2       GLN  20 -11.031   5.553   0.421
  180   2HG   GLN  20          HG1       GLN  20 -10.590   7.195  -0.052
  181   1HE2  GLN  20          HE21      GLN  20 -11.313   7.975  -2.097
  182   2HE2  GLN  20          HE22      GLN  20 -12.736   7.323  -2.829
  183    H    LYS  21           HN       LYS  21 -10.961   3.567   0.412
  184    HA   LYS  21           HA       LYS  21 -10.304   0.867   0.181
  185   1HB   LYS  21          HB2       LYS  21 -12.840   2.420   0.235
  186   2HB   LYS  21          HB1       LYS  21 -12.923   0.751  -0.311
  187   1HG   LYS  21          HG2       LYS  21 -12.449  -0.094   1.741
  188   2HG   LYS  21          HG1       LYS  21 -11.451   1.286   2.202
  189   1HD   LYS  21          HD2       LYS  21 -13.368   2.626   2.647
  190   2HD   LYS  21          HD1       LYS  21 -14.446   1.436   1.914
  191   1HE   LYS  21          HE2       LYS  21 -13.434  -0.138   3.757
  192   2HE   LYS  21          HE1       LYS  21 -13.074   1.388   4.562
  193   1HZ   LYS  21          HZ1       LYS  21 -15.609   1.787   3.889
  194   2HZ   LYS  21          HZ2       LYS  21 -15.144   1.091   5.360
  195   3HZ   LYS  21          HZ3       LYS  21 -15.636   0.105   4.077
  196    H    GLY  22           HN       GLY  22  -9.864  -0.374  -1.512
  197   1HA   GLY  22          HA2       GLY  22 -10.389  -1.297  -3.641
  198   2HA   GLY  22          HA1       GLY  22 -11.132   0.236  -4.088
  199    H    ASP  23           HN       ASP  23  -8.376   1.191  -2.663
  200    HA   ASP  23           HA       ASP  23  -7.121   1.834  -5.129
  201   1HB   ASP  23          HB2       ASP  23  -6.547   2.284  -2.249
  202   2HB   ASP  23          HB1       ASP  23  -5.183   2.389  -3.358
  203    H    ILE  24           HN       ILE  24  -5.590   0.806  -6.250
  204    HA   ILE  24           HA       ILE  24  -4.365  -1.585  -5.036
  205    HB   ILE  24           HB       ILE  24  -4.158  -2.517  -7.289
  206   1HG1  ILE  24          HG12      ILE  24  -5.887  -1.098  -8.891
  207   2HG1  ILE  24          HG11      ILE  24  -5.034   0.184  -8.037
  208   1HG2  ILE  24          HG21      ILE  24  -6.476  -3.076  -7.630
  209   2HG2  ILE  24          HG22      ILE  24  -6.990  -1.656  -6.719
  210   3HG2  ILE  24          HG23      ILE  24  -6.152  -2.974  -5.899
  211   1HD1  ILE  24          HD11      ILE  24  -2.970  -1.400  -8.759
  212   2HD1  ILE  24          HD12      ILE  24  -3.560  -0.033  -9.704
  213   3HD1  ILE  24          HD13      ILE  24  -4.087  -1.670 -10.097
  214    H    VAL  25           HN       VAL  25  -2.222  -1.581  -4.812
  215    HA   VAL  25           HA       VAL  25  -0.587   0.047  -6.613
  216    HB   VAL  25           HB       VAL  25   0.740   0.937  -4.746
  217   1HG1  VAL  25          HG11      VAL  25  -1.024   2.507  -3.852
  218   2HG1  VAL  25          HG12      VAL  25  -2.203   1.559  -4.759
  219   3HG1  VAL  25          HG13      VAL  25  -0.908   2.403  -5.609
  220   1HG2  VAL  25          HG21      VAL  25  -0.794   0.783  -2.504
  221   2HG2  VAL  25          HG22      VAL  25   0.600  -0.245  -2.839
  222   3HG2  VAL  25          HG23      VAL  25  -1.027  -0.822  -3.199
  223    H    TYR  26           HN       TYR  26   1.656  -0.549  -6.653
  224    HA   TYR  26           HA       TYR  26   2.031  -3.387  -6.158
  225   1HB   TYR  26          HB2       TYR  26   3.898  -1.400  -7.472
  226   2HB   TYR  26          HB1       TYR  26   4.065  -3.153  -7.484
  227    HD1  TYR  26           HD1      TYR  26   2.236  -0.295  -8.860
  228    HD2  TYR  26           HD2      TYR  26   2.654  -4.528  -8.905
  229    HE1  TYR  26           HE1      TYR  26   0.904  -0.399 -10.924
  230    HE2  TYR  26           HE2      TYR  26   1.323  -4.644 -10.970
  231    HH   TYR  26           HH       TYR  26  -0.573  -2.192 -12.075
  232    H    ILE  27           HN       ILE  27   3.038  -4.178  -4.437
  233    HA   ILE  27           HA       ILE  27   4.260  -2.393  -2.527
  234    HB   ILE  27           HB       ILE  27   3.939  -5.398  -2.466
  235   1HG1  ILE  27          HG12      ILE  27   2.214  -4.770  -0.690
  236   2HG1  ILE  27          HG11      ILE  27   2.340  -3.122  -1.297
  237   1HG2  ILE  27          HG21      ILE  27   5.680  -5.055  -0.991
  238   2HG2  ILE  27          HG22      ILE  27   4.279  -4.901   0.069
  239   3HG2  ILE  27          HG23      ILE  27   5.105  -3.457  -0.518
  240   1HD1  ILE  27          HD11      ILE  27   0.469  -4.685  -2.166
  241   2HD1  ILE  27          HD12      ILE  27   1.747  -5.356  -3.180
  242   3HD1  ILE  27          HD13      ILE  27   1.335  -3.645  -3.298
  243    H    HIS  28           HN       HIS  28   6.377  -2.129  -2.108
  244    HA   HIS  28           HA       HIS  28   8.272  -3.446  -3.910
  245   1HB   HIS  28          HB2       HIS  28   8.012  -0.819  -3.262
  246   2HB   HIS  28          HB1       HIS  28   9.241  -1.318  -2.105
  247    HD1  HIS  28           HD1      HIS  28  10.935  -3.196  -3.773
  248    HD2  HIS  28           HD2      HIS  28   9.436   0.401  -5.214
  249    HE1  HIS  28           HE1      HIS  28  12.439  -2.559  -5.686
  250    HE2  HIS  28           HE2      HIS  28  11.456  -0.427  -6.600
  251    H    LYS  29           HN       LYS  29   7.673  -2.834  -0.479
  252    HA   LYS  29           HA       LYS  29   9.268  -5.188   0.172
  253   1HB   LYS  29          HB2       LYS  29  10.416  -3.996   2.020
  254   2HB   LYS  29          HB1       LYS  29  10.880  -3.407   0.431
  255   1HG   LYS  29          HG2       LYS  29  10.173  -1.350   0.880
  256   2HG   LYS  29          HG1       LYS  29   8.639  -1.934   1.526
  257   1HD   LYS  29          HD2       LYS  29  10.119  -2.631   3.573
  258   2HD   LYS  29          HD1       LYS  29  11.219  -1.410   2.932
  259   1HE   LYS  29          HE2       LYS  29   9.227   0.162   2.911
  260   2HE   LYS  29          HE1       LYS  29   8.383  -1.052   3.872
  261   1HZ   LYS  29          HZ1       LYS  29  10.624   0.681   4.613
  262   2HZ   LYS  29          HZ2       LYS  29  10.543  -0.852   5.322
  263   3HZ   LYS  29          HZ3       LYS  29   9.262   0.235   5.512
  264    H    GLU  30           HN       GLU  30   8.551  -6.279   1.972
  265    HA   GLU  30           HA       GLU  30   6.084  -5.214   3.172
  266   1HB   GLU  30          HB2       GLU  30   6.901  -8.107   3.129
  267   2HB   GLU  30          HB1       GLU  30   5.314  -7.430   3.464
  268   1HG   GLU  30          HG2       GLU  30   4.903  -6.957   1.228
  269   2HG   GLU  30          HG1       GLU  30   6.609  -7.049   0.797
  270    H    VAL  31           HN       VAL  31   6.645  -4.211   4.970
  271    HA   VAL  31           HA       VAL  31   8.474  -5.550   6.825
  272    HB   VAL  31           HB       VAL  31   7.421  -2.982   7.715
  273   1HG1  VAL  31          HG11      VAL  31  10.297  -3.457   7.178
  274   2HG1  VAL  31          HG12      VAL  31   9.506  -4.479   8.378
  275   3HG1  VAL  31          HG13      VAL  31   9.509  -2.727   8.576
  276   1HG2  VAL  31          HG21      VAL  31   7.387  -2.423   5.364
  277   2HG2  VAL  31          HG22      VAL  31   9.016  -3.060   5.156
  278   3HG2  VAL  31          HG23      VAL  31   8.751  -1.616   6.132
  279    H    ASP  32           HN       ASP  32   7.293  -7.068   7.768
  280    HA   ASP  32           HA       ASP  32   4.593  -6.918   8.471
  281   1HB   ASP  32          HB2       ASP  32   6.495  -8.890   8.463
  282   2HB   ASP  32          HB1       ASP  32   6.214  -8.664  10.186
  283    H    LYS  33           HN       LYS  33   7.279  -5.435   9.970
  284    HA   LYS  33           HA       LYS  33   6.492  -5.481  12.657
  285   1HB   LYS  33          HB2       LYS  33   7.719  -3.190  12.716
  286   2HB   LYS  33          HB1       LYS  33   8.634  -4.648  12.367
  287   1HG   LYS  33          HG2       LYS  33   9.119  -4.004  10.271
  288   2HG   LYS  33          HG1       LYS  33   7.545  -3.248  10.020
  289   1HD   LYS  33          HD2       LYS  33   9.338  -1.944  11.975
  290   2HD   LYS  33          HD1       LYS  33   9.825  -1.854  10.282
  291   1HE   LYS  33          HE2       LYS  33   8.003  -0.597   9.683
  292   2HE   LYS  33          HE1       LYS  33   7.001  -1.234  10.985
  293   1HZ   LYS  33          HZ1       LYS  33   8.962   0.084  12.307
  294   2HZ   LYS  33          HZ2       LYS  33   7.422   0.701  11.979
  295   3HZ   LYS  33          HZ3       LYS  33   8.716   1.071  10.955
  296    H    ASN  34           HN       ASN  34   5.655  -3.227  10.046
  297    HA   ASN  34           HA       ASN  34   3.061  -2.770  10.638
  298   1HB   ASN  34          HB2       ASN  34   4.752  -1.495  12.645
  299   2HB   ASN  34          HB1       ASN  34   3.668  -0.352  11.860
  300   1HD2  ASN  34          HD21      ASN  34   3.273  -0.697  14.437
  301   2HD2  ASN  34          HD22      ASN  34   1.874  -1.661  14.752
  302    H    TRP  35           HN       TRP  35   5.090  -2.541   8.491
  303    HA   TRP  35           HA       TRP  35   3.972  -0.225   7.213
  304   1HB   TRP  35          HB2       TRP  35   6.476   0.004   8.561
  305   2HB   TRP  35          HB1       TRP  35   6.767   0.113   6.830
  306    HD1  TRP  35           HD1      TRP  35   4.660   1.883   5.671
  307    HE1  TRP  35           HE1      TRP  35   4.216   4.290   6.465
  308    HE3  TRP  35           HE3      TRP  35   6.743   1.597  10.331
  309    HZ2  TRP  35           HZ2      TRP  35   4.687   5.860   8.764
  310    HZ3  TRP  35           HZ3      TRP  35   6.705   3.595  11.764
  311    HH2  TRP  35           HH2      TRP  35   5.698   5.683  10.995
  312    H    LEU  36           HN       LEU  36   5.041   0.081   4.980
  313    HA   LEU  36           HA       LEU  36   6.341  -2.140   3.761
  314   1HB   LEU  36          HB2       LEU  36   4.639  -3.128   2.549
  315   2HB   LEU  36          HB1       LEU  36   3.865  -2.838   4.095
  316    HG   LEU  36           HG       LEU  36   3.173  -0.570   2.854
  317   1HD1  LEU  36          HD11      LEU  36   2.435  -1.477   0.510
  318   2HD1  LEU  36          HD12      LEU  36   3.840  -2.524   0.718
  319   3HD1  LEU  36          HD13      LEU  36   4.033  -0.771   0.755
  320   1HD2  LEU  36          HD21      LEU  36   1.295  -1.551   3.568
  321   2HD2  LEU  36          HD22      LEU  36   1.938  -3.171   3.299
  322   3HD2  LEU  36          HD23      LEU  36   1.207  -2.280   1.965
  323    H    GLU  37           HN       GLU  37   6.673  -1.748   1.415
  324    HA   GLU  37           HA       GLU  37   6.539   1.137   0.840
  325   1HB   GLU  37          HB2       GLU  37   8.808   0.165   0.970
  326   2HB   GLU  37          HB1       GLU  37   8.398  -0.934  -0.340
  327   1HG   GLU  37          HG2       GLU  37   8.622   0.651  -1.920
  328   2HG   GLU  37          HG1       GLU  37   7.970   1.924  -0.890
  329    H    GLY  38           HN       GLY  38   5.910   1.871  -1.208
  330   1HA   GLY  38          HA2       GLY  38   5.091   0.059  -3.271
  331   2HA   GLY  38          HA1       GLY  38   3.722   0.707  -2.381
  332    H    GLU  39           HN       GLU  39   4.261   1.108  -5.152
  333    HA   GLU  39           HA       GLU  39   4.226   4.013  -5.177
  334   1HB   GLU  39          HB2       GLU  39   5.782   3.740  -7.333
  335   2HB   GLU  39          HB1       GLU  39   6.436   4.028  -5.727
  336   1HG   GLU  39          HG2       GLU  39   7.603   2.255  -7.010
  337   2HG   GLU  39          HG1       GLU  39   6.975   1.727  -5.449
  338    H    HIS  40           HN       HIS  40   3.352   4.901  -7.146
  339    HA   HIS  40           HA       HIS  40   2.079   2.981  -8.951
  340   1HB   HIS  40          HB2       HIS  40  -0.091   4.073  -8.756
  341   2HB   HIS  40          HB1       HIS  40   0.432   3.484  -7.182
  342    HD1  HIS  40           HD1      HIS  40   1.568   5.428  -5.617
  343    HD2  HIS  40           HD2      HIS  40  -0.842   6.677  -8.762
  344    HE1  HIS  40           HE1      HIS  40   0.947   7.806  -5.084
  345    HE2  HIS  40           HE2      HIS  40  -0.570   8.517  -6.965
  346    H    HIS  41           HN       HIS  41   2.420   3.556 -10.985
  347    HA   HIS  41           HA       HIS  41   2.972   4.772 -12.826
  348   1HB   HIS  41          HB2       HIS  41   0.698   5.775 -12.071
  349   2HB   HIS  41          HB1       HIS  41   1.658   7.162 -11.568
  350    HD1  HIS  41           HD1      HIS  41   2.439   5.233 -14.695
  351    HD2  HIS  41           HD2      HIS  41   0.703   8.835 -13.566
  352    HE1  HIS  41           HE1      HIS  41   2.167   6.543 -16.823
  353    HE2  HIS  41           HE2      HIS  41   1.033   8.683 -16.127
  354    H    GLY  42           HN       GLY  42   4.943   4.673 -10.804
  355   1HA   GLY  42          HA2       GLY  42   7.089   5.587 -10.720
  356   2HA   GLY  42          HA1       GLY  42   6.497   6.997 -11.582
  357    H    ARG  43           HN       ARG  43   4.256   6.819  -9.329
  358    HA   ARG  43           HA       ARG  43   5.600   8.737  -7.622
  359   1HB   ARG  43          HB2       ARG  43   3.038   8.563  -8.538
  360   2HB   ARG  43          HB1       ARG  43   2.863   7.894  -6.921
  361   1HG   ARG  43          HG2       ARG  43   4.295  10.485  -7.340
  362   2HG   ARG  43          HG1       ARG  43   2.532  10.426  -7.286
  363   1HD   ARG  43          HD2       ARG  43   2.482   9.851  -5.071
  364   2HD   ARG  43          HD1       ARG  43   4.050   9.050  -5.131
  365    HE   ARG  43           HE       ARG  43   5.043  11.034  -4.580
  366   1HH1  ARG  43          HH11      ARG  43   1.783  11.674  -5.649
  367   2HH1  ARG  43          HH12      ARG  43   1.835  13.348  -5.211
  368   1HH2  ARG  43          HH21      ARG  43   5.112  13.237  -4.004
  369   2HH2  ARG  43          HH22      ARG  43   3.724  14.236  -4.277
  370    H    LEU  44           HN       LEU  44   5.888   8.521  -5.392
  371    HA   LEU  44           HA       LEU  44   6.041   5.745  -4.490
  372   1HB   LEU  44          HB2       LEU  44   7.399   8.283  -3.704
  373   2HB   LEU  44          HB1       LEU  44   7.297   6.976  -2.538
  374    HG   LEU  44           HG       LEU  44   8.188   5.911  -5.031
  375   1HD1  LEU  44          HD11      LEU  44   9.343   8.521  -4.278
  376   2HD1  LEU  44          HD12      LEU  44   9.238   7.736  -5.853
  377   3HD1  LEU  44          HD13      LEU  44  10.486   7.249  -4.707
  378   1HD2  LEU  44          HD21      LEU  44   9.614   4.781  -3.696
  379   2HD2  LEU  44          HD22      LEU  44   8.572   5.404  -2.416
  380   3HD2  LEU  44          HD23      LEU  44  10.086   6.224  -2.798
  381    H    GLY  45           HN       GLY  45   5.040   4.972  -2.710
  382   1HA   GLY  45          HA2       GLY  45   3.538   6.739  -0.964
  383   2HA   GLY  45          HA1       GLY  45   2.565   5.668  -1.959
  384    H    ILE  46           HN       ILE  46   3.715   5.993   1.030
  385    HA   ILE  46           HA       ILE  46   4.108   3.096   1.404
  386    HB   ILE  46           HB       ILE  46   5.165   5.389   3.062
  387   1HG1  ILE  46          HG12      ILE  46   6.588   3.348   1.340
  388   2HG1  ILE  46          HG11      ILE  46   6.335   5.040   0.924
  389   1HG2  ILE  46          HG21      ILE  46   4.772   2.595   3.718
  390   2HG2  ILE  46          HG22      ILE  46   5.219   3.945   4.755
  391   3HG2  ILE  46          HG23      ILE  46   6.461   3.076   3.856
  392   1HD1  ILE  46          HD11      ILE  46   7.555   5.204   3.365
  393   2HD1  ILE  46          HD12      ILE  46   8.348   5.369   1.799
  394   3HD1  ILE  46          HD13      ILE  46   8.342   3.810   2.625
  395    H    PHE  47           HN       PHE  47   3.075   2.075   3.122
  396    HA   PHE  47           HA       PHE  47   1.343   3.515   4.910
  397   1HB   PHE  47          HB2       PHE  47  -0.706   2.224   4.140
  398   2HB   PHE  47          HB1       PHE  47  -0.172   3.518   3.073
  399    HD1  PHE  47           HD1      PHE  47   1.381   2.821   1.120
  400    HD2  PHE  47           HD2      PHE  47  -1.080   0.113   3.293
  401    HE1  PHE  47           HE1      PHE  47   1.486   1.229  -0.753
  402    HE2  PHE  47           HE2      PHE  47  -0.979  -1.484   1.424
  403    HZ   PHE  47           HZ       PHE  47   0.306  -0.928  -0.602
  404    HA   PRO  48           HA       PRO  48   2.041   0.041   7.520
  405   1HB   PRO  48          HB2       PRO  48  -0.442  -0.396   8.624
  406   2HB   PRO  48          HB1       PRO  48   0.675   0.867   9.151
  407   1HG   PRO  48          HG2       PRO  48  -1.677   1.063   7.313
  408   2HG   PRO  48          HG1       PRO  48  -1.155   2.179   8.589
  409   1HD   PRO  48          HD2       PRO  48  -0.674   2.686   6.000
  410   2HD   PRO  48          HD1       PRO  48   0.496   3.121   7.262
  411    H    ALA  49           HN       ALA  49   2.229  -2.076   7.166
  412    HA   ALA  49           HA       ALA  49   0.923  -3.340   4.997
  413   1HB   ALA  49          HB1       ALA  49   2.138  -5.321   5.635
  414   2HB   ALA  49          HB2       ALA  49   2.485  -4.639   7.224
  415   3HB   ALA  49          HB3       ALA  49   3.195  -3.917   5.780
  416    H    ASN  50           HN       ASN  50   0.206  -3.118   8.387
  417    HA   ASN  50           HA       ASN  50  -1.502  -5.381   8.554
  418   1HB   ASN  50          HB2       ASN  50  -0.945  -2.998  10.259
  419   2HB   ASN  50          HB1       ASN  50  -2.402  -3.933  10.582
  420   1HD2  ASN  50          HD21      ASN  50  -2.225  -6.031  11.334
  421   2HD2  ASN  50          HD22      ASN  50  -0.746  -6.667  11.962
  422    H    TYR  51           HN       TYR  51  -1.895  -2.437   6.970
  423    HA   TYR  51           HA       TYR  51  -4.827  -2.696   7.073
  424   1HB   TYR  51          HB2       TYR  51  -3.153  -0.229   6.560
  425   2HB   TYR  51          HB1       TYR  51  -4.909  -0.291   6.454
  426    HD1  TYR  51           HD2      TYR  51  -2.235  -1.235   8.899
  427    HD2  TYR  51           HD1      TYR  51  -6.067   0.505   8.276
  428    HE1  TYR  51           HE2      TYR  51  -2.391  -0.734  11.302
  429    HE2  TYR  51           HE1      TYR  51  -6.233   1.012  10.677
  430    HH   TYR  51           HH       TYR  51  -4.050  -0.279  12.985
  431    H    VAL  52           HN       VAL  52  -3.558  -4.367   5.373
  432    HA   VAL  52           HA       VAL  52  -4.491  -3.405   2.802
  433    HB   VAL  52           HB       VAL  52  -2.135  -2.694   2.809
  434   1HG1  VAL  52          HG11      VAL  52  -0.545  -3.938   3.726
  435   2HG1  VAL  52          HG12      VAL  52  -0.826  -5.204   2.531
  436   3HG1  VAL  52          HG13      VAL  52  -1.724  -5.210   4.049
  437   1HG2  VAL  52          HG21      VAL  52  -1.565  -3.548   0.673
  438   2HG2  VAL  52          HG22      VAL  52  -3.327  -3.501   0.739
  439   3HG2  VAL  52          HG23      VAL  52  -2.477  -5.032   0.946
  440    H    GLU  53           HN       GLU  53  -4.654  -5.119   1.199
  441    HA   GLU  53           HA       GLU  53  -4.728  -7.802   2.417
  442   1HB   GLU  53          HB2       GLU  53  -6.761  -6.323   0.832
  443   2HB   GLU  53          HB1       GLU  53  -6.604  -8.046   0.520
  444   1HG   GLU  53          HG2       GLU  53  -7.885  -8.450   2.271
  445   2HG   GLU  53          HG1       GLU  53  -6.647  -7.750   3.312
  446    H    VAL  54           HN       VAL  54  -3.502  -9.265   1.438
  447    HA   VAL  54           HA       VAL  54  -2.203  -8.622  -1.064
  448    HB   VAL  54           HB       VAL  54  -1.961 -11.174   0.530
  449   1HG1  VAL  54          HG11      VAL  54  -0.208  -9.871  -1.546
  450   2HG1  VAL  54          HG12      VAL  54  -1.087 -11.393  -1.692
  451   3HG1  VAL  54          HG13      VAL  54   0.269 -11.261  -0.571
  452   1HG2  VAL  54          HG21      VAL  54  -0.288  -8.672   0.751
  453   2HG2  VAL  54          HG22      VAL  54  -0.029 -10.184   1.621
  454   3HG2  VAL  54          HG23      VAL  54  -1.470  -9.219   1.940
  455    H    LEU  55           HN       LEU  55  -3.030  -9.110  -2.977
  456    HA   LEU  55           HA       LEU  55  -4.084 -11.682  -3.584
  457   1HB   LEU  55          HB2       LEU  55  -6.356 -10.928  -4.238
  458   2HB   LEU  55          HB1       LEU  55  -6.072 -10.895  -2.508
  459    HG   LEU  55           HG       LEU  55  -5.526  -8.350  -3.881
  460   1HD1  LEU  55          HD11      LEU  55  -8.406  -8.895  -3.448
  461   2HD1  LEU  55          HD12      LEU  55  -7.665  -9.541  -4.912
  462   3HD1  LEU  55          HD13      LEU  55  -7.613  -7.808  -4.589
  463   1HD2  LEU  55          HD21      LEU  55  -7.272  -8.961  -1.507
  464   2HD2  LEU  55          HD22      LEU  55  -6.512  -7.427  -1.932
  465   3HD2  LEU  55          HD23      LEU  55  -5.520  -8.785  -1.401
  466    HA   PRO  56           HA       PRO  56  -2.071  -9.104  -6.980
  467   1HB   PRO  56          HB2       PRO  56  -1.145 -11.879  -7.551
  468   2HB   PRO  56          HB1       PRO  56  -0.249 -10.358  -7.622
  469   1HG   PRO  56          HG2       PRO  56   0.115 -12.048  -5.600
  470   2HG   PRO  56          HG1       PRO  56   0.088 -10.296  -5.326
  471   1HD   PRO  56          HD2       PRO  56  -2.008 -12.340  -4.744
  472   2HD   PRO  56          HD1       PRO  56  -1.570 -10.879  -3.835
  473    H    LEU  57           HN       LEU  57  -3.631  -8.656  -8.419
  474    HA   LEU  57           HA       LEU  57  -5.190 -10.842  -9.584
  475   1HB   LEU  57          HB2       LEU  57  -5.636  -7.907 -10.055
  476   2HB   LEU  57          HB1       LEU  57  -6.776  -9.224 -10.252
  477    HG   LEU  57           HG       LEU  57  -6.303  -9.456  -7.616
  478   1HD1  LEU  57          HD11      LEU  57  -5.639  -6.644  -8.366
  479   2HD1  LEU  57          HD12      LEU  57  -4.876  -7.702  -7.179
  480   3HD1  LEU  57          HD13      LEU  57  -6.447  -6.978  -6.834
  481   1HD2  LEU  57          HD21      LEU  57  -8.511  -9.344  -8.236
  482   2HD2  LEU  57          HD22      LEU  57  -8.285  -7.873  -9.181
  483   3HD2  LEU  57          HD23      LEU  57  -8.316  -7.793  -7.419
  484    H    GLU  58           HN       GLU  58  -3.562 -11.666 -10.961
  485    HA   GLU  58           HA       GLU  58  -2.146 -10.110 -12.840
  486   1HB   GLU  58          HB2       GLU  58  -1.610 -12.240 -13.922
  487   2HB   GLU  58          HB1       GLU  58  -1.415 -12.348 -12.179
  488   1HG   GLU  58          HG2       GLU  58  -2.825 -14.045 -12.073
  489   2HG   GLU  58          HG1       GLU  58  -4.077 -13.111 -12.890
  Start of MODEL    5
    1   1H    MET   0          HT1       MET   0   3.209  -8.367  -9.696
    2   2H    MET   0          HT2       MET   0   4.460  -8.878 -10.753
    3   3H    MET   0          HT3       MET   0   4.844  -8.275  -9.193
    4    HA   MET   0           HA       MET   0   3.592 -10.812  -9.946
    5   1HB   MET   0          HB2       MET   0   6.044 -10.651  -9.843
    6   2HB   MET   0          HB1       MET   0   5.939 -10.034  -8.200
    7   1HG   MET   0          HG2       MET   0   6.268 -12.163  -7.619
    8   2HG   MET   0          HG1       MET   0   4.549 -12.343  -7.966
    9   1HE   MET   0          HE1       MET   0   7.750 -14.816  -9.622
   10   2HE   MET   0          HE2       MET   0   6.846 -14.851  -8.109
   11   3HE   MET   0          HE3       MET   0   7.939 -13.510  -8.452
   12    H    LYS   1           HN       LYS   1   3.785  -8.333  -7.490
   13    HA   LYS   1           HA       LYS   1   1.823  -9.838  -5.897
   14   1HB   LYS   1          HB2       LYS   1   4.293  -9.664  -5.001
   15   2HB   LYS   1          HB1       LYS   1   3.791  -8.044  -4.535
   16   1HG   LYS   1          HG2       LYS   1   2.275  -8.813  -2.982
   17   2HG   LYS   1          HG1       LYS   1   2.109 -10.385  -3.768
   18   1HD   LYS   1          HD2       LYS   1   4.737 -10.419  -3.108
   19   2HD   LYS   1          HD1       LYS   1   4.076  -9.454  -1.786
   20   1HE   LYS   1          HE2       LYS   1   2.603 -11.185  -1.134
   21   2HE   LYS   1          HE1       LYS   1   2.885 -12.085  -2.624
   22   1HZ   LYS   1          HZ1       LYS   1   4.072 -12.733  -0.394
   23   2HZ   LYS   1          HZ2       LYS   1   5.176 -11.548  -0.882
   24   3HZ   LYS   1          HZ3       LYS   1   4.869 -12.878  -1.880
   25    H    ALA   2           HN       ALA   2   0.006  -8.725  -6.330
   26    HA   ALA   2           HA       ALA   2   0.067  -5.807  -5.904
   27   1HB   ALA   2          HB1       ALA   2  -0.522  -5.820  -8.094
   28   2HB   ALA   2          HB2       ALA   2  -2.127  -6.062  -7.404
   29   3HB   ALA   2          HB3       ALA   2  -1.213  -7.441  -8.014
   30    H    ALA   3           HN       ALA   3  -1.682  -4.863  -4.814
   31    HA   ALA   3           HA       ALA   3  -3.659  -6.653  -3.614
   32   1HB   ALA   3          HB1       ALA   3  -3.221  -5.419  -1.395
   33   2HB   ALA   3          HB2       ALA   3  -1.656  -5.017  -2.102
   34   3HB   ALA   3          HB3       ALA   3  -2.114  -6.705  -1.876
   35    H    ARG   4           HN       ARG   4  -5.592  -5.667  -3.056
   36    HA   ARG   4           HA       ARG   4  -5.906  -2.924  -4.064
   37   1HB   ARG   4          HB2       ARG   4  -7.244  -4.878  -5.050
   38   2HB   ARG   4          HB1       ARG   4  -8.144  -4.870  -3.540
   39   1HG   ARG   4          HG2       ARG   4  -8.801  -2.548  -3.948
   40   2HG   ARG   4          HG1       ARG   4  -7.909  -2.569  -5.470
   41   1HD   ARG   4          HD2       ARG   4  -9.584  -3.583  -6.534
   42   2HD   ARG   4          HD1       ARG   4  -9.736  -4.806  -5.273
   43    HE   ARG   4           HE       ARG   4 -11.327  -2.433  -5.590
   44   1HH1  ARG   4          HH11      ARG   4 -10.183  -4.827  -3.322
   45   2HH1  ARG   4          HH12      ARG   4 -11.499  -4.593  -2.221
   46   1HH2  ARG   4          HH21      ARG   4 -13.059  -2.125  -4.142
   47   2HH2  ARG   4          HH22      ARG   4 -13.132  -3.061  -2.687
   48    H    LEU   5           HN       LEU   5  -6.088  -1.374  -2.604
   49    HA   LEU   5           HA       LEU   5  -6.472  -1.922   0.168
   50   1HB   LEU   5          HB2       LEU   5  -5.961   0.454  -1.510
   51   2HB   LEU   5          HB1       LEU   5  -6.813   0.762  -0.009
   52    HG   LEU   5           HG       LEU   5  -4.490   1.096   0.403
   53   1HD1  LEU   5          HD11      LEU   5  -4.130  -0.320   2.236
   54   2HD1  LEU   5          HD12      LEU   5  -5.024  -1.647   1.495
   55   3HD1  LEU   5          HD13      LEU   5  -5.883  -0.220   2.074
   56   1HD2  LEU   5          HD21      LEU   5  -4.149  -1.543  -0.982
   57   2HD2  LEU   5          HD22      LEU   5  -2.907  -0.882   0.081
   58   3HD2  LEU   5          HD23      LEU   5  -3.401   0.009  -1.359
   59    H    LYS   6           HN       LYS   6  -8.164  -1.002   1.511
   60    HA   LYS   6           HA       LYS   6 -10.633  -0.219   0.239
   61   1HB   LYS   6          HB2       LYS   6 -11.989  -2.014   1.002
   62   2HB   LYS   6          HB1       LYS   6 -10.611  -2.740   0.187
   63   1HG   LYS   6          HG2       LYS   6  -9.554  -3.111   2.387
   64   2HG   LYS   6          HG1       LYS   6 -11.010  -2.479   3.157
   65   1HD   LYS   6          HD2       LYS   6 -11.620  -4.651   3.195
   66   2HD   LYS   6          HD1       LYS   6 -12.087  -4.341   1.522
   67   1HE   LYS   6          HE2       LYS   6  -9.474  -5.506   2.476
   68   2HE   LYS   6          HE1       LYS   6 -10.773  -6.372   1.659
   69   1HZ   LYS   6          HZ1       LYS   6  -8.922  -4.358   0.552
   70   2HZ   LYS   6          HZ2       LYS   6 -10.399  -4.684  -0.203
   71   3HZ   LYS   6          HZ3       LYS   6  -9.256  -5.916  -0.017
   72    H    PHE   7           HN       PHE   7  -8.651   0.788   2.225
   73    HA   PHE   7           HA       PHE   7 -10.601   1.520   4.282
   74   1HB   PHE   7          HB2       PHE   7  -7.747   0.779   4.948
   75   2HB   PHE   7          HB1       PHE   7  -9.027   1.205   6.079
   76    HD1  PHE   7           HD1      PHE   7 -10.852  -0.364   6.535
   77    HD2  PHE   7           HD2      PHE   7  -7.585  -1.411   4.019
   78    HE1  PHE   7           HE1      PHE   7 -11.459  -2.739   6.743
   79    HE2  PHE   7           HE2      PHE   7  -8.186  -3.786   4.220
   80    HZ   PHE   7           HZ       PHE   7 -10.125  -4.455   5.584
   81    H    ASP   8           HN       ASP   8 -10.807   3.555   3.362
   82    HA   ASP   8           HA       ASP   8  -8.886   5.243   2.395
   83   1HB   ASP   8          HB2       ASP   8 -10.370   7.109   3.023
   84   2HB   ASP   8          HB1       ASP   8 -11.269   5.770   2.317
   85    H    PHE   9           HN       PHE   9  -6.932   5.258   3.423
   86    HA   PHE   9           HA       PHE   9  -6.874   6.158   6.221
   87   1HB   PHE   9          HB2       PHE   9  -5.597   4.028   5.076
   88   2HB   PHE   9          HB1       PHE   9  -4.347   5.265   5.001
   89    HD1  PHE   9           HD2      PHE   9  -6.927   4.228   7.497
   90    HD2  PHE   9           HD1      PHE   9  -2.842   5.130   6.714
   91    HE1  PHE   9           HE2      PHE   9  -6.386   3.815   9.862
   92    HE2  PHE   9           HE1      PHE   9  -2.294   4.717   9.077
   93    HZ   PHE   9           HZ       PHE   9  -4.067   4.060  10.654
   94    H    GLN  10           HN       GLN  10  -5.642   7.913   6.844
   95    HA   GLN  10           HA       GLN  10  -4.852   9.706   4.654
   96   1HB   GLN  10          HB2       GLN  10  -6.546  10.248   6.654
   97   2HB   GLN  10          HB1       GLN  10  -5.044  10.695   7.451
   98   1HG   GLN  10          HG2       GLN  10  -5.810  11.761   4.753
   99   2HG   GLN  10          HG1       GLN  10  -6.306  12.535   6.258
  100   1HE2  GLN  10          HE21      GLN  10  -4.079  12.610   3.875
  101   2HE2  GLN  10          HE22      GLN  10  -2.767  13.359   4.712
  102    H    ALA  11           HN       ALA  11  -2.781  10.231   4.355
  103    HA   ALA  11           HA       ALA  11  -0.719   8.942   5.797
  104   1HB   ALA  11          HB1       ALA  11  -0.544  11.267   3.883
  105   2HB   ALA  11          HB2       ALA  11  -0.468   9.558   3.454
  106   3HB   ALA  11          HB3       ALA  11   0.810  10.279   4.431
  107    H    GLN  12           HN       GLN  12   0.521   9.584   7.469
  108    HA   GLN  12           HA       GLN  12  -0.213  12.072   8.801
  109   1HB   GLN  12          HB2       GLN  12   1.317  11.035  10.621
  110   2HB   GLN  12          HB1       GLN  12  -0.279  10.353  10.358
  111   1HG   GLN  12          HG2       GLN  12   0.539   8.406   9.548
  112   2HG   GLN  12          HG1       GLN  12   1.949   9.173   8.819
  113   1HE2  GLN  12          HE21      GLN  12   1.992   6.780  10.311
  114   2HE2  GLN  12          HE22      GLN  12   2.934   7.054  11.733
  115    H    SER  13           HN       SER  13   2.572  10.428   7.408
  116    HA   SER  13           HA       SER  13   4.245  12.771   7.960
  117   1HB   SER  13          HB2       SER  13   4.781   9.894   7.473
  118   2HB   SER  13          HB1       SER  13   5.969  11.031   6.835
  119    HG   SER  13           HG       SER  13   5.038  11.031   9.515
  120    HA   PRO  14           HA       PRO  14   4.020  14.397   3.871
  121   1HB   PRO  14          HB2       PRO  14   6.979  14.667   4.016
  122   2HB   PRO  14          HB1       PRO  14   5.752  15.892   3.673
  123   1HG   PRO  14          HG2       PRO  14   6.980  15.824   6.035
  124   2HG   PRO  14          HG1       PRO  14   5.253  16.210   5.916
  125   1HD   PRO  14          HD2       PRO  14   6.575  13.670   6.771
  126   2HD   PRO  14          HD1       PRO  14   5.108  14.447   7.400
  127    H    LYS  15           HN       LYS  15   6.333  11.881   4.634
  128    HA   LYS  15           HA       LYS  15   6.840  11.244   1.858
  129   1HB   LYS  15          HB2       LYS  15   8.243   9.450   2.732
  130   2HB   LYS  15          HB1       LYS  15   8.615  10.972   3.529
  131   1HG   LYS  15          HG2       LYS  15   8.399   9.905   5.458
  132   2HG   LYS  15          HG1       LYS  15   6.668   9.813   5.132
  133   1HD   LYS  15          HD2       LYS  15   7.550   7.610   5.659
  134   2HD   LYS  15          HD1       LYS  15   7.012   7.671   3.980
  135   1HE   LYS  15          HE2       LYS  15   9.234   6.529   4.422
  136   2HE   LYS  15          HE1       LYS  15   9.218   7.766   3.167
  137   1HZ   LYS  15          HZ1       LYS  15  10.499   9.154   4.388
  138   2HZ   LYS  15          HZ2       LYS  15  11.039   7.701   5.064
  139   3HZ   LYS  15          HZ3       LYS  15   9.880   8.629   5.874
  140    H    GLU  16           HN       GLU  16   4.745  10.166   4.422
  141    HA   GLU  16           HA       GLU  16   4.064   7.624   3.510
  142   1HB   GLU  16          HB2       GLU  16   2.820   9.653   5.260
  143   2HB   GLU  16          HB1       GLU  16   1.716   8.470   4.573
  144   1HG   GLU  16          HG2       GLU  16   3.810   6.925   5.455
  145   2HG   GLU  16          HG1       GLU  16   3.690   8.181   6.685
  146    H    LEU  17           HN       LEU  17   1.612   7.219   2.823
  147    HA   LEU  17           HA       LEU  17   1.026   8.959   0.521
  148   1HB   LEU  17          HB2       LEU  17   2.110   6.559   0.166
  149   2HB   LEU  17          HB1       LEU  17   0.444   6.046   0.345
  150    HG   LEU  17           HG       LEU  17   0.915   6.278  -1.992
  151   1HD1  LEU  17          HD11      LEU  17  -1.232   7.324  -0.837
  152   2HD1  LEU  17          HD12      LEU  17  -0.957   7.425  -2.576
  153   3HD1  LEU  17          HD13      LEU  17  -0.574   8.801  -1.542
  154   1HD2  LEU  17          HD21      LEU  17   1.484   8.633  -2.844
  155   2HD2  LEU  17          HD22      LEU  17   2.779   7.669  -2.134
  156   3HD2  LEU  17          HD23      LEU  17   2.014   8.950  -1.192
  157    H    THR  18           HN       THR  18  -1.058   9.527   0.256
  158    HA   THR  18           HA       THR  18  -3.006   8.378   2.139
  159    HB   THR  18           HB       THR  18  -3.034  11.064   0.747
  160    HG1  THR  18           HG1      THR  18  -1.900  11.678   2.379
  161   1HG2  THR  18          HG21      THR  18  -5.120  11.372   1.400
  162   2HG2  THR  18          HG22      THR  18  -4.722  10.892   3.050
  163   3HG2  THR  18          HG23      THR  18  -5.185   9.672   1.863
  164    H    LEU  19           HN       LEU  19  -4.553   7.134   1.330
  165    HA   LEU  19           HA       LEU  19  -5.595   7.672  -1.344
  166   1HB   LEU  19          HB2       LEU  19  -5.488   5.247  -1.906
  167   2HB   LEU  19          HB1       LEU  19  -3.926   6.039  -1.822
  168    HG   LEU  19           HG       LEU  19  -4.930   4.610   0.597
  169   1HD1  LEU  19          HD11      LEU  19  -3.551   2.631  -0.478
  170   2HD1  LEU  19          HD12      LEU  19  -4.136   3.357  -1.975
  171   3HD1  LEU  19          HD13      LEU  19  -5.284   2.809  -0.754
  172   1HD2  LEU  19          HD21      LEU  19  -2.226   5.113  -0.634
  173   2HD2  LEU  19          HD22      LEU  19  -2.493   4.135   0.809
  174   3HD2  LEU  19          HD23      LEU  19  -2.895   5.852   0.820
  175    H    GLN  20           HN       GLN  20  -7.649   6.647  -1.761
  176    HA   GLN  20           HA       GLN  20  -9.164   6.246   0.716
  177   1HB   GLN  20          HB2       GLN  20  -9.718   7.928  -1.274
  178   2HB   GLN  20          HB1       GLN  20 -10.513   6.503  -1.927
  179   1HG   GLN  20          HG2       GLN  20 -11.589   6.387   0.455
  180   2HG   GLN  20          HG1       GLN  20 -11.167   8.098   0.498
  181   1HE2  GLN  20          HE21      GLN  20 -12.916   5.653  -1.335
  182   2HE2  GLN  20          HE22      GLN  20 -14.076   6.734  -2.021
  183    H    LYS  21           HN       LYS  21 -10.862   4.608   0.743
  184    HA   LYS  21           HA       LYS  21  -9.978   2.053   0.230
  185   1HB   LYS  21          HB2       LYS  21 -11.756   2.341   1.767
  186   2HB   LYS  21          HB1       LYS  21 -12.753   3.169   0.585
  187   1HG   LYS  21          HG2       LYS  21 -12.227   0.604  -0.457
  188   2HG   LYS  21          HG1       LYS  21 -12.657   0.397   1.240
  189   1HD   LYS  21          HD2       LYS  21 -14.794   1.017   0.902
  190   2HD   LYS  21          HD1       LYS  21 -14.347   2.294  -0.231
  191   1HE   LYS  21          HE2       LYS  21 -14.514   0.935  -2.040
  192   2HE   LYS  21          HE1       LYS  21 -13.976  -0.491  -1.153
  193   1HZ   LYS  21          HZ1       LYS  21 -16.643   0.737  -0.755
  194   2HZ   LYS  21          HZ2       LYS  21 -16.112  -0.781  -0.232
  195   3HZ   LYS  21          HZ3       LYS  21 -16.360  -0.495  -1.880
  196    H    GLY  22           HN       GLY  22 -10.116   0.612  -1.435
  197   1HA   GLY  22          HA2       GLY  22 -11.020  -0.221  -3.474
  198   2HA   GLY  22          HA1       GLY  22 -11.611   1.399  -3.836
  199    H    ASP  23           HN       ASP  23  -8.604   1.979  -2.766
  200    HA   ASP  23           HA       ASP  23  -7.583   2.363  -5.420
  201   1HB   ASP  23          HB2       ASP  23  -7.202   3.816  -3.290
  202   2HB   ASP  23          HB1       ASP  23  -5.924   2.658  -2.935
  203    H    ILE  24           HN       ILE  24  -6.017   1.247  -6.481
  204    HA   ILE  24           HA       ILE  24  -5.050  -1.215  -5.180
  205    HB   ILE  24           HB       ILE  24  -6.569  -1.641  -7.072
  206   1HG1  ILE  24          HG12      ILE  24  -4.348  -2.692  -8.460
  207   2HG1  ILE  24          HG11      ILE  24  -3.882  -2.638  -6.762
  208   1HG2  ILE  24          HG21      ILE  24  -4.639  -0.791  -9.113
  209   2HG2  ILE  24          HG22      ILE  24  -5.437   0.523  -8.248
  210   3HG2  ILE  24          HG23      ILE  24  -6.400  -0.687  -9.097
  211   1HD1  ILE  24          HD11      ILE  24  -6.511  -3.660  -6.884
  212   2HD1  ILE  24          HD12      ILE  24  -5.028  -4.490  -6.412
  213   3HD1  ILE  24          HD13      ILE  24  -5.548  -4.505  -8.097
  214    H    VAL  25           HN       VAL  25  -2.932  -1.377  -4.865
  215    HA   VAL  25           HA       VAL  25  -1.096   0.043  -6.656
  216    HB   VAL  25           HB       VAL  25   0.274   0.790  -4.749
  217   1HG1  VAL  25          HG11      VAL  25  -2.579   1.743  -4.849
  218   2HG1  VAL  25          HG12      VAL  25  -1.178   2.419  -5.679
  219   3HG1  VAL  25          HG13      VAL  25  -1.318   2.560  -3.927
  220   1HG2  VAL  25          HG21      VAL  25  -0.153   0.305  -2.592
  221   2HG2  VAL  25          HG22      VAL  25  -1.081  -1.032  -3.272
  222   3HG2  VAL  25          HG23      VAL  25  -1.899   0.456  -2.795
  223    H    TYR  26           HN       TYR  26   1.036  -0.819  -6.717
  224    HA   TYR  26           HA       TYR  26   1.110  -3.659  -6.087
  225   1HB   TYR  26          HB2       TYR  26   2.638  -1.845  -7.891
  226   2HB   TYR  26          HB1       TYR  26   3.436  -3.309  -7.328
  227    HD1  TYR  26           HD1      TYR  26   0.433  -2.065  -9.118
  228    HD2  TYR  26           HD2      TYR  26   2.953  -5.395  -8.305
  229    HE1  TYR  26           HE1      TYR  26  -0.717  -3.355 -10.867
  230    HE2  TYR  26           HE2      TYR  26   1.811  -6.694 -10.052
  231    HH   TYR  26           HH       TYR  26  -1.014  -6.130 -11.213
  232    H    ILE  27           HN       ILE  27   2.515  -4.621  -4.693
  233    HA   ILE  27           HA       ILE  27   3.697  -2.930  -2.674
  234    HB   ILE  27           HB       ILE  27   3.705  -5.943  -2.914
  235   1HG1  ILE  27          HG12      ILE  27   2.000  -5.672  -1.008
  236   2HG1  ILE  27          HG11      ILE  27   1.874  -3.994  -1.523
  237   1HG2  ILE  27          HG21      ILE  27   5.363  -5.697  -1.397
  238   2HG2  ILE  27          HG22      ILE  27   4.010  -5.462  -0.290
  239   3HG2  ILE  27          HG23      ILE  27   4.861  -4.066  -0.952
  240   1HD1  ILE  27          HD11      ILE  27   0.892  -4.556  -3.539
  241   2HD1  ILE  27          HD12      ILE  27   0.181  -5.713  -2.412
  242   3HD1  ILE  27          HD13      ILE  27   1.490  -6.214  -3.483
  243    H    HIS  28           HN       HIS  28   5.833  -2.604  -2.272
  244    HA   HIS  28           HA       HIS  28   7.711  -3.627  -4.295
  245   1HB   HIS  28          HB2       HIS  28   7.190  -1.029  -3.710
  246   2HB   HIS  28          HB1       HIS  28   8.537  -1.337  -2.620
  247    HD1  HIS  28           HD1      HIS  28   8.225  -2.830  -6.072
  248    HD2  HIS  28           HD2      HIS  28  10.462   0.025  -4.044
  249    HE1  HIS  28           HE1      HIS  28  10.062  -2.166  -7.655
  250    HE2  HIS  28           HE2      HIS  28  11.335  -0.358  -6.448
  251    H    LYS  29           HN       LYS  29   7.268  -3.000  -0.847
  252    HA   LYS  29           HA       LYS  29   9.184  -5.118  -0.259
  253   1HB   LYS  29          HB2       LYS  29  10.356  -3.768   1.423
  254   2HB   LYS  29          HB1       LYS  29  10.543  -3.090  -0.188
  255   1HG   LYS  29          HG2       LYS  29   9.684  -1.157   0.458
  256   2HG   LYS  29          HG1       LYS  29   8.246  -1.951   1.102
  257   1HD   LYS  29          HD2       LYS  29   9.599  -2.504   3.149
  258   2HD   LYS  29          HD1       LYS  29  10.863  -1.453   2.509
  259   1HE   LYS  29          HE2       LYS  29   8.920   0.283   2.324
  260   2HE   LYS  29          HE1       LYS  29   8.139  -0.753   3.518
  261   1HZ   LYS  29          HZ1       LYS  29   9.900  -0.395   5.037
  262   2HZ   LYS  29          HZ2       LYS  29   9.470   1.129   4.444
  263   3HZ   LYS  29          HZ3       LYS  29  10.865   0.362   3.871
  264    H    GLU  30           HN       GLU  30   8.886  -6.078   1.791
  265    HA   GLU  30           HA       GLU  30   6.331  -5.361   3.068
  266   1HB   GLU  30          HB2       GLU  30   6.809  -7.680   1.829
  267   2HB   GLU  30          HB1       GLU  30   7.442  -8.083   3.419
  268   1HG   GLU  30          HG2       GLU  30   5.230  -7.273   4.349
  269   2HG   GLU  30          HG1       GLU  30   4.650  -7.267   2.684
  270    H    VAL  31           HN       VAL  31   6.839  -4.156   4.751
  271    HA   VAL  31           HA       VAL  31   9.067  -4.897   6.461
  272    HB   VAL  31           HB       VAL  31   7.151  -2.800   7.303
  273   1HG1  VAL  31          HG11      VAL  31  10.069  -2.376   7.252
  274   2HG1  VAL  31          HG12      VAL  31   9.474  -3.658   8.307
  275   3HG1  VAL  31          HG13      VAL  31   8.889  -2.007   8.509
  276   1HG2  VAL  31          HG21      VAL  31   8.196  -1.107   5.876
  277   2HG2  VAL  31          HG22      VAL  31   7.383  -2.336   4.910
  278   3HG2  VAL  31          HG23      VAL  31   9.137  -2.365   5.075
  279    H    ASP  32           HN       ASP  32   8.589  -6.678   7.501
  280    HA   ASP  32           HA       ASP  32   6.085  -7.497   8.437
  281   1HB   ASP  32          HB2       ASP  32   8.047  -8.999   8.118
  282   2HB   ASP  32          HB1       ASP  32   8.779  -8.294   9.557
  283    H    LYS  33           HN       LYS  33   8.239  -5.154   9.693
  284    HA   LYS  33           HA       LYS  33   7.641  -5.326  12.439
  285   1HB   LYS  33          HB2       LYS  33   8.252  -2.807  10.882
  286   2HB   LYS  33          HB1       LYS  33   8.481  -3.067  12.606
  287   1HG   LYS  33          HG2       LYS  33  10.393  -4.262  12.316
  288   2HG   LYS  33          HG1       LYS  33   9.896  -4.888  10.743
  289   1HD   LYS  33          HD2       LYS  33  11.264  -3.377   9.838
  290   2HD   LYS  33          HD1       LYS  33  10.100  -2.151  10.346
  291   1HE   LYS  33          HE2       LYS  33  11.320  -2.121  12.569
  292   2HE   LYS  33          HE1       LYS  33  12.578  -3.072  11.781
  293   1HZ   LYS  33          HZ1       LYS  33  13.268  -1.318  10.558
  294   2HZ   LYS  33          HZ2       LYS  33  12.619  -0.439  11.849
  295   3HZ   LYS  33          HZ3       LYS  33  11.725  -0.636  10.426
  296    H    ASN  34           HN       ASN  34   6.235  -3.315   9.864
  297    HA   ASN  34           HA       ASN  34   3.593  -3.605  10.414
  298   1HB   ASN  34          HB2       ASN  34   3.060  -1.516  11.749
  299   2HB   ASN  34          HB1       ASN  34   3.794  -2.831  12.659
  300   1HD2  ASN  34          HD21      ASN  34   3.725   0.004  13.252
  301   2HD2  ASN  34          HD22      ASN  34   5.370   0.518  13.374
  302    H    TRP  35           HN       TRP  35   5.332  -2.971   8.230
  303    HA   TRP  35           HA       TRP  35   3.788  -0.847   7.054
  304   1HB   TRP  35          HB2       TRP  35   6.287  -0.230   8.262
  305   2HB   TRP  35          HB1       TRP  35   6.487  -0.099   6.519
  306    HD1  TRP  35           HD1      TRP  35   3.441   0.984   6.001
  307    HE1  TRP  35           HE1      TRP  35   2.929   3.439   6.581
  308    HE3  TRP  35           HE3      TRP  35   7.298   1.873   9.233
  309    HZ2  TRP  35           HZ2      TRP  35   4.018   5.482   8.196
  310    HZ3  TRP  35           HZ3      TRP  35   7.493   4.104  10.253
  311    HH2  TRP  35           HH2      TRP  35   5.886   5.870   9.744
  312    H    LEU  36           HN       LEU  36   4.610  -0.368   4.774
  313    HA   LEU  36           HA       LEU  36   6.102  -2.444   3.446
  314   1HB   LEU  36          HB2       LEU  36   4.397  -3.361   2.127
  315   2HB   LEU  36          HB1       LEU  36   3.721  -3.326   3.745
  316    HG   LEU  36           HG       LEU  36   2.890  -0.920   2.747
  317   1HD1  LEU  36          HD11      LEU  36   3.320  -2.791   0.497
  318   2HD1  LEU  36          HD12      LEU  36   3.371  -1.028   0.541
  319   3HD1  LEU  36          HD13      LEU  36   1.818  -1.865   0.513
  320   1HD2  LEU  36          HD21      LEU  36   1.744  -3.139   3.795
  321   2HD2  LEU  36          HD22      LEU  36   1.102  -3.178   2.153
  322   3HD2  LEU  36          HD23      LEU  36   0.842  -1.759   3.167
  323    H    GLU  37           HN       GLU  37   5.940  -1.971   0.932
  324    HA   GLU  37           HA       GLU  37   5.901   0.961   0.625
  325   1HB   GLU  37          HB2       GLU  37   8.169   0.116   0.493
  326   2HB   GLU  37          HB1       GLU  37   7.698  -1.048  -0.738
  327   1HG   GLU  37          HG2       GLU  37   7.676   0.500  -2.388
  328   2HG   GLU  37          HG1       GLU  37   7.152   1.797  -1.317
  329    H    GLY  38           HN       GLY  38   4.816   1.849  -1.022
  330   1HA   GLY  38          HA2       GLY  38   3.858   0.180  -3.218
  331   2HA   GLY  38          HA1       GLY  38   2.636   0.922  -2.194
  332    H    GLU  39           HN       GLU  39   4.174   1.270  -5.037
  333    HA   GLU  39           HA       GLU  39   3.983   4.211  -4.950
  334   1HB   GLU  39          HB2       GLU  39   5.548   3.917  -7.068
  335   2HB   GLU  39          HB1       GLU  39   6.205   3.974  -5.439
  336   1HG   GLU  39          HG2       GLU  39   6.207   1.500  -5.403
  337   2HG   GLU  39          HG1       GLU  39   5.680   1.514  -7.087
  338    H    HIS  40           HN       HIS  40   3.029   5.273  -6.690
  339    HA   HIS  40           HA       HIS  40   1.726   3.610  -8.722
  340   1HB   HIS  40          HB2       HIS  40   0.073   3.968  -6.942
  341   2HB   HIS  40          HB1       HIS  40   0.317   5.707  -7.056
  342    HD1  HIS  40           HD1      HIS  40  -0.259   3.208  -9.864
  343    HD2  HIS  40           HD2      HIS  40  -2.002   6.576  -8.163
  344    HE1  HIS  40           HE1      HIS  40  -2.217   3.769 -11.338
  345    HE2  HIS  40           HE2      HIS  40  -3.287   5.781 -10.262
  346    H    HIS  41           HN       HIS  41   1.926   4.421 -10.702
  347    HA   HIS  41           HA       HIS  41   2.502   5.802 -12.414
  348   1HB   HIS  41          HB2       HIS  41   0.391   6.914 -11.396
  349   2HB   HIS  41          HB1       HIS  41   1.513   8.124 -10.784
  350    HD1  HIS  41           HD1      HIS  41   3.270   8.831 -13.001
  351    HD2  HIS  41           HD2      HIS  41  -0.711   7.845 -13.666
  352    HE1  HIS  41           HE1      HIS  41   2.686   9.855 -15.223
  353    HE2  HIS  41           HE2      HIS  41   0.297   9.173 -15.643
  354    H    GLY  42           HN       GLY  42   4.556   5.259 -10.533
  355   1HA   GLY  42          HA2       GLY  42   6.785   5.933 -10.467
  356   2HA   GLY  42          HA1       GLY  42   6.317   7.474 -11.164
  357    H    ARG  43           HN       ARG  43   4.176   7.327  -8.811
  358    HA   ARG  43           HA       ARG  43   5.761   8.969  -7.046
  359   1HB   ARG  43          HB2       ARG  43   3.257   9.259  -7.719
  360   2HB   ARG  43          HB1       ARG  43   2.957   8.078  -6.452
  361   1HG   ARG  43          HG2       ARG  43   4.639  10.445  -5.814
  362   2HG   ARG  43          HG1       ARG  43   2.893  10.655  -5.962
  363   1HD   ARG  43          HD2       ARG  43   2.746   8.623  -4.377
  364   2HD   ARG  43          HD1       ARG  43   4.436   8.976  -4.018
  365    HE   ARG  43           HE       ARG  43   2.128  10.485  -3.187
  366   1HH1  ARG  43          HH11      ARG  43   5.571  10.576  -3.751
  367   2HH1  ARG  43          HH12      ARG  43   5.837  11.913  -2.684
  368   1HH2  ARG  43          HH21      ARG  43   2.476  12.245  -1.784
  369   2HH2  ARG  43          HH22      ARG  43   4.080  12.862  -1.568
  370    H    LEU  44           HN       LEU  44   6.361   8.503  -4.949
  371    HA   LEU  44           HA       LEU  44   6.343   5.657  -4.273
  372   1HB   LEU  44          HB2       LEU  44   8.482   6.990  -4.343
  373   2HB   LEU  44          HB1       LEU  44   7.901   7.864  -2.937
  374    HG   LEU  44           HG       LEU  44   7.658   5.377  -1.988
  375   1HD1  LEU  44          HD11      LEU  44   9.940   5.216  -3.950
  376   2HD1  LEU  44          HD12      LEU  44   8.434   4.303  -4.025
  377   3HD1  LEU  44          HD13      LEU  44   9.568   4.025  -2.704
  378   1HD2  LEU  44          HD21      LEU  44   9.504   5.830  -0.679
  379   2HD2  LEU  44          HD22      LEU  44   9.061   7.438  -1.251
  380   3HD2  LEU  44          HD23      LEU  44  10.397   6.570  -2.008
  381    H    GLY  45           HN       GLY  45   5.156   4.848  -2.679
  382   1HA   GLY  45          HA2       GLY  45   4.215   6.622  -0.543
  383   2HA   GLY  45          HA1       GLY  45   3.015   5.753  -1.489
  384    H    ILE  46           HN       ILE  46   3.390   5.520   1.317
  385    HA   ILE  46           HA       ILE  46   3.936   2.650   1.457
  386    HB   ILE  46           HB       ILE  46   5.228   4.752   3.181
  387   1HG1  ILE  46          HG12      ILE  46   6.548   2.328   2.012
  388   2HG1  ILE  46          HG11      ILE  46   6.216   3.722   0.989
  389   1HG2  ILE  46          HG21      ILE  46   4.787   3.428   4.942
  390   2HG2  ILE  46          HG22      ILE  46   6.104   2.451   4.294
  391   3HG2  ILE  46          HG23      ILE  46   4.432   2.026   3.936
  392   1HD1  ILE  46          HD11      ILE  46   7.483   5.115   2.627
  393   2HD1  ILE  46          HD12      ILE  46   8.445   3.907   1.773
  394   3HD1  ILE  46          HD13      ILE  46   7.946   3.620   3.441
  395    H    PHE  47           HN       PHE  47   2.792   1.556   3.064
  396    HA   PHE  47           HA       PHE  47   1.107   2.978   4.918
  397   1HB   PHE  47          HB2       PHE  47  -0.996   1.874   4.004
  398   2HB   PHE  47          HB1       PHE  47  -0.357   3.222   3.069
  399    HD1  PHE  47           HD2      PHE  47   0.772   2.824   0.931
  400    HD2  PHE  47           HD1      PHE  47  -1.035  -0.343   3.125
  401    HE1  PHE  47           HE2      PHE  47   0.838   1.401  -1.076
  402    HE2  PHE  47           HE1      PHE  47  -0.972  -1.772   1.123
  403    HZ   PHE  47           HZ       PHE  47  -0.035  -0.900  -0.981
  404    HA   PRO  48           HA       PRO  48   1.472  -0.715   7.280
  405   1HB   PRO  48          HB2       PRO  48  -1.396  -0.583   7.972
  406   2HB   PRO  48          HB1       PRO  48   0.020  -0.487   9.023
  407   1HG   PRO  48          HG2       PRO  48  -1.471   1.673   8.497
  408   2HG   PRO  48          HG1       PRO  48   0.290   1.783   8.675
  409   1HD   PRO  48          HD2       PRO  48  -1.366   1.762   6.179
  410   2HD   PRO  48          HD1       PRO  48   0.060   2.744   6.578
  411    H    ALA  49           HN       ALA  49   1.451  -2.820   6.802
  412    HA   ALA  49           HA       ALA  49   0.020  -3.823   4.573
  413   1HB   ALA  49          HB1       ALA  49   1.925  -5.021   4.802
  414   2HB   ALA  49          HB2       ALA  49   0.871  -6.076   5.742
  415   3HB   ALA  49          HB3       ALA  49   1.913  -4.914   6.562
  416    H    ASN  50           HN       ASN  50  -0.787  -3.527   7.898
  417    HA   ASN  50           HA       ASN  50  -2.657  -5.686   8.018
  418   1HB   ASN  50          HB2       ASN  50  -1.447  -4.490   9.967
  419   2HB   ASN  50          HB1       ASN  50  -2.721  -3.282   9.823
  420   1HD2  ASN  50          HD21      ASN  50  -2.173  -6.744  10.240
  421   2HD2  ASN  50          HD22      ASN  50  -3.583  -7.032  11.195
  422    H    TYR  51           HN       TYR  51  -2.783  -2.382   6.962
  423    HA   TYR  51           HA       TYR  51  -5.707  -2.418   6.907
  424   1HB   TYR  51          HB2       TYR  51  -3.669  -0.349   7.062
  425   2HB   TYR  51          HB1       TYR  51  -4.862   0.002   5.817
  426    HD1  TYR  51           HD1      TYR  51  -7.341  -1.005   6.933
  427    HD2  TYR  51           HD2      TYR  51  -4.138   1.013   8.875
  428    HE1  TYR  51           HE1      TYR  51  -8.901  -0.195   8.652
  429    HE2  TYR  51           HE2      TYR  51  -5.690   1.828  10.600
  430    HH   TYR  51           HH       TYR  51  -9.095   1.560  10.284
  431    H    VAL  52           HN       VAL  52  -4.194  -4.143   5.140
  432    HA   VAL  52           HA       VAL  52  -5.402  -3.299   2.635
  433    HB   VAL  52           HB       VAL  52  -3.150  -2.365   2.461
  434   1HG1  VAL  52          HG11      VAL  52  -2.010  -3.866   4.011
  435   2HG1  VAL  52          HG12      VAL  52  -1.180  -3.807   2.457
  436   3HG1  VAL  52          HG13      VAL  52  -2.188  -5.195   2.866
  437   1HG2  VAL  52          HG21      VAL  52  -2.657  -3.159   0.321
  438   2HG2  VAL  52          HG22      VAL  52  -4.377  -3.501   0.512
  439   3HG2  VAL  52          HG23      VAL  52  -3.195  -4.795   0.703
  440    H    GLU  53           HN       GLU  53  -5.546  -5.035   1.068
  441    HA   GLU  53           HA       GLU  53  -5.464  -7.679   2.359
  442   1HB   GLU  53          HB2       GLU  53  -7.394  -6.357   0.557
  443   2HB   GLU  53          HB1       GLU  53  -7.079  -8.052   0.211
  444   1HG   GLU  53          HG2       GLU  53  -7.852  -7.042   2.933
  445   2HG   GLU  53          HG1       GLU  53  -9.020  -7.584   1.729
  446    H    VAL  54           HN       VAL  54  -4.070  -9.126   1.606
  447    HA   VAL  54           HA       VAL  54  -2.509  -8.536  -0.752
  448    HB   VAL  54           HB       VAL  54  -1.419  -9.459   1.247
  449   1HG1  VAL  54          HG11      VAL  54  -2.033 -11.350   2.301
  450   2HG1  VAL  54          HG12      VAL  54  -2.413 -12.190   0.797
  451   3HG1  VAL  54          HG13      VAL  54  -3.578 -11.067   1.498
  452   1HG2  VAL  54          HG21      VAL  54   0.088 -10.756   0.097
  453   2HG2  VAL  54          HG22      VAL  54  -0.744  -9.959  -1.238
  454   3HG2  VAL  54          HG23      VAL  54  -1.166 -11.614  -0.798
  455    H    LEU  55           HN       LEU  55  -3.197  -9.059  -2.714
  456    HA   LEU  55           HA       LEU  55  -3.894 -11.682  -3.458
  457   1HB   LEU  55          HB2       LEU  55  -6.252 -11.282  -4.116
  458   2HB   LEU  55          HB1       LEU  55  -5.996 -11.295  -2.382
  459    HG   LEU  55           HG       LEU  55  -5.754  -8.611  -3.074
  460   1HD1  LEU  55          HD11      LEU  55  -6.973  -9.715  -5.236
  461   2HD1  LEU  55          HD12      LEU  55  -7.188  -8.048  -4.702
  462   3HD1  LEU  55          HD13      LEU  55  -8.360  -9.280  -4.236
  463   1HD2  LEU  55          HD21      LEU  55  -7.619  -8.311  -1.695
  464   2HD2  LEU  55          HD22      LEU  55  -6.882  -9.803  -1.111
  465   3HD2  LEU  55          HD23      LEU  55  -8.312  -9.871  -2.140
  466    HA   PRO  56           HA       PRO  56  -2.190  -8.969  -6.795
  467   1HB   PRO  56          HB2       PRO  56  -1.495 -11.703  -7.744
  468   2HB   PRO  56          HB1       PRO  56  -0.499 -10.245  -7.683
  469   1HG   PRO  56          HG2       PRO  56  -0.146 -12.206  -5.917
  470   2HG   PRO  56          HG1       PRO  56  -0.020 -10.506  -5.429
  471   1HD   PRO  56          HD2       PRO  56  -2.237 -12.453  -4.968
  472   2HD   PRO  56          HD1       PRO  56  -1.623 -11.167  -3.908
  473    H    LEU  57           HN       LEU  57  -3.071  -8.516  -8.761
  474    HA   LEU  57           HA       LEU  57  -5.240 -10.286  -9.681
  475   1HB   LEU  57          HB2       LEU  57  -4.999  -7.308  -9.567
  476   2HB   LEU  57          HB1       LEU  57  -6.006  -8.042 -10.801
  477    HG   LEU  57           HG       LEU  57  -7.006  -9.319  -8.685
  478   1HD1  LEU  57          HD11      LEU  57  -6.333  -6.647  -7.497
  479   2HD1  LEU  57          HD12      LEU  57  -5.332  -8.073  -7.223
  480   3HD1  LEU  57          HD13      LEU  57  -7.018  -8.067  -6.706
  481   1HD2  LEU  57          HD21      LEU  57  -8.511  -7.114  -8.515
  482   2HD2  LEU  57          HD22      LEU  57  -8.605  -8.240  -9.869
  483   3HD2  LEU  57          HD23      LEU  57  -7.655  -6.761 -10.016
  484    H    GLU  58           HN       GLU  58  -2.422 -10.440 -10.419
  485    HA   GLU  58           HA       GLU  58  -2.690 -10.810 -13.184
  486   1HB   GLU  58          HB2       GLU  58  -2.518  -8.191 -12.813
  487   2HB   GLU  58          HB1       GLU  58  -0.799  -8.549 -12.720
  488   1HG   GLU  58          HG2       GLU  58  -0.659  -8.659 -14.921
  489   2HG   GLU  58          HG1       GLU  58  -1.914  -9.897 -14.975
  Start of MODEL    6
    1   1H    MET   0          HT1       MET   0   4.363  -7.145  -8.805
    2   2H    MET   0          HT2       MET   0   3.412  -8.247  -9.714
    3   3H    MET   0          HT3       MET   0   5.057  -7.984 -10.129
    4    HA   MET   0           HA       MET   0   4.834 -10.042  -9.018
    5   1HB   MET   0          HB2       MET   0   6.675  -8.167  -8.559
    6   2HB   MET   0          HB1       MET   0   6.013  -8.268  -6.933
    7   1HG   MET   0          HG2       MET   0   7.670  -9.810  -6.774
    8   2HG   MET   0          HG1       MET   0   6.351 -10.847  -7.315
    9   1HE   MET   0          HE1       MET   0   7.112 -12.030 -10.650
   10   2HE   MET   0          HE2       MET   0   6.036 -11.880  -9.261
   11   3HE   MET   0          HE3       MET   0   7.503 -12.853  -9.141
   12    H    LYS   1           HN       LYS   1   3.821  -7.366  -6.893
   13    HA   LYS   1           HA       LYS   1   1.903  -9.192  -5.631
   14   1HB   LYS   1          HB2       LYS   1   4.240  -8.415  -4.377
   15   2HB   LYS   1          HB1       LYS   1   3.059  -7.273  -3.753
   16   1HG   LYS   1          HG2       LYS   1   3.061  -9.058  -2.239
   17   2HG   LYS   1          HG1       LYS   1   1.611  -9.286  -3.218
   18   1HD   LYS   1          HD2       LYS   1   2.375 -11.394  -3.429
   19   2HD   LYS   1          HD1       LYS   1   3.428 -10.690  -4.658
   20   1HE   LYS   1          HE2       LYS   1   4.197 -10.899  -1.756
   21   2HE   LYS   1          HE1       LYS   1   4.556 -12.157  -2.937
   22   1HZ   LYS   1          HZ1       LYS   1   5.466  -9.333  -3.095
   23   2HZ   LYS   1          HZ2       LYS   1   5.822 -10.548  -4.216
   24   3HZ   LYS   1          HZ3       LYS   1   6.424 -10.652  -2.639
   25    H    ALA   2           HN       ALA   2  -0.071  -8.356  -5.528
   26    HA   ALA   2           HA       ALA   2  -0.372  -5.428  -5.589
   27   1HB   ALA   2          HB1       ALA   2  -2.615  -6.274  -6.874
   28   2HB   ALA   2          HB2       ALA   2  -1.422  -7.438  -7.449
   29   3HB   ALA   2          HB3       ALA   2  -1.150  -5.711  -7.677
   30    H    ALA   3           HN       ALA   3  -1.509  -4.675  -3.934
   31    HA   ALA   3           HA       ALA   3  -3.343  -6.517  -2.543
   32   1HB   ALA   3          HB1       ALA   3  -2.317  -4.148  -1.104
   33   2HB   ALA   3          HB2       ALA   3  -1.158  -5.432  -1.447
   34   3HB   ALA   3          HB3       ALA   3  -2.620  -5.786  -0.527
   35    H    ARG   4           HN       ARG   4  -5.382  -5.842  -2.034
   36    HA   ARG   4           HA       ARG   4  -6.252  -3.345  -3.304
   37   1HB   ARG   4          HB2       ARG   4  -7.340  -5.482  -3.985
   38   2HB   ARG   4          HB1       ARG   4  -7.932  -5.665  -2.340
   39   1HG   ARG   4          HG2       ARG   4  -9.010  -3.355  -2.699
   40   2HG   ARG   4          HG1       ARG   4  -8.729  -3.663  -4.414
   41   1HD   ARG   4          HD2       ARG   4  -9.989  -5.843  -2.864
   42   2HD   ARG   4          HD1       ARG   4 -10.966  -4.399  -3.130
   43    HE   ARG   4           HE       ARG   4 -10.382  -6.396  -5.031
   44   1HH1  ARG   4          HH11      ARG   4 -10.657  -2.929  -4.742
   45   2HH1  ARG   4          HH12      ARG   4 -11.088  -2.699  -6.403
   46   1HH2  ARG   4          HH21      ARG   4 -10.948  -6.096  -7.217
   47   2HH2  ARG   4          HH22      ARG   4 -11.252  -4.496  -7.809
   48    H    LEU   5           HN       LEU   5  -7.066  -1.690  -2.162
   49    HA   LEU   5           HA       LEU   5  -6.973  -1.862   0.734
   50   1HB   LEU   5          HB2       LEU   5  -6.533   0.165  -1.187
   51   2HB   LEU   5          HB1       LEU   5  -7.902   0.680  -0.221
   52    HG   LEU   5           HG       LEU   5  -5.731   1.524   0.621
   53   1HD1  LEU   5          HD11      LEU   5  -6.123   0.989   2.951
   54   2HD1  LEU   5          HD12      LEU   5  -7.109  -0.399   2.489
   55   3HD1  LEU   5          HD13      LEU   5  -7.657   1.236   2.116
   56   1HD2  LEU   5          HD21      LEU   5  -5.013  -1.113   1.732
   57   2HD2  LEU   5          HD22      LEU   5  -3.984   0.206   1.174
   58   3HD2  LEU   5          HD23      LEU   5  -4.722  -0.890   0.007
   59    H    LYS   6           HN       LYS   6  -8.692  -1.557   2.116
   60    HA   LYS   6           HA       LYS   6 -11.362  -1.352   0.905
   61   1HB   LYS   6          HB2       LYS   6 -10.470  -3.338   2.998
   62   2HB   LYS   6          HB1       LYS   6 -12.155  -3.021   2.610
   63   1HG   LYS   6          HG2       LYS   6 -10.119  -3.977   0.612
   64   2HG   LYS   6          HG1       LYS   6 -11.204  -5.038   1.513
   65   1HD   LYS   6          HD2       LYS   6 -12.510  -2.790   0.136
   66   2HD   LYS   6          HD1       LYS   6 -11.761  -3.985  -0.925
   67   1HE   LYS   6          HE2       LYS   6 -13.797  -4.967  -0.685
   68   2HE   LYS   6          HE1       LYS   6 -13.001  -5.654   0.730
   69   1HZ   LYS   6          HZ1       LYS   6 -15.094  -4.843   1.426
   70   2HZ   LYS   6          HZ2       LYS   6 -14.872  -3.356   0.651
   71   3HZ   LYS   6          HZ3       LYS   6 -13.947  -3.746   2.012
   72    H    PHE   7           HN       PHE   7  -9.432   0.415   2.527
   73    HA   PHE   7           HA       PHE   7 -11.492   1.572   4.192
   74   1HB   PHE   7          HB2       PHE   7  -8.865   0.840   5.487
   75   2HB   PHE   7          HB1       PHE   7 -10.300   1.503   6.262
   76    HD1  PHE   7           HD2      PHE   7  -8.817  -1.498   4.750
   77    HD2  PHE   7           HD1      PHE   7 -12.119   0.102   6.905
   78    HE1  PHE   7           HE2      PHE   7  -9.586  -3.779   5.257
   79    HE2  PHE   7           HE1      PHE   7 -12.894  -2.176   7.418
   80    HZ   PHE   7           HZ       PHE   7 -11.627  -4.121   6.593
   81    H    ASP   8           HN       ASP   8 -11.432   3.675   3.789
   82    HA   ASP   8           HA       ASP   8  -9.318   4.940   2.418
   83   1HB   ASP   8          HB2       ASP   8 -10.553   7.042   2.899
   84   2HB   ASP   8          HB1       ASP   8 -11.588   5.777   2.242
   85    H    PHE   9           HN       PHE   9  -7.361   5.174   3.292
   86    HA   PHE   9           HA       PHE   9  -7.172   6.091   6.084
   87   1HB   PHE   9          HB2       PHE   9  -6.090   3.884   5.414
   88   2HB   PHE   9          HB1       PHE   9  -4.949   4.839   4.474
   89    HD1  PHE   9           HD1      PHE   9  -6.373   4.748   7.923
   90    HD2  PHE   9           HD2      PHE   9  -2.956   5.371   5.465
   91    HE1  PHE   9           HE1      PHE   9  -4.990   5.067   9.934
   92    HE2  PHE   9           HE2      PHE   9  -1.566   5.690   7.471
   93    HZ   PHE   9           HZ       PHE   9  -2.583   5.538   9.709
   94    H    GLN  10           HN       GLN  10  -6.172   7.971   6.560
   95    HA   GLN  10           HA       GLN  10  -5.255   9.593   4.294
   96   1HB   GLN  10          HB2       GLN  10  -7.084  10.414   5.853
   97   2HB   GLN  10          HB1       GLN  10  -5.845  10.552   7.093
   98   1HG   GLN  10          HG2       GLN  10  -5.158  12.500   6.297
   99   2HG   GLN  10          HG1       GLN  10  -5.007  11.851   4.665
  100   1HE2  GLN  10          HE21      GLN  10  -6.737  12.037   3.238
  101   2HE2  GLN  10          HE22      GLN  10  -8.038  13.140   3.512
  102    H    ALA  11           HN       ALA  11  -3.154   9.888   3.994
  103    HA   ALA  11           HA       ALA  11  -1.183   8.845   5.708
  104   1HB   ALA  11          HB1       ALA  11  -0.759   9.093   3.349
  105   2HB   ALA  11          HB2       ALA  11   0.421  10.042   4.253
  106   3HB   ALA  11          HB3       ALA  11  -0.938  10.843   3.464
  107    H    GLN  12           HN       GLN  12  -0.739   9.594   7.671
  108    HA   GLN  12           HA       GLN  12  -1.274  12.264   8.494
  109   1HB   GLN  12          HB2       GLN  12   0.572  10.469  10.016
  110   2HB   GLN  12          HB1       GLN  12  -0.644  11.584  10.615
  111   1HG   GLN  12          HG2       GLN  12  -2.145   9.754   9.239
  112   2HG   GLN  12          HG1       GLN  12  -0.861   8.766   9.936
  113   1HE2  GLN  12          HE21      GLN  12  -1.290   7.980  11.860
  114   2HE2  GLN  12          HE22      GLN  12  -2.340   8.678  13.042
  115    H    SER  13           HN       SER  13   1.659  10.470   7.674
  116    HA   SER  13           HA       SER  13   3.309  12.830   8.084
  117   1HB   SER  13          HB2       SER  13   5.105  11.138   7.179
  118   2HB   SER  13          HB1       SER  13   4.471  10.960   8.815
  119    HG   SER  13           HG       SER  13   3.924   9.035   8.198
  120    HA   PRO  14           HA       PRO  14   3.381  14.187   3.894
  121   1HB   PRO  14          HB2       PRO  14   5.952  15.038   3.627
  122   2HB   PRO  14          HB1       PRO  14   4.732  15.924   4.549
  123   1HG   PRO  14          HG2       PRO  14   6.867  14.067   5.527
  124   2HG   PRO  14          HG1       PRO  14   6.349  15.627   6.193
  125   1HD   PRO  14          HD2       PRO  14   5.550  13.274   7.249
  126   2HD   PRO  14          HD1       PRO  14   4.508  14.711   7.243
  127    H    LYS  15           HN       LYS  15   5.830  11.900   4.931
  128    HA   LYS  15           HA       LYS  15   6.680  11.219   2.277
  129   1HB   LYS  15          HB2       LYS  15   8.104  10.985   4.331
  130   2HB   LYS  15          HB1       LYS  15   7.081   9.642   4.822
  131   1HG   LYS  15          HG2       LYS  15   7.700   8.446   2.764
  132   2HG   LYS  15          HG1       LYS  15   8.772   9.780   2.334
  133   1HD   LYS  15          HD2       LYS  15  10.099   9.393   4.327
  134   2HD   LYS  15          HD1       LYS  15   8.991   8.122   4.846
  135   1HE   LYS  15          HE2       LYS  15   9.555   7.050   2.551
  136   2HE   LYS  15          HE1       LYS  15  10.957   8.117   2.590
  137   1HZ   LYS  15          HZ1       LYS  15  11.126   7.062   5.005
  138   2HZ   LYS  15          HZ2       LYS  15  11.845   6.349   3.650
  139   3HZ   LYS  15          HZ3       LYS  15  10.358   5.776   4.216
  140    H    GLU  16           HN       GLU  16   4.239  10.108   4.495
  141    HA   GLU  16           HA       GLU  16   3.747   7.592   3.278
  142   1HB   GLU  16          HB2       GLU  16   2.395   9.312   5.278
  143   2HB   GLU  16          HB1       GLU  16   1.379   8.150   4.437
  144   1HG   GLU  16          HG2       GLU  16   3.282   6.476   5.083
  145   2HG   GLU  16          HG1       GLU  16   3.637   7.684   6.317
  146    H    LEU  17           HN       LEU  17   1.427   7.147   2.409
  147    HA   LEU  17           HA       LEU  17   0.654   9.263   0.520
  148   1HB   LEU  17          HB2       LEU  17   2.012   7.680  -0.706
  149   2HB   LEU  17          HB1       LEU  17   1.058   6.339  -0.102
  150    HG   LEU  17           HG       LEU  17  -0.925   7.484  -1.305
  151   1HD1  LEU  17          HD11      LEU  17  -0.559   9.136  -2.800
  152   2HD1  LEU  17          HD12      LEU  17   1.059   8.563  -3.205
  153   3HD1  LEU  17          HD13      LEU  17   0.796   9.491  -1.728
  154   1HD2  LEU  17          HD21      LEU  17  -0.617   6.079  -3.091
  155   2HD2  LEU  17          HD22      LEU  17   0.532   5.397  -1.940
  156   3HD2  LEU  17          HD23      LEU  17   1.100   6.455  -3.232
  157    H    THR  18           HN       THR  18  -1.493   9.557   0.252
  158    HA   THR  18           HA       THR  18  -3.263   8.093   2.020
  159    HB   THR  18           HB       THR  18  -3.803  10.420   0.163
  160    HG1  THR  18           HG1      THR  18  -3.526  11.675   1.919
  161   1HG2  THR  18          HG21      THR  18  -5.515   9.271   2.352
  162   2HG2  THR  18          HG22      THR  18  -5.875   9.284   0.626
  163   3HG2  THR  18          HG23      THR  18  -5.806  10.800   1.524
  164    H    LEU  19           HN       LEU  19  -4.425   6.395   1.418
  165    HA   LEU  19           HA       LEU  19  -5.136   6.104  -1.424
  166   1HB   LEU  19          HB2       LEU  19  -3.280   4.589  -0.780
  167   2HB   LEU  19          HB1       LEU  19  -4.317   3.876   0.441
  168    HG   LEU  19           HG       LEU  19  -5.887   3.217  -1.424
  169   1HD1  LEU  19          HD11      LEU  19  -3.734   4.517  -2.971
  170   2HD1  LEU  19          HD12      LEU  19  -5.455   4.363  -3.323
  171   3HD1  LEU  19          HD13      LEU  19  -4.369   3.006  -3.620
  172   1HD2  LEU  19          HD21      LEU  19  -3.223   1.955  -1.884
  173   2HD2  LEU  19          HD22      LEU  19  -4.812   1.206  -1.723
  174   3HD2  LEU  19          HD23      LEU  19  -3.982   1.827  -0.297
  175    H    GLN  20           HN       GLN  20  -7.115   5.085  -1.869
  176    HA   GLN  20           HA       GLN  20  -8.930   4.897   0.445
  177   1HB   GLN  20          HB2       GLN  20  -9.180   6.705  -1.509
  178   2HB   GLN  20          HB1       GLN  20 -10.024   5.368  -2.279
  179   1HG   GLN  20          HG2       GLN  20 -11.590   5.237  -0.468
  180   2HG   GLN  20          HG1       GLN  20 -10.687   6.440   0.452
  181   1HE2  GLN  20          HE21      GLN  20 -13.478   6.388  -0.533
  182   2HE2  GLN  20          HE22      GLN  20 -13.667   7.844  -1.443
  183    H    LYS  21           HN       LYS  21 -10.721   3.373   0.224
  184    HA   LYS  21           HA       LYS  21  -9.877   0.812  -0.489
  185   1HB   LYS  21          HB2       LYS  21 -12.201   0.147  -0.086
  186   2HB   LYS  21          HB1       LYS  21 -11.615   1.221   1.172
  187   1HG   LYS  21          HG2       LYS  21 -12.747   3.099  -0.050
  188   2HG   LYS  21          HG1       LYS  21 -13.488   1.877  -1.085
  189   1HD   LYS  21          HD2       LYS  21 -14.025   0.892   1.398
  190   2HD   LYS  21          HD1       LYS  21 -14.097   2.632   1.685
  191   1HE   LYS  21          HE2       LYS  21 -16.258   2.256   1.050
  192   2HE   LYS  21          HE1       LYS  21 -15.536   2.585  -0.525
  193   1HZ   LYS  21          HZ1       LYS  21 -16.543   0.657  -1.044
  194   2HZ   LYS  21          HZ2       LYS  21 -16.583   0.099   0.552
  195   3HZ   LYS  21          HZ3       LYS  21 -15.163  -0.039  -0.356
  196    H    GLY  22           HN       GLY  22 -10.176  -0.463  -2.264
  197   1HA   GLY  22          HA2       GLY  22 -11.218  -1.062  -4.318
  198   2HA   GLY  22          HA1       GLY  22 -11.756   0.606  -4.496
  199    H    ASP  23           HN       ASP  23  -8.694   1.001  -3.551
  200    HA   ASP  23           HA       ASP  23  -7.754   1.219  -6.313
  201   1HB   ASP  23          HB2       ASP  23  -7.688   3.111  -4.489
  202   2HB   ASP  23          HB1       ASP  23  -6.226   2.280  -3.967
  203    H    ILE  24           HN       ILE  24  -5.845   0.307  -7.032
  204    HA   ILE  24           HA       ILE  24  -4.700  -1.765  -5.274
  205    HB   ILE  24           HB       ILE  24  -4.696  -1.802  -8.290
  206   1HG1  ILE  24          HG12      ILE  24  -7.006  -1.904  -7.403
  207   2HG1  ILE  24          HG11      ILE  24  -6.518  -3.413  -8.168
  208   1HG2  ILE  24          HG21      ILE  24  -3.075  -3.294  -7.814
  209   2HG2  ILE  24          HG22      ILE  24  -4.442  -4.363  -7.500
  210   3HG2  ILE  24          HG23      ILE  24  -3.639  -3.542  -6.161
  211   1HD1  ILE  24          HD11      ILE  24  -6.692  -2.843  -5.221
  212   2HD1  ILE  24          HD12      ILE  24  -6.021  -4.321  -5.911
  213   3HD1  ILE  24          HD13      ILE  24  -7.718  -3.918  -6.170
  214    H    VAL  25           HN       VAL  25  -2.507  -1.926  -5.072
  215    HA   VAL  25           HA       VAL  25  -0.854  -0.035  -6.603
  216    HB   VAL  25           HB       VAL  25   0.492   0.387  -4.557
  217   1HG1  VAL  25          HG11      VAL  25  -0.979   2.117  -5.118
  218   2HG1  VAL  25          HG12      VAL  25  -1.306   1.806  -3.413
  219   3HG1  VAL  25          HG13      VAL  25  -2.399   1.183  -4.649
  220   1HG2  VAL  25          HG21      VAL  25  -0.733  -1.770  -3.500
  221   2HG2  VAL  25          HG22      VAL  25  -1.695  -0.478  -2.782
  222   3HG2  VAL  25          HG23      VAL  25   0.051  -0.517  -2.537
  223    H    TYR  26           HN       TYR  26   1.477  -0.572  -6.538
  224    HA   TYR  26           HA       TYR  26   1.868  -3.488  -6.367
  225   1HB   TYR  26          HB2       TYR  26   3.708  -3.088  -8.067
  226   2HB   TYR  26          HB1       TYR  26   2.063  -2.860  -8.649
  227    HD1  TYR  26           HD2      TYR  26   1.174  -0.516  -8.893
  228    HD2  TYR  26           HD1      TYR  26   5.281  -1.328  -8.137
  229    HE1  TYR  26           HE2      TYR  26   1.758   1.745  -9.665
  230    HE2  TYR  26           HE1      TYR  26   5.876   0.930  -8.907
  231    HH   TYR  26           HH       TYR  26   4.316   2.728 -10.715
  232    H    ILE  27           HN       ILE  27   3.133  -4.114  -4.769
  233    HA   ILE  27           HA       ILE  27   4.825  -2.239  -3.373
  234    HB   ILE  27           HB       ILE  27   4.796  -5.190  -2.833
  235   1HG1  ILE  27          HG12      ILE  27   2.460  -4.701  -2.967
  236   2HG1  ILE  27          HG11      ILE  27   2.875  -4.721  -1.256
  237   1HG2  ILE  27          HG21      ILE  27   4.800  -3.043  -0.770
  238   2HG2  ILE  27          HG22      ILE  27   6.271  -3.353  -1.692
  239   3HG2  ILE  27          HG23      ILE  27   5.541  -4.643  -0.736
  240   1HD1  ILE  27          HD11      ILE  27   3.152  -2.154  -1.583
  241   2HD1  ILE  27          HD12      ILE  27   1.546  -2.859  -1.401
  242   3HD1  ILE  27          HD13      ILE  27   2.142  -2.424  -3.003
  243    H    HIS  28           HN       HIS  28   7.029  -2.177  -3.329
  244    HA   HIS  28           HA       HIS  28   8.401  -3.814  -5.347
  245   1HB   HIS  28          HB2       HIS  28  10.190  -2.055  -5.230
  246   2HB   HIS  28          HB1       HIS  28   8.641  -1.486  -5.838
  247    HD1  HIS  28           HD1      HIS  28  11.233  -0.557  -3.582
  248    HD2  HIS  28           HD2      HIS  28   7.095  -0.189  -3.587
  249    HE1  HIS  28           HE1      HIS  28  10.720   1.274  -1.937
  250    HE2  HIS  28           HE2      HIS  28   8.217   1.546  -2.032
  251    H    LYS  29           HN       LYS  29   8.228  -3.106  -1.979
  252    HA   LYS  29           HA       LYS  29  10.108  -5.234  -1.416
  253   1HB   LYS  29          HB2       LYS  29  11.169  -3.627   0.377
  254   2HB   LYS  29          HB1       LYS  29  11.779  -3.659  -1.270
  255   1HG   LYS  29          HG2       LYS  29  11.115  -1.562  -1.696
  256   2HG   LYS  29          HG1       LYS  29   9.609  -1.741  -0.794
  257   1HD   LYS  29          HD2       LYS  29  12.349  -1.311   0.395
  258   2HD   LYS  29          HD1       LYS  29  11.083  -0.091   0.248
  259   1HE   LYS  29          HE2       LYS  29   9.637  -1.735   1.602
  260   2HE   LYS  29          HE1       LYS  29  11.164  -2.521   2.003
  261   1HZ   LYS  29          HZ1       LYS  29  10.039  -0.326   3.247
  262   2HZ   LYS  29          HZ2       LYS  29  11.368   0.277   2.392
  263   3HZ   LYS  29          HZ3       LYS  29  11.580  -0.973   3.512
  264    H    GLU  30           HN       GLU  30   9.701  -6.249   0.529
  265    HA   GLU  30           HA       GLU  30   7.332  -5.267   1.970
  266   1HB   GLU  30          HB2       GLU  30   8.383  -8.088   1.967
  267   2HB   GLU  30          HB1       GLU  30   6.820  -7.524   2.541
  268   1HG   GLU  30          HG2       GLU  30   6.179  -6.954   0.259
  269   2HG   GLU  30          HG1       GLU  30   7.749  -7.507  -0.322
  270    H    VAL  31           HN       VAL  31   7.689  -4.377   3.838
  271    HA   VAL  31           HA       VAL  31   9.986  -5.283   5.438
  272    HB   VAL  31           HB       VAL  31   8.839  -2.910   6.532
  273   1HG1  VAL  31          HG11      VAL  31  11.278  -4.007   6.356
  274   2HG1  VAL  31          HG12      VAL  31  11.004  -2.311   6.758
  275   3HG1  VAL  31          HG13      VAL  31  11.418  -2.771   5.106
  276   1HG2  VAL  31          HG21      VAL  31   9.199  -1.315   4.736
  277   2HG2  VAL  31          HG22      VAL  31   7.972  -2.491   4.264
  278   3HG2  VAL  31          HG23      VAL  31   9.610  -2.626   3.630
  279    H    ASP  32           HN       ASP  32   9.038  -6.977   6.437
  280    HA   ASP  32           HA       ASP  32   6.476  -7.038   7.568
  281   1HB   ASP  32          HB2       ASP  32   7.403  -8.991   8.900
  282   2HB   ASP  32          HB1       ASP  32   7.537  -9.112   7.148
  283    H    LYS  33           HN       LYS  33   9.201  -5.329   8.642
  284    HA   LYS  33           HA       LYS  33   9.190  -5.511  11.377
  285   1HB   LYS  33          HB2       LYS  33  10.622  -4.023   9.854
  286   2HB   LYS  33          HB1       LYS  33   9.321  -2.847   9.976
  287   1HG   LYS  33          HG2       LYS  33  10.225  -2.095  11.848
  288   2HG   LYS  33          HG1       LYS  33   9.897  -3.655  12.603
  289   1HD   LYS  33          HD2       LYS  33  12.058  -4.232  12.577
  290   2HD   LYS  33          HD1       LYS  33  12.257  -3.713  10.902
  291   1HE   LYS  33          HE2       LYS  33  12.038  -1.324  12.173
  292   2HE   LYS  33          HE1       LYS  33  12.840  -2.293  13.408
  293   1HZ   LYS  33          HZ1       LYS  33  13.917  -2.540  10.726
  294   2HZ   LYS  33          HZ2       LYS  33  14.721  -2.418  12.209
  295   3HZ   LYS  33          HZ3       LYS  33  14.127  -1.026  11.452
  296    H    ASN  34           HN       ASN  34   7.147  -3.359   9.426
  297    HA   ASN  34           HA       ASN  34   4.745  -3.703  10.605
  298   1HB   ASN  34          HB2       ASN  34   4.613  -1.747  12.243
  299   2HB   ASN  34          HB1       ASN  34   5.455  -3.190  12.796
  300   1HD2  ASN  34          HD21      ASN  34   5.866  -0.833  14.056
  301   2HD2  ASN  34          HD22      ASN  34   7.455  -0.242  13.722
  302    H    TRP  35           HN       TRP  35   6.254  -2.486   8.256
  303    HA   TRP  35           HA       TRP  35   4.206  -0.613   7.554
  304   1HB   TRP  35          HB2       TRP  35   6.437   0.470   8.803
  305   2HB   TRP  35          HB1       TRP  35   6.766   0.706   7.090
  306    HD1  TRP  35           HD1      TRP  35   3.405   1.042   6.628
  307    HE1  TRP  35           HE1      TRP  35   2.466   3.396   7.076
  308    HE3  TRP  35           HE3      TRP  35   7.229   2.916   9.458
  309    HZ2  TRP  35           HZ2      TRP  35   3.244   5.737   8.448
  310    HZ3  TRP  35           HZ3      TRP  35   7.053   5.222  10.298
  311    HH2  TRP  35           HH2      TRP  35   5.102   6.602   9.802
  312    H    LEU  36           HN       LEU  36   3.710  -1.247   5.542
  313    HA   LEU  36           HA       LEU  36   5.635  -2.601   3.892
  314   1HB   LEU  36          HB2       LEU  36   3.275  -3.274   4.020
  315   2HB   LEU  36          HB1       LEU  36   2.805  -1.727   3.340
  316    HG   LEU  36           HG       LEU  36   4.511  -2.575   1.429
  317   1HD1  LEU  36          HD11      LEU  36   4.818  -4.782   1.367
  318   2HD1  LEU  36          HD12      LEU  36   3.121  -5.108   1.722
  319   3HD1  LEU  36          HD13      LEU  36   4.255  -4.804   3.039
  320   1HD2  LEU  36          HD21      LEU  36   2.623  -2.132   0.344
  321   2HD2  LEU  36          HD22      LEU  36   1.683  -2.343   1.822
  322   3HD2  LEU  36          HD23      LEU  36   2.023  -3.731   0.786
  323    H    GLU  37           HN       GLU  37   6.445  -1.893   1.907
  324    HA   GLU  37           HA       GLU  37   6.206   1.006   1.439
  325   1HB   GLU  37          HB2       GLU  37   8.481  -0.130   2.071
  326   2HB   GLU  37          HB1       GLU  37   8.489  -0.616   0.382
  327   1HG   GLU  37          HG2       GLU  37   9.147   1.394  -0.272
  328   2HG   GLU  37          HG1       GLU  37   7.857   2.180   0.637
  329    H    GLY  38           HN       GLY  38   5.232   1.620  -0.371
  330   1HA   GLY  38          HA2       GLY  38   5.312  -0.186  -2.697
  331   2HA   GLY  38          HA1       GLY  38   3.775   0.460  -2.142
  332    H    GLU  39           HN       GLU  39   4.197   1.011  -4.632
  333    HA   GLU  39           HA       GLU  39   4.716   3.867  -4.641
  334   1HB   GLU  39          HB2       GLU  39   6.059   3.409  -6.876
  335   2HB   GLU  39          HB1       GLU  39   6.861   3.424  -5.312
  336   1HG   GLU  39          HG2       GLU  39   6.882   1.041  -5.220
  337   2HG   GLU  39          HG1       GLU  39   5.866   0.927  -6.657
  338    H    HIS  40           HN       HIS  40   3.924   4.928  -6.573
  339    HA   HIS  40           HA       HIS  40   2.207   3.328  -8.308
  340   1HB   HIS  40          HB2       HIS  40   0.266   4.761  -7.929
  341   2HB   HIS  40          HB1       HIS  40   0.772   4.004  -6.423
  342    HD1  HIS  40           HD1      HIS  40  -0.623   6.982  -7.293
  343    HD2  HIS  40           HD2      HIS  40   2.921   6.102  -5.310
  344    HE1  HIS  40           HE1      HIS  40  -0.049   9.055  -5.991
  345    HE2  HIS  40           HE2      HIS  40   2.149   8.532  -4.877
  346    H    HIS  41           HN       HIS  41   2.502   3.932 -10.342
  347    HA   HIS  41           HA       HIS  41   3.131   5.124 -12.174
  348   1HB   HIS  41          HB2       HIS  41   1.796   7.197 -10.465
  349   2HB   HIS  41          HB1       HIS  41   2.538   7.659 -11.993
  350    HD1  HIS  41           HD1      HIS  41   1.491   6.589 -14.171
  351    HD2  HIS  41           HD2      HIS  41  -0.649   5.940 -10.669
  352    HE1  HIS  41           HE1      HIS  41  -0.783   5.809 -14.908
  353    HE2  HIS  41           HE2      HIS  41  -2.029   5.333 -12.770
  354    H    GLY  42           HN       GLY  42   5.180   4.605 -10.302
  355   1HA   GLY  42          HA2       GLY  42   7.451   5.146 -10.334
  356   2HA   GLY  42          HA1       GLY  42   7.052   6.676 -11.099
  357    H    ARG  43           HN       ARG  43   4.957   6.759  -8.704
  358    HA   ARG  43           HA       ARG  43   6.758   8.262  -6.984
  359   1HB   ARG  43          HB2       ARG  43   4.644   9.298  -7.718
  360   2HB   ARG  43          HB1       ARG  43   3.746   8.014  -6.920
  361   1HG   ARG  43          HG2       ARG  43   3.786  10.053  -5.590
  362   2HG   ARG  43          HG1       ARG  43   4.601   8.723  -4.766
  363   1HD   ARG  43          HD2       ARG  43   5.923  10.701  -4.488
  364   2HD   ARG  43          HD1       ARG  43   6.769   9.622  -5.595
  365    HE   ARG  43           HE       ARG  43   6.507  11.170  -7.266
  366   1HH1  ARG  43          HH11      ARG  43   4.439  12.020  -4.586
  367   2HH1  ARG  43          HH12      ARG  43   4.018  13.567  -5.240
  368   1HH2  ARG  43          HH21      ARG  43   5.953  13.204  -8.128
  369   2HH2  ARG  43          HH22      ARG  43   4.877  14.239  -7.251
  370    H    LEU  44           HN       LEU  44   6.721   7.988  -4.661
  371    HA   LEU  44           HA       LEU  44   6.415   5.172  -3.941
  372   1HB   LEU  44          HB2       LEU  44   8.043   7.443  -2.907
  373   2HB   LEU  44          HB1       LEU  44   7.634   6.141  -1.805
  374    HG   LEU  44           HG       LEU  44   8.577   4.897  -4.143
  375   1HD1  LEU  44          HD11      LEU  44  10.012   7.420  -3.513
  376   2HD1  LEU  44          HD12      LEU  44   9.748   6.623  -5.064
  377   3HD1  LEU  44          HD13      LEU  44  10.965   6.002  -3.948
  378   1HD2  LEU  44          HD21      LEU  44  10.215   5.353  -1.672
  379   2HD2  LEU  44          HD22      LEU  44  10.147   3.929  -2.710
  380   3HD2  LEU  44          HD23      LEU  44   8.788   4.317  -1.655
  381    H    GLY  45           HN       GLY  45   4.890   4.458  -2.630
  382   1HA   GLY  45          HA2       GLY  45   3.503   6.370  -0.870
  383   2HA   GLY  45          HA1       GLY  45   2.575   5.319  -1.928
  384    H    ILE  46           HN       ILE  46   3.714   5.669   1.143
  385    HA   ILE  46           HA       ILE  46   3.741   2.761   1.612
  386    HB   ILE  46           HB       ILE  46   4.991   4.954   3.269
  387   1HG1  ILE  46          HG12      ILE  46   6.149   2.950   1.330
  388   2HG1  ILE  46          HG11      ILE  46   6.184   4.704   1.201
  389   1HG2  ILE  46          HG21      ILE  46   4.234   2.389   4.060
  390   2HG2  ILE  46          HG22      ILE  46   5.327   3.483   4.901
  391   3HG2  ILE  46          HG23      ILE  46   5.969   2.289   3.774
  392   1HD1  ILE  46          HD11      ILE  46   7.520   4.608   3.396
  393   2HD1  ILE  46          HD12      ILE  46   8.318   4.177   1.883
  394   3HD1  ILE  46          HD13      ILE  46   7.766   2.911   2.981
  395    H    PHE  47           HN       PHE  47   2.583   1.907   3.326
  396    HA   PHE  47           HA       PHE  47   1.018   3.554   5.083
  397   1HB   PHE  47          HB2       PHE  47  -1.164   2.478   4.299
  398   2HB   PHE  47          HB1       PHE  47  -0.498   3.749   3.279
  399    HD1  PHE  47           HD1      PHE  47  -0.601   0.053   3.655
  400    HD2  PHE  47           HD2      PHE  47  -0.155   3.365   1.021
  401    HE1  PHE  47           HE1      PHE  47  -0.646  -1.478   1.730
  402    HE2  PHE  47           HE2      PHE  47  -0.201   1.840  -0.910
  403    HZ   PHE  47           HZ       PHE  47  -0.447  -0.585  -0.557
  404    HA   PRO  48           HA       PRO  48   1.216   0.120   7.823
  405   1HB   PRO  48          HB2       PRO  48  -1.749   0.227   8.082
  406   2HB   PRO  48          HB1       PRO  48  -0.507   0.275   9.338
  407   1HG   PRO  48          HG2       PRO  48  -1.813   2.486   8.632
  408   2HG   PRO  48          HG1       PRO  48  -0.082   2.532   9.019
  409   1HD   PRO  48          HD2       PRO  48  -1.436   2.635   6.360
  410   2HD   PRO  48          HD1       PRO  48   0.032   3.466   6.914
  411    H    ALA  49           HN       ALA  49   1.363  -2.010   7.480
  412    HA   ALA  49           HA       ALA  49   0.274  -3.216   5.163
  413   1HB   ALA  49          HB1       ALA  49   2.368  -3.792   6.743
  414   2HB   ALA  49          HB2       ALA  49   1.648  -4.947   5.621
  415   3HB   ALA  49          HB3       ALA  49   1.210  -4.986   7.329
  416    H    ASN  50           HN       ASN  50  -0.872  -2.901   8.413
  417    HA   ASN  50           HA       ASN  50  -2.760  -5.074   8.225
  418   1HB   ASN  50          HB2       ASN  50  -1.626  -4.171  10.360
  419   2HB   ASN  50          HB1       ASN  50  -2.835  -2.892  10.294
  420   1HD2  ASN  50          HD21      ASN  50  -2.839  -4.388  12.472
  421   2HD2  ASN  50          HD22      ASN  50  -4.167  -5.493  12.484
  422    H    TYR  51           HN       TYR  51  -2.707  -2.174   6.736
  423    HA   TYR  51           HA       TYR  51  -5.623  -1.818   6.942
  424   1HB   TYR  51          HB2       TYR  51  -3.470   0.072   7.094
  425   2HB   TYR  51          HB1       TYR  51  -4.465   0.446   5.690
  426    HD1  TYR  51           HD1      TYR  51  -7.119   0.206   6.271
  427    HD2  TYR  51           HD2      TYR  51  -4.029   1.180   9.028
  428    HE1  TYR  51           HE1      TYR  51  -8.772   1.295   7.729
  429    HE2  TYR  51           HE2      TYR  51  -5.673   2.272  10.494
  430    HH   TYR  51           HH       TYR  51  -8.885   2.934   9.484
  431    H    VAL  52           HN       VAL  52  -4.301  -3.753   5.252
  432    HA   VAL  52           HA       VAL  52  -5.527  -3.000   2.744
  433    HB   VAL  52           HB       VAL  52  -3.254  -2.085   2.493
  434   1HG1  VAL  52          HG11      VAL  52  -1.321  -3.270   2.783
  435   2HG1  VAL  52          HG12      VAL  52  -2.087  -4.820   2.437
  436   3HG1  VAL  52          HG13      VAL  52  -2.336  -4.043   4.000
  437   1HG2  VAL  52          HG21      VAL  52  -4.604  -3.173   0.607
  438   2HG2  VAL  52          HG22      VAL  52  -3.463  -4.512   0.742
  439   3HG2  VAL  52          HG23      VAL  52  -2.884  -2.897   0.333
  440    H    GLU  53           HN       GLU  53  -5.671  -4.807   1.234
  441    HA   GLU  53           HA       GLU  53  -5.654  -7.377   2.660
  442   1HB   GLU  53          HB2       GLU  53  -7.365  -6.257   0.468
  443   2HB   GLU  53          HB1       GLU  53  -7.214  -7.999   0.658
  444   1HG   GLU  53          HG2       GLU  53  -7.881  -7.600   3.095
  445   2HG   GLU  53          HG1       GLU  53  -8.391  -6.002   2.552
  446    H    VAL  54           HN       VAL  54  -4.270  -8.904   2.055
  447    HA   VAL  54           HA       VAL  54  -2.537  -8.462  -0.210
  448    HB   VAL  54           HB       VAL  54  -2.613 -10.875   1.602
  449   1HG1  VAL  54          HG11      VAL  54  -0.215 -11.029   0.947
  450   2HG1  VAL  54          HG12      VAL  54  -0.498  -9.734  -0.216
  451   3HG1  VAL  54          HG13      VAL  54  -1.340 -11.274  -0.388
  452   1HG2  VAL  54          HG21      VAL  54  -2.365  -8.621   2.768
  453   2HG2  VAL  54          HG22      VAL  54  -0.810  -8.496   1.947
  454   3HG2  VAL  54          HG23      VAL  54  -1.110  -9.823   3.070
  455    H    LEU  55           HN       LEU  55  -3.117  -9.025  -2.197
  456    HA   LEU  55           HA       LEU  55  -3.843 -11.648  -2.906
  457   1HB   LEU  55          HB2       LEU  55  -6.141 -11.280  -3.670
  458   2HB   LEU  55          HB1       LEU  55  -5.993 -11.100  -1.932
  459    HG   LEU  55           HG       LEU  55  -5.649  -8.519  -3.022
  460   1HD1  LEU  55          HD11      LEU  55  -8.302  -9.375  -3.963
  461   2HD1  LEU  55          HD12      LEU  55  -6.935  -9.902  -4.945
  462   3HD1  LEU  55          HD13      LEU  55  -7.186  -8.184  -4.631
  463   1HD2  LEU  55          HD21      LEU  55  -7.211  -7.968  -1.477
  464   2HD2  LEU  55          HD22      LEU  55  -6.855  -9.595  -0.896
  465   3HD2  LEU  55          HD23      LEU  55  -8.271  -9.310  -1.907
  466    HA   PRO  56           HA       PRO  56  -1.905  -8.857  -6.133
  467   1HB   PRO  56          HB2       PRO  56  -0.854 -11.571  -6.786
  468   2HB   PRO  56          HB1       PRO  56  -0.017 -10.014  -6.770
  469   1HG   PRO  56          HG2       PRO  56   0.349 -11.762  -4.800
  470   2HG   PRO  56          HG1       PRO  56   0.235 -10.025  -4.462
  471   1HD   PRO  56          HD2       PRO  56  -1.784 -12.178  -4.032
  472   2HD   PRO  56          HD1       PRO  56  -1.447 -10.735  -3.055
  473    H    LEU  57           HN       LEU  57  -3.350  -8.393  -7.670
  474    HA   LEU  57           HA       LEU  57  -4.771 -10.587  -9.005
  475   1HB   LEU  57          HB2       LEU  57  -5.424  -7.676  -9.321
  476   2HB   LEU  57          HB1       LEU  57  -6.465  -9.066  -9.564
  477    HG   LEU  57           HG       LEU  57  -5.919  -9.321  -6.919
  478   1HD1  LEU  57          HD11      LEU  57  -5.651  -7.342  -5.818
  479   2HD1  LEU  57          HD12      LEU  57  -6.377  -6.393  -7.115
  480   3HD1  LEU  57          HD13      LEU  57  -4.729  -6.996  -7.281
  481   1HD2  LEU  57          HD21      LEU  57  -8.130  -9.482  -7.374
  482   2HD2  LEU  57          HD22      LEU  57  -8.109  -8.132  -8.508
  483   3HD2  LEU  57          HD23      LEU  57  -8.132  -7.824  -6.772
  484    H    GLU  58           HN       GLU  58  -4.160 -11.183 -10.969
  485    HA   GLU  58           HA       GLU  58  -2.209  -9.632 -12.425
  486   1HB   GLU  58          HB2       GLU  58  -3.515 -12.304 -12.911
  487   2HB   GLU  58          HB1       GLU  58  -2.431 -11.564 -14.080
  488   1HG   GLU  58          HG2       GLU  58  -0.946 -11.404 -11.818
  489   2HG   GLU  58          HG1       GLU  58  -1.846 -12.894 -11.538
  Start of MODEL    7
    1   1H    MET   0          HT1       MET   0   6.288 -10.132  -8.804
    2   2H    MET   0          HT2       MET   0   7.171  -9.132  -9.884
    3   3H    MET   0          HT3       MET   0   5.646  -9.766 -10.351
    4    HA   MET   0           HA       MET   0   6.267  -7.677  -8.396
    5   1HB   MET   0          HB2       MET   0   5.790  -7.436 -10.974
    6   2HB   MET   0          HB1       MET   0   4.117  -7.663 -10.481
    7   1HG   MET   0          HG2       MET   0   4.582  -5.321 -10.631
    8   2HG   MET   0          HG1       MET   0   4.347  -5.754  -8.938
    9   1HE   MET   0          HE1       MET   0   5.502  -4.340  -7.436
   10   2HE   MET   0          HE2       MET   0   5.574  -3.110  -8.697
   11   3HE   MET   0          HE3       MET   0   7.008  -3.475  -7.738
   12    H    LYS   1           HN       LYS   1   4.536  -6.915  -7.081
   13    HA   LYS   1           HA       LYS   1   2.411  -8.901  -6.607
   14   1HB   LYS   1          HB2       LYS   1   4.301  -7.608  -4.707
   15   2HB   LYS   1          HB1       LYS   1   2.650  -7.861  -4.159
   16   1HG   LYS   1          HG2       LYS   1   2.854 -10.129  -4.132
   17   2HG   LYS   1          HG1       LYS   1   4.056 -10.147  -5.423
   18   1HD   LYS   1          HD2       LYS   1   5.137 -10.779  -3.379
   19   2HD   LYS   1          HD1       LYS   1   5.693  -9.164  -3.823
   20   1HE   LYS   1          HE2       LYS   1   3.317  -9.269  -2.084
   21   2HE   LYS   1          HE1       LYS   1   4.820  -9.840  -1.359
   22   1HZ   LYS   1          HZ1       LYS   1   4.893  -7.311  -2.824
   23   2HZ   LYS   1          HZ2       LYS   1   5.753  -7.786  -1.447
   24   3HZ   LYS   1          HZ3       LYS   1   4.134  -7.315  -1.312
   25    H    ALA   2           HN       ALA   2   0.431  -8.072  -5.739
   26    HA   ALA   2           HA       ALA   2   0.056  -5.180  -5.823
   27   1HB   ALA   2          HB1       ALA   2  -0.459  -6.542  -8.087
   28   2HB   ALA   2          HB2       ALA   2  -1.334  -5.091  -7.598
   29   3HB   ALA   2          HB3       ALA   2  -2.020  -6.683  -7.279
   30    H    ALA   3           HN       ALA   3  -1.793  -4.449  -4.711
   31    HA   ALA   3           HA       ALA   3  -3.495  -6.406  -3.398
   32   1HB   ALA   3          HB1       ALA   3  -3.017  -5.184  -1.167
   33   2HB   ALA   3          HB2       ALA   3  -1.510  -4.702  -1.945
   34   3HB   ALA   3          HB3       ALA   3  -1.884  -6.412  -1.731
   35    H    ARG   4           HN       ARG   4  -5.449  -5.571  -2.679
   36    HA   ARG   4           HA       ARG   4  -6.049  -2.868  -3.652
   37   1HB   ARG   4          HB2       ARG   4  -7.367  -4.846  -4.493
   38   2HB   ARG   4          HB1       ARG   4  -8.006  -5.030  -2.866
   39   1HG   ARG   4          HG2       ARG   4  -8.391  -2.335  -3.590
   40   2HG   ARG   4          HG1       ARG   4  -8.892  -3.317  -4.967
   41   1HD   ARG   4          HD2       ARG   4  -9.954  -4.667  -2.814
   42   2HD   ARG   4          HD1       ARG   4 -10.140  -2.975  -2.355
   43    HE   ARG   4           HE       ARG   4 -11.063  -3.030  -4.896
   44   1HH1  ARG   4          HH11      ARG   4 -11.795  -4.913  -2.050
   45   2HH1  ARG   4          HH12      ARG   4 -13.437  -5.208  -2.515
   46   1HH2  ARG   4          HH21      ARG   4 -13.221  -3.417  -5.509
   47   2HH2  ARG   4          HH22      ARG   4 -14.247  -4.359  -4.479
   48    H    LEU   5           HN       LEU   5  -6.510  -1.261  -2.286
   49    HA   LEU   5           HA       LEU   5  -6.241  -1.612   0.515
   50   1HB   LEU   5          HB2       LEU   5  -5.934   0.496  -1.094
   51   2HB   LEU   5          HB1       LEU   5  -7.568   0.821  -0.547
   52    HG   LEU   5           HG       LEU   5  -6.493   0.428   1.837
   53   1HD1  LEU   5          HD11      LEU   5  -4.132   1.812   0.887
   54   2HD1  LEU   5          HD12      LEU   5  -4.241   0.171   0.249
   55   3HD1  LEU   5          HD13      LEU   5  -4.275   0.444   1.991
   56   1HD2  LEU   5          HD21      LEU   5  -7.297   2.508   1.834
   57   2HD2  LEU   5          HD22      LEU   5  -6.902   2.746   0.133
   58   3HD2  LEU   5          HD23      LEU   5  -5.676   3.022   1.369
   59    H    LYS   6           HN       LYS   6  -7.734  -1.628   2.141
   60    HA   LYS   6           HA       LYS   6 -10.566  -1.725   1.339
   61   1HB   LYS   6          HB2       LYS   6  -8.973  -3.803   2.493
   62   2HB   LYS   6          HB1       LYS   6 -10.206  -3.329   3.653
   63   1HG   LYS   6          HG2       LYS   6 -11.244  -3.629   0.950
   64   2HG   LYS   6          HG1       LYS   6 -10.527  -5.108   1.591
   65   1HD   LYS   6          HD2       LYS   6 -11.951  -5.007   3.537
   66   2HD   LYS   6          HD1       LYS   6 -12.595  -3.446   3.027
   67   1HE   LYS   6          HE2       LYS   6 -14.117  -4.425   1.734
   68   2HE   LYS   6          HE1       LYS   6 -12.886  -5.396   0.929
   69   1HZ   LYS   6          HZ1       LYS   6 -13.758  -6.181   3.616
   70   2HZ   LYS   6          HZ2       LYS   6 -13.210  -7.144   2.339
   71   3HZ   LYS   6          HZ3       LYS   6 -14.779  -6.513   2.309
   72    H    PHE   7           HN       PHE   7  -8.433   0.089   2.926
   73    HA   PHE   7           HA       PHE   7 -10.456   1.252   4.627
   74   1HB   PHE   7          HB2       PHE   7  -7.858   0.420   5.918
   75   2HB   PHE   7          HB1       PHE   7  -9.296   1.067   6.699
   76    HD1  PHE   7           HD2      PHE   7  -7.817  -1.891   5.105
   77    HD2  PHE   7           HD1      PHE   7 -11.139  -0.339   7.264
   78    HE1  PHE   7           HE2      PHE   7  -8.609  -4.182   5.526
   79    HE2  PHE   7           HE1      PHE   7 -11.937  -2.627   7.691
   80    HZ   PHE   7           HZ       PHE   7 -10.671  -4.553   6.821
   81    H    ASP   8           HN       ASP   8 -10.337   3.287   3.923
   82    HA   ASP   8           HA       ASP   8  -8.158   4.522   2.730
   83   1HB   ASP   8          HB2       ASP   8  -9.347   6.677   3.297
   84   2HB   ASP   8          HB1       ASP   8 -10.326   5.482   2.451
   85    H    PHE   9           HN       PHE   9  -6.305   5.314   3.465
   86    HA   PHE   9           HA       PHE   9  -6.086   5.948   6.335
   87   1HB   PHE   9          HB2       PHE   9  -4.896   3.844   5.688
   88   2HB   PHE   9          HB1       PHE   9  -3.894   4.796   4.598
   89    HD1  PHE   9           HD1      PHE   9  -4.657   4.043   8.099
   90    HD2  PHE   9           HD2      PHE   9  -2.159   6.230   5.437
   91    HE1  PHE   9           HE1      PHE   9  -3.104   4.512   9.949
   92    HE2  PHE   9           HE2      PHE   9  -0.600   6.702   7.282
   93    HZ   PHE   9           HZ       PHE   9  -1.072   5.842   9.541
   94    H    GLN  10           HN       GLN  10  -5.401   7.940   6.801
   95    HA   GLN  10           HA       GLN  10  -4.643   9.699   4.616
   96   1HB   GLN  10          HB2       GLN  10  -6.248  10.127   6.720
   97   2HB   GLN  10          HB1       GLN  10  -4.734  10.692   7.414
   98   1HG   GLN  10          HG2       GLN  10  -5.391  11.691   4.718
   99   2HG   GLN  10          HG1       GLN  10  -6.410  12.258   6.040
  100   1HE2  GLN  10          HE21      GLN  10  -5.336  13.260   7.866
  101   2HE2  GLN  10          HE22      GLN  10  -3.872  14.140   7.606
  102    H    ALA  11           HN       ALA  11  -2.652  10.460   4.238
  103    HA   ALA  11           HA       ALA  11  -0.418   9.306   5.577
  104   1HB   ALA  11          HB1       ALA  11   0.895  10.891   4.109
  105   2HB   ALA  11          HB2       ALA  11  -0.654  11.438   3.468
  106   3HB   ALA  11          HB3       ALA  11  -0.163   9.756   3.270
  107    H    GLN  12           HN       GLN  12   0.752  10.047   7.235
  108    HA   GLN  12           HA       GLN  12   0.059  12.674   8.338
  109   1HB   GLN  12          HB2       GLN  12   1.442  11.634  10.331
  110   2HB   GLN  12          HB1       GLN  12  -0.248  11.224  10.089
  111   1HG   GLN  12          HG2       GLN  12   0.387   9.158   8.992
  112   2HG   GLN  12          HG1       GLN  12   2.091   9.581   9.146
  113   1HE2  GLN  12          HE21      GLN  12  -0.828   9.099  11.090
  114   2HE2  GLN  12          HE22      GLN  12  -0.021   8.392  12.444
  115    H    SER  13           HN       SER  13   2.738  10.708   7.222
  116    HA   SER  13           HA       SER  13   4.671  12.786   7.872
  117   1HB   SER  13          HB2       SER  13   4.803   9.979   7.608
  118   2HB   SER  13          HB1       SER  13   5.776  10.640   6.294
  119    HG   SER  13           HG       SER  13   6.023  11.484   8.987
  120    HA   PRO  14           HA       PRO  14   4.853  14.683   3.905
  121   1HB   PRO  14          HB2       PRO  14   7.536  14.927   3.459
  122   2HB   PRO  14          HB1       PRO  14   6.637  15.949   4.585
  123   1HG   PRO  14          HG2       PRO  14   8.317  13.535   5.144
  124   2HG   PRO  14          HG1       PRO  14   8.239  15.072   6.025
  125   1HD   PRO  14          HD2       PRO  14   6.972  12.863   6.900
  126   2HD   PRO  14          HD1       PRO  14   6.291  14.487   7.127
  127    H    LYS  15           HN       LYS  15   6.655  11.723   4.368
  128    HA   LYS  15           HA       LYS  15   6.919  11.289   1.500
  129   1HB   LYS  15          HB2       LYS  15   8.197   9.308   2.101
  130   2HB   LYS  15          HB1       LYS  15   8.797  10.706   2.983
  131   1HG   LYS  15          HG2       LYS  15   7.381   9.949   4.922
  132   2HG   LYS  15          HG1       LYS  15   7.106   8.453   4.027
  133   1HD   LYS  15          HD2       LYS  15   9.812   8.679   3.873
  134   2HD   LYS  15          HD1       LYS  15   9.495   9.392   5.456
  135   1HE   LYS  15          HE2       LYS  15   8.342   6.746   4.619
  136   2HE   LYS  15          HE1       LYS  15   9.925   6.884   5.380
  137   1HZ   LYS  15          HZ1       LYS  15   8.547   6.522   7.166
  138   2HZ   LYS  15          HZ2       LYS  15   7.267   7.421   6.521
  139   3HZ   LYS  15          HZ3       LYS  15   8.621   8.213   7.154
  140    H    GLU  16           HN       GLU  16   4.971  10.256   4.194
  141    HA   GLU  16           HA       GLU  16   3.911   7.882   3.185
  142   1HB   GLU  16          HB2       GLU  16   3.048   9.907   5.177
  143   2HB   GLU  16          HB1       GLU  16   1.811   8.811   4.574
  144   1HG   GLU  16          HG2       GLU  16   3.969   7.168   5.164
  145   2HG   GLU  16          HG1       GLU  16   3.929   8.343   6.477
  146    H    LEU  17           HN       LEU  17   1.721   7.507   2.336
  147    HA   LEU  17           HA       LEU  17   0.753   9.712   0.645
  148   1HB   LEU  17          HB2       LEU  17   2.134   8.123  -0.674
  149   2HB   LEU  17          HB1       LEU  17   1.028   6.837  -0.230
  150    HG   LEU  17           HG       LEU  17  -0.590   8.845  -1.331
  151   1HD1  LEU  17          HD11      LEU  17   1.910   8.422  -2.960
  152   2HD1  LEU  17          HD12      LEU  17   1.333   9.943  -2.279
  153   3HD1  LEU  17          HD13      LEU  17   0.421   9.150  -3.563
  154   1HD2  LEU  17          HD21      LEU  17   0.344   6.130  -2.087
  155   2HD2  LEU  17          HD22      LEU  17  -0.496   7.087  -3.307
  156   3HD2  LEU  17          HD23      LEU  17  -1.288   6.722  -1.774
  157    H    THR  18           HN       THR  18  -1.414   9.954   0.549
  158    HA   THR  18           HA       THR  18  -3.021   8.306   2.312
  159    HB   THR  18           HB       THR  18  -3.776  10.732   0.670
  160    HG1  THR  18           HG1      THR  18  -2.311  11.320   2.229
  161   1HG2  THR  18          HG21      THR  18  -5.262   9.212   2.778
  162   2HG2  THR  18          HG22      THR  18  -5.807   9.702   1.174
  163   3HG2  THR  18          HG23      THR  18  -5.589  10.912   2.439
  164    H    LEU  19           HN       LEU  19  -4.168   6.617   1.649
  165    HA   LEU  19           HA       LEU  19  -5.009   6.507  -1.170
  166   1HB   LEU  19          HB2       LEU  19  -3.109   4.986  -0.673
  167   2HB   LEU  19          HB1       LEU  19  -4.104   4.179   0.523
  168    HG   LEU  19           HG       LEU  19  -5.642   3.438  -1.211
  169   1HD1  LEU  19          HD11      LEU  19  -4.124   5.361  -2.819
  170   2HD1  LEU  19          HD12      LEU  19  -5.782   4.789  -2.996
  171   3HD1  LEU  19          HD13      LEU  19  -4.445   3.825  -3.622
  172   1HD2  LEU  19          HD21      LEU  19  -4.372   1.655  -1.681
  173   2HD2  LEU  19          HD22      LEU  19  -3.125   2.472  -0.739
  174   3HD2  LEU  19          HD23      LEU  19  -3.146   2.627  -2.496
  175    H    GLN  20           HN       GLN  20  -7.002   5.551  -1.608
  176    HA   GLN  20           HA       GLN  20  -8.735   5.192   0.748
  177   1HB   GLN  20          HB2       GLN  20  -9.172   7.140  -0.863
  178   2HB   GLN  20          HB1       GLN  20  -9.699   5.917  -2.012
  179   1HG   GLN  20          HG2       GLN  20 -11.673   5.699  -1.021
  180   2HG   GLN  20          HG1       GLN  20 -10.945   5.579   0.579
  181   1HE2  GLN  20          HE21      GLN  20 -11.598   7.081   1.920
  182   2HE2  GLN  20          HE22      GLN  20 -12.049   8.697   1.511
  183    H    LYS  21           HN       LYS  21 -10.552   3.680   0.459
  184    HA   LYS  21           HA       LYS  21  -9.707   1.141  -0.303
  185   1HB   LYS  21          HB2       LYS  21 -12.541   2.158  -0.031
  186   2HB   LYS  21          HB1       LYS  21 -12.065   0.467  -0.055
  187   1HG   LYS  21          HG2       LYS  21 -11.815   0.526   2.139
  188   2HG   LYS  21          HG1       LYS  21 -10.525   1.715   1.948
  189   1HD   LYS  21          HD2       LYS  21 -11.837   3.420   2.606
  190   2HD   LYS  21          HD1       LYS  21 -13.234   2.817   1.712
  191   1HE   LYS  21          HE2       LYS  21 -14.096   1.846   3.529
  192   2HE   LYS  21          HE1       LYS  21 -12.550   1.123   3.972
  193   1HZ   LYS  21          HZ1       LYS  21 -11.910   3.074   5.107
  194   2HZ   LYS  21          HZ2       LYS  21 -13.494   2.749   5.604
  195   3HZ   LYS  21          HZ3       LYS  21 -13.197   3.972   4.473
  196    H    GLY  22           HN       GLY  22 -10.232  -0.213  -2.046
  197   1HA   GLY  22          HA2       GLY  22 -11.078  -0.729  -4.171
  198   2HA   GLY  22          HA1       GLY  22 -11.593   0.946  -4.348
  199    H    ASP  23           HN       ASP  23  -8.552   1.274  -3.288
  200    HA   ASP  23           HA       ASP  23  -7.526   1.566  -6.008
  201   1HB   ASP  23          HB2       ASP  23  -7.417   3.267  -3.897
  202   2HB   ASP  23          HB1       ASP  23  -5.865   2.451  -3.731
  203    H    ILE  24           HN       ILE  24  -5.867   0.411  -6.817
  204    HA   ILE  24           HA       ILE  24  -4.633  -1.597  -5.045
  205    HB   ILE  24           HB       ILE  24  -4.308  -3.010  -7.016
  206   1HG1  ILE  24          HG12      ILE  24  -5.971  -2.080  -8.979
  207   2HG1  ILE  24          HG11      ILE  24  -5.252  -0.583  -8.394
  208   1HG2  ILE  24          HG21      ILE  24  -7.187  -2.403  -7.232
  209   2HG2  ILE  24          HG22      ILE  24  -6.574  -2.712  -5.607
  210   3HG2  ILE  24          HG23      ILE  24  -6.368  -3.923  -6.872
  211   1HD1  ILE  24          HD11      ILE  24  -3.441  -2.859  -8.962
  212   2HD1  ILE  24          HD12      ILE  24  -3.180  -1.124  -9.149
  213   3HD1  ILE  24          HD13      ILE  24  -4.158  -2.002 -10.326
  214    H    VAL  25           HN       VAL  25  -2.461  -1.679  -4.900
  215    HA   VAL  25           HA       VAL  25  -0.879  -0.097  -6.811
  216    HB   VAL  25           HB       VAL  25   0.579   0.662  -4.984
  217   1HG1  VAL  25          HG11      VAL  25  -2.244   1.424  -4.301
  218   2HG1  VAL  25          HG12      VAL  25  -1.471   1.941  -5.800
  219   3HG1  VAL  25          HG13      VAL  25  -0.789   2.419  -4.245
  220   1HG2  VAL  25          HG21      VAL  25  -0.466  -1.361  -3.519
  221   2HG2  VAL  25          HG22      VAL  25  -1.365   0.012  -2.874
  222   3HG2  VAL  25          HG23      VAL  25   0.398   0.016  -2.834
  223    H    TYR  26           HN       TYR  26   1.492  -0.628  -6.665
  224    HA   TYR  26           HA       TYR  26   1.796  -3.535  -6.379
  225   1HB   TYR  26          HB2       TYR  26   3.499  -1.563  -7.918
  226   2HB   TYR  26          HB1       TYR  26   3.718  -3.309  -7.891
  227    HD1  TYR  26           HD1      TYR  26   1.185  -4.474  -8.326
  228    HD2  TYR  26           HD2      TYR  26   2.705  -0.851  -9.956
  229    HE1  TYR  26           HE1      TYR  26  -0.345  -4.699 -10.237
  230    HE2  TYR  26           HE2      TYR  26   1.178  -1.065 -11.872
  231    HH   TYR  26           HH       TYR  26  -1.420  -3.191 -11.923
  232    H    ILE  27           HN       ILE  27   2.648  -4.121  -4.498
  233    HA   ILE  27           HA       ILE  27   4.343  -2.346  -2.981
  234    HB   ILE  27           HB       ILE  27   3.930  -5.217  -2.244
  235   1HG1  ILE  27          HG12      ILE  27   1.697  -4.591  -2.826
  236   2HG1  ILE  27          HG11      ILE  27   1.812  -4.483  -1.073
  237   1HG2  ILE  27          HG21      ILE  27   5.379  -3.563  -0.968
  238   2HG2  ILE  27          HG22      ILE  27   4.180  -4.464  -0.041
  239   3HG2  ILE  27          HG23      ILE  27   3.870  -2.787  -0.487
  240   1HD1  ILE  27          HD11      ILE  27   2.429  -1.957  -1.726
  241   2HD1  ILE  27          HD12      ILE  27   0.784  -2.517  -1.424
  242   3HD1  ILE  27          HD13      ILE  27   1.378  -2.377  -3.079
  243    H    HIS  28           HN       HIS  28   6.507  -2.430  -2.745
  244    HA   HIS  28           HA       HIS  28   7.967  -4.287  -4.465
  245   1HB   HIS  28          HB2       HIS  28   8.383  -1.774  -4.477
  246   2HB   HIS  28          HB1       HIS  28   9.120  -1.983  -2.893
  247    HD1  HIS  28           HD1      HIS  28   9.999  -1.827  -6.336
  248    HD2  HIS  28           HD2      HIS  28  11.320  -4.054  -3.085
  249    HE1  HIS  28           HE1      HIS  28  12.276  -2.676  -6.983
  250    HE2  HIS  28           HE2      HIS  28  13.039  -4.056  -5.017
  251    H    LYS  29           HN       LYS  29   8.562  -2.918  -1.225
  252    HA   LYS  29           HA       LYS  29   9.661  -5.526  -0.422
  253   1HB   LYS  29          HB2       LYS  29  10.804  -4.260   1.387
  254   2HB   LYS  29          HB1       LYS  29  11.285  -3.750  -0.226
  255   1HG   LYS  29          HG2       LYS  29  10.507  -1.676   0.066
  256   2HG   LYS  29          HG1       LYS  29   9.043  -2.235   0.877
  257   1HD   LYS  29          HD2       LYS  29  10.872  -2.800   2.770
  258   2HD   LYS  29          HD1       LYS  29  11.644  -1.410   2.005
  259   1HE   LYS  29          HE2       LYS  29   9.666  -0.068   2.365
  260   2HE   LYS  29          HE1       LYS  29   8.805  -1.459   3.024
  261   1HZ   LYS  29          HZ1       LYS  29   9.595  -0.082   4.805
  262   2HZ   LYS  29          HZ2       LYS  29  11.178  -0.122   4.211
  263   3HZ   LYS  29          HZ3       LYS  29  10.469  -1.532   4.819
  264    H    GLU  30           HN       GLU  30   9.060  -6.433   1.583
  265    HA   GLU  30           HA       GLU  30   6.542  -5.356   2.668
  266   1HB   GLU  30          HB2       GLU  30   7.377  -8.235   2.858
  267   2HB   GLU  30          HB1       GLU  30   5.778  -7.540   3.090
  268   1HG   GLU  30          HG2       GLU  30   6.437  -6.847   0.496
  269   2HG   GLU  30          HG1       GLU  30   7.058  -8.487   0.675
  270    H    VAL  31           HN       VAL  31   6.857  -4.380   4.500
  271    HA   VAL  31           HA       VAL  31   8.808  -5.488   6.398
  272    HB   VAL  31           HB       VAL  31   7.850  -2.984   7.333
  273   1HG1  VAL  31          HG11      VAL  31  10.497  -3.845   6.180
  274   2HG1  VAL  31          HG12      VAL  31  10.009  -3.886   7.874
  275   3HG1  VAL  31          HG13      VAL  31  10.229  -2.339   7.057
  276   1HG2  VAL  31          HG21      VAL  31   8.397  -1.451   5.579
  277   2HG2  VAL  31          HG22      VAL  31   7.213  -2.591   4.943
  278   3HG2  VAL  31          HG23      VAL  31   8.916  -2.763   4.521
  279    H    ASP  32           HN       ASP  32   7.608  -7.027   7.346
  280    HA   ASP  32           HA       ASP  32   4.923  -6.835   8.103
  281   1HB   ASP  32          HB2       ASP  32   7.181  -8.648   8.832
  282   2HB   ASP  32          HB1       ASP  32   5.687  -8.733   9.762
  283    H    LYS  33           HN       LYS  33   7.592  -5.277   9.513
  284    HA   LYS  33           HA       LYS  33   7.146  -5.343  12.220
  285   1HB   LYS  33          HB2       LYS  33   7.777  -2.780  12.063
  286   2HB   LYS  33          HB1       LYS  33   8.962  -4.033  11.729
  287   1HG   LYS  33          HG2       LYS  33   9.179  -3.421   9.596
  288   2HG   LYS  33          HG1       LYS  33   7.441  -3.214   9.377
  289   1HD   LYS  33          HD2       LYS  33   7.486  -1.008  10.042
  290   2HD   LYS  33          HD1       LYS  33   8.948  -1.221  11.008
  291   1HE   LYS  33          HE2       LYS  33  10.222  -1.519   8.887
  292   2HE   LYS  33          HE1       LYS  33   8.751  -1.117   8.002
  293   1HZ   LYS  33          HZ1       LYS  33   8.919   0.944   9.690
  294   2HZ   LYS  33          HZ2       LYS  33   9.574   0.952   8.131
  295   3HZ   LYS  33          HZ3       LYS  33  10.562   0.611   9.460
  296    H    ASN  34           HN       ASN  34   5.580  -3.152   9.902
  297    HA   ASN  34           HA       ASN  34   3.012  -3.307  10.707
  298   1HB   ASN  34          HB2       ASN  34   4.568  -1.881  12.727
  299   2HB   ASN  34          HB1       ASN  34   3.177  -0.964  12.159
  300   1HD2  ASN  34          HD21      ASN  34   2.782  -1.410  14.567
  301   2HD2  ASN  34          HD22      ASN  34   1.815  -2.797  14.918
  302    H    TRP  35           HN       TRP  35   4.903  -2.312   8.554
  303    HA   TRP  35           HA       TRP  35   3.120  -0.327   7.516
  304   1HB   TRP  35          HB2       TRP  35   5.372   0.577   8.961
  305   2HB   TRP  35          HB1       TRP  35   5.731   0.849   7.260
  306    HD1  TRP  35           HD1      TRP  35   3.263   1.957   5.993
  307    HE1  TRP  35           HE1      TRP  35   2.083   4.097   6.803
  308    HE3  TRP  35           HE3      TRP  35   5.061   2.116  10.777
  309    HZ2  TRP  35           HZ2      TRP  35   1.934   5.646   9.157
  310    HZ3  TRP  35           HZ3      TRP  35   4.350   3.960  12.243
  311    HH2  TRP  35           HH2      TRP  35   2.819   5.688  11.449
  312    H    LEU  36           HN       LEU  36   2.832  -1.016   5.492
  313    HA   LEU  36           HA       LEU  36   4.946  -2.448   4.115
  314   1HB   LEU  36          HB2       LEU  36   2.616  -3.273   4.186
  315   2HB   LEU  36          HB1       LEU  36   2.109  -1.844   3.304
  316    HG   LEU  36           HG       LEU  36   3.917  -2.698   1.572
  317   1HD1  LEU  36          HD11      LEU  36   3.013  -5.386   2.114
  318   2HD1  LEU  36          HD12      LEU  36   3.945  -4.741   3.467
  319   3HD1  LEU  36          HD13      LEU  36   4.649  -4.780   1.850
  320   1HD2  LEU  36          HD21      LEU  36   1.595  -4.353   1.218
  321   2HD2  LEU  36          HD22      LEU  36   2.065  -2.887   0.356
  322   3HD2  LEU  36          HD23      LEU  36   1.124  -2.772   1.844
  323    H    GLU  37           HN       GLU  37   5.936  -1.752   2.242
  324    HA   GLU  37           HA       GLU  37   5.471   1.063   1.522
  325   1HB   GLU  37          HB2       GLU  37   7.726   0.655   2.292
  326   2HB   GLU  37          HB1       GLU  37   7.909  -0.686   1.171
  327   1HG   GLU  37          HG2       GLU  37   7.703   0.893  -0.709
  328   2HG   GLU  37          HG1       GLU  37   7.614   2.220   0.447
  329    H    GLY  38           HN       GLY  38   4.770   1.591  -0.455
  330   1HA   GLY  38          HA2       GLY  38   5.122  -0.249  -2.684
  331   2HA   GLY  38          HA1       GLY  38   3.462   0.047  -2.190
  332    H    GLU  39           HN       GLU  39   3.708   0.713  -4.624
  333    HA   GLU  39           HA       GLU  39   3.740   3.620  -4.626
  334   1HB   GLU  39          HB2       GLU  39   5.047   3.432  -6.896
  335   2HB   GLU  39          HB1       GLU  39   5.916   3.488  -5.369
  336   1HG   GLU  39          HG2       GLU  39   6.195   1.089  -5.398
  337   2HG   GLU  39          HG1       GLU  39   5.231   0.971  -6.870
  338    H    HIS  40           HN       HIS  40   2.838   4.510  -6.671
  339    HA   HIS  40           HA       HIS  40   1.294   2.658  -8.288
  340   1HB   HIS  40          HB2       HIS  40  -0.052   3.286  -6.190
  341   2HB   HIS  40          HB1       HIS  40  -0.175   4.892  -6.901
  342    HD1  HIS  40           HD1      HIS  40  -0.584   1.479  -8.536
  343    HD2  HIS  40           HD2      HIS  40  -2.696   4.996  -7.878
  344    HE1  HIS  40           HE1      HIS  40  -2.761   1.195  -9.763
  345    HE2  HIS  40           HE2      HIS  40  -4.060   3.297  -9.271
  346    H    HIS  41           HN       HIS  41   1.085   3.350 -10.325
  347    HA   HIS  41           HA       HIS  41   1.415   4.609 -12.192
  348   1HB   HIS  41          HB2       HIS  41  -0.532   5.794 -10.790
  349   2HB   HIS  41          HB1       HIS  41   0.641   7.107 -10.778
  350    HD1  HIS  41           HD1      HIS  41  -2.197   6.359 -12.525
  351    HD2  HIS  41           HD2      HIS  41   1.682   7.149 -13.789
  352    HE1  HIS  41           HE1      HIS  41  -2.409   7.106 -14.917
  353    HE2  HIS  41           HE2      HIS  41  -0.042   7.506 -15.684
  354    H    GLY  42           HN       GLY  42   3.720   4.275 -10.571
  355   1HA   GLY  42          HA2       GLY  42   5.910   5.019 -10.822
  356   2HA   GLY  42          HA1       GLY  42   5.299   6.468 -11.602
  357    H    ARG  43           HN       ARG  43   3.472   6.462  -8.978
  358    HA   ARG  43           HA       ARG  43   5.282   8.237  -7.549
  359   1HB   ARG  43          HB2       ARG  43   2.667   8.505  -8.134
  360   2HB   ARG  43          HB1       ARG  43   2.534   7.769  -6.542
  361   1HG   ARG  43          HG2       ARG  43   4.306  10.138  -6.985
  362   2HG   ARG  43          HG1       ARG  43   2.570  10.336  -6.736
  363   1HD   ARG  43          HD2       ARG  43   2.797  10.051  -4.543
  364   2HD   ARG  43          HD1       ARG  43   3.649   8.526  -4.783
  365    HE   ARG  43           HE       ARG  43   5.552  10.374  -5.293
  366   1HH1  ARG  43          HH11      ARG  43   3.351   9.903  -2.626
  367   2HH1  ARG  43          HH12      ARG  43   4.425  10.591  -1.455
  368   1HH2  ARG  43          HH21      ARG  43   6.966  11.278  -3.756
  369   2HH2  ARG  43          HH22      ARG  43   6.478  11.372  -2.097
  370    H    LEU  44           HN       LEU  44   5.748   8.039  -5.330
  371    HA   LEU  44           HA       LEU  44   5.684   5.270  -4.382
  372   1HB   LEU  44          HB2       LEU  44   7.868   6.329  -4.453
  373   2HB   LEU  44          HB1       LEU  44   7.288   7.655  -3.464
  374    HG   LEU  44           HG       LEU  44   6.773   5.689  -1.756
  375   1HD1  LEU  44          HD11      LEU  44   9.018   4.618  -3.457
  376   2HD1  LEU  44          HD12      LEU  44   7.442   3.875  -3.188
  377   3HD1  LEU  44          HD13      LEU  44   8.591   4.011  -1.857
  378   1HD2  LEU  44          HD21      LEU  44   9.246   7.253  -2.296
  379   2HD2  LEU  44          HD22      LEU  44   9.288   6.014  -1.041
  380   3HD2  LEU  44          HD23      LEU  44   8.128   7.338  -0.934
  381    H    GLY  45           HN       GLY  45   4.427   4.641  -2.752
  382   1HA   GLY  45          HA2       GLY  45   3.505   6.592  -0.783
  383   2HA   GLY  45          HA1       GLY  45   2.274   5.783  -1.737
  384    H    ILE  46           HN       ILE  46   3.564   5.745   1.181
  385    HA   ILE  46           HA       ILE  46   3.507   2.813   1.426
  386    HB   ILE  46           HB       ILE  46   4.836   4.821   3.245
  387   1HG1  ILE  46          HG12      ILE  46   5.883   3.028   1.059
  388   2HG1  ILE  46          HG11      ILE  46   6.016   4.779   1.177
  389   1HG2  ILE  46          HG21      ILE  46   5.480   1.922   3.304
  390   2HG2  ILE  46          HG22      ILE  46   3.984   2.449   4.070
  391   3HG2  ILE  46          HG23      ILE  46   5.525   3.118   4.597
  392   1HD1  ILE  46          HD11      ILE  46   7.381   4.310   3.298
  393   2HD1  ILE  46          HD12      ILE  46   8.127   4.032   1.724
  394   3HD1  ILE  46          HD13      ILE  46   7.512   2.670   2.663
  395    H    PHE  47           HN       PHE  47   2.373   1.863   3.093
  396    HA   PHE  47           HA       PHE  47   0.858   3.404   4.988
  397   1HB   PHE  47          HB2       PHE  47  -1.343   2.374   4.167
  398   2HB   PHE  47          HB1       PHE  47  -0.698   3.723   3.239
  399    HD1  PHE  47           HD2      PHE  47  -0.481  -0.001   3.326
  400    HD2  PHE  47           HD1      PHE  47  -0.695   3.527   0.957
  401    HE1  PHE  47           HE2      PHE  47  -0.557  -1.380   1.289
  402    HE2  PHE  47           HE1      PHE  47  -0.772   2.156  -1.086
  403    HZ   PHE  47           HZ       PHE  47  -0.702  -0.301  -0.921
  404    HA   PRO  48           HA       PRO  48   1.158  -0.296   7.351
  405   1HB   PRO  48          HB2       PRO  48  -1.324  -0.480   8.518
  406   2HB   PRO  48          HB1       PRO  48  -0.039   0.595   9.077
  407   1HG   PRO  48          HG2       PRO  48  -2.403   1.203   7.350
  408   2HG   PRO  48          HG1       PRO  48  -1.696   2.164   8.662
  409   1HD   PRO  48          HD2       PRO  48  -1.247   2.750   6.076
  410   2HD   PRO  48          HD1       PRO  48   0.003   2.980   7.316
  411    H    ALA  49           HN       ALA  49   1.058  -2.392   6.858
  412    HA   ALA  49           HA       ALA  49  -0.464  -3.329   4.664
  413   1HB   ALA  49          HB1       ALA  49   0.620  -5.331   6.537
  414   2HB   ALA  49          HB2       ALA  49   1.782  -4.184   5.871
  415   3HB   ALA  49          HB3       ALA  49   0.812  -5.185   4.790
  416    H    ASN  50           HN       ASN  50  -0.947  -3.409   8.129
  417    HA   ASN  50           HA       ASN  50  -2.904  -5.393   8.293
  418   1HB   ASN  50          HB2       ASN  50  -1.886  -3.265   9.992
  419   2HB   ASN  50          HB1       ASN  50  -3.616  -3.506  10.216
  420   1HD2  ASN  50          HD21      ASN  50  -4.128  -6.016  10.155
  421   2HD2  ASN  50          HD22      ASN  50  -3.177  -6.940  11.263
  422    H    TYR  51           HN       TYR  51  -3.073  -2.226   6.963
  423    HA   TYR  51           HA       TYR  51  -6.003  -2.250   7.024
  424   1HB   TYR  51          HB2       TYR  51  -3.955  -0.114   6.521
  425   2HB   TYR  51          HB1       TYR  51  -5.611   0.097   5.962
  426    HD1  TYR  51           HD2      TYR  51  -3.977  -1.143   9.096
  427    HD2  TYR  51           HD1      TYR  51  -6.881   1.425   7.343
  428    HE1  TYR  51           HE2      TYR  51  -4.626  -0.359  11.335
  429    HE2  TYR  51           HE1      TYR  51  -7.538   2.217   9.577
  430    HH   TYR  51           HH       TYR  51  -6.939   0.713  12.311
  431    H    VAL  52           HN       VAL  52  -4.382  -4.031   5.313
  432    HA   VAL  52           HA       VAL  52  -5.781  -3.497   2.837
  433    HB   VAL  52           HB       VAL  52  -2.995  -4.149   2.224
  434   1HG1  VAL  52          HG11      VAL  52  -4.252  -1.763   1.071
  435   2HG1  VAL  52          HG12      VAL  52  -5.160  -3.260   0.859
  436   3HG1  VAL  52          HG13      VAL  52  -3.497  -3.148   0.282
  437   1HG2  VAL  52          HG21      VAL  52  -2.678  -2.568   4.129
  438   2HG2  VAL  52          HG22      VAL  52  -3.556  -1.353   3.199
  439   3HG2  VAL  52          HG23      VAL  52  -2.029  -1.996   2.592
  440    H    GLU  53           HN       GLU  53  -5.426  -5.292   1.244
  441    HA   GLU  53           HA       GLU  53  -4.970  -7.835   2.662
  442   1HB   GLU  53          HB2       GLU  53  -6.924  -7.230   0.433
  443   2HB   GLU  53          HB1       GLU  53  -6.621  -8.832   1.092
  444   1HG   GLU  53          HG2       GLU  53  -7.273  -7.776   3.352
  445   2HG   GLU  53          HG1       GLU  53  -7.978  -6.495   2.368
  446    H    VAL  54           HN       VAL  54  -3.275  -8.932   1.940
  447    HA   VAL  54           HA       VAL  54  -1.908  -8.142  -0.450
  448    HB   VAL  54           HB       VAL  54  -1.354 -10.574   1.252
  449   1HG1  VAL  54          HG11      VAL  54  -0.307 -10.081  -1.130
  450   2HG1  VAL  54          HG12      VAL  54   0.653 -10.759   0.185
  451   3HG1  VAL  54          HG13      VAL  54   0.747  -9.036  -0.177
  452   1HG2  VAL  54          HG21      VAL  54  -0.116  -7.843   1.546
  453   2HG2  VAL  54          HG22      VAL  54   0.110  -9.251   2.585
  454   3HG2  VAL  54          HG23      VAL  54  -1.447  -8.424   2.547
  455    H    LEU  55           HN       LEU  55  -2.409  -8.801  -2.432
  456    HA   LEU  55           HA       LEU  55  -2.750 -11.509  -3.137
  457   1HB   LEU  55          HB2       LEU  55  -5.106 -11.404  -3.901
  458   2HB   LEU  55          HB1       LEU  55  -4.928 -11.350  -2.158
  459    HG   LEU  55           HG       LEU  55  -5.044  -8.701  -3.412
  460   1HD1  LEU  55          HD11      LEU  55  -7.134  -8.723  -4.300
  461   2HD1  LEU  55          HD12      LEU  55  -7.677 -10.054  -3.279
  462   3HD1  LEU  55          HD13      LEU  55  -6.663 -10.378  -4.684
  463   1HD2  LEU  55          HD21      LEU  55  -6.076  -8.128  -1.469
  464   2HD2  LEU  55          HD22      LEU  55  -5.251  -9.585  -0.915
  465   3HD2  LEU  55          HD23      LEU  55  -6.957  -9.652  -1.356
  466    HA   PRO  56           HA       PRO  56  -1.308  -8.667  -6.495
  467   1HB   PRO  56          HB2       PRO  56  -0.053 -11.237  -7.294
  468   2HB   PRO  56          HB1       PRO  56   0.658  -9.624  -7.182
  469   1HG   PRO  56          HG2       PRO  56   1.207 -11.492  -5.360
  470   2HG   PRO  56          HG1       PRO  56   1.005  -9.792  -4.896
  471   1HD   PRO  56          HD2       PRO  56  -0.891 -12.082  -4.589
  472   2HD   PRO  56          HD1       PRO  56  -0.566 -10.731  -3.483
  473    H    LEU  57           HN       LEU  57  -2.048  -8.512  -8.587
  474    HA   LEU  57           HA       LEU  57  -3.594 -10.769  -9.655
  475   1HB   LEU  57          HB2       LEU  57  -4.568  -7.939  -9.906
  476   2HB   LEU  57          HB1       LEU  57  -5.447  -9.426 -10.209
  477    HG   LEU  57           HG       LEU  57  -4.905  -9.728  -7.576
  478   1HD1  LEU  57          HD11      LEU  57  -3.981  -7.772  -6.900
  479   2HD1  LEU  57          HD12      LEU  57  -5.678  -7.307  -6.774
  480   3HD1  LEU  57          HD13      LEU  57  -4.738  -6.838  -8.191
  481   1HD2  LEU  57          HD21      LEU  57  -7.105  -9.599  -9.061
  482   2HD2  LEU  57          HD22      LEU  57  -7.262  -8.052  -8.228
  483   3HD2  LEU  57          HD23      LEU  57  -7.154  -9.547  -7.298
  484    H    GLU  58           HN       GLU  58  -2.096 -11.266 -11.213
  485    HA   GLU  58           HA       GLU  58  -0.893  -9.279 -12.885
  486   1HB   GLU  58          HB2       GLU  58  -0.896 -12.265 -12.780
  487   2HB   GLU  58          HB1       GLU  58  -0.357 -11.475 -14.255
  488   1HG   GLU  58          HG2       GLU  58   1.502 -10.575 -13.261
  489   2HG   GLU  58          HG1       GLU  58   0.786 -10.600 -11.650
  Start of MODEL    8
    1   1H    MET   0          HT1       MET   0   6.933  -8.652  -6.735
    2   2H    MET   0          HT2       MET   0   6.786  -6.944  -6.797
    3   3H    MET   0          HT3       MET   0   7.938  -7.744  -7.786
    4    HA   MET   0           HA       MET   0   5.855  -6.965  -8.876
    5   1HB   MET   0          HB2       MET   0   7.574  -9.035  -9.332
    6   2HB   MET   0          HB1       MET   0   6.032  -9.879  -9.301
    7   1HG   MET   0          HG2       MET   0   6.487  -9.308 -11.552
    8   2HG   MET   0          HG1       MET   0   5.195  -8.248 -10.993
    9   1HE   MET   0          HE1       MET   0   6.290  -5.171 -10.244
   10   2HE   MET   0          HE2       MET   0   5.040  -6.163 -10.996
   11   3HE   MET   0          HE3       MET   0   6.024  -5.084 -11.985
   12    H    LYS   1           HN       LYS   1   4.924  -7.333  -6.195
   13    HA   LYS   1           HA       LYS   1   2.539  -8.997  -6.676
   14   1HB   LYS   1          HB2       LYS   1   3.982  -8.407  -4.089
   15   2HB   LYS   1          HB1       LYS   1   2.400  -9.169  -4.169
   16   1HG   LYS   1          HG2       LYS   1   3.455 -10.955  -5.594
   17   2HG   LYS   1          HG1       LYS   1   5.017 -10.243  -5.181
   18   1HD   LYS   1          HD2       LYS   1   4.944 -11.686  -3.453
   19   2HD   LYS   1          HD1       LYS   1   3.893 -10.470  -2.726
   20   1HE   LYS   1          HE2       LYS   1   2.466 -12.194  -2.493
   21   2HE   LYS   1          HE1       LYS   1   2.101 -11.872  -4.188
   22   1HZ   LYS   1          HZ1       LYS   1   4.043 -13.875  -3.167
   23   2HZ   LYS   1          HZ2       LYS   1   3.760 -13.542  -4.801
   24   3HZ   LYS   1          HZ3       LYS   1   2.530 -14.206  -3.849
   25    H    ALA   2           HN       ALA   2   0.662  -7.961  -6.745
   26    HA   ALA   2           HA       ALA   2   0.574  -5.165  -5.865
   27   1HB   ALA   2          HB1       ALA   2  -0.894  -4.741  -7.535
   28   2HB   ALA   2          HB2       ALA   2  -1.691  -6.307  -7.382
   29   3HB   ALA   2          HB3       ALA   2  -0.153  -6.180  -8.236
   30    H    ALA   3           HN       ALA   3  -0.929  -4.414  -4.418
   31    HA   ALA   3           HA       ALA   3  -2.597  -6.451  -3.090
   32   1HB   ALA   3          HB1       ALA   3  -1.935  -5.794  -1.027
   33   2HB   ALA   3          HB2       ALA   3  -1.718  -4.112  -1.511
   34   3HB   ALA   3          HB3       ALA   3  -0.486  -5.310  -1.907
   35    H    ARG   4           HN       ARG   4  -4.670  -5.892  -2.529
   36    HA   ARG   4           HA       ARG   4  -5.662  -3.398  -3.713
   37   1HB   ARG   4          HB2       ARG   4  -6.698  -5.467  -4.516
   38   2HB   ARG   4          HB1       ARG   4  -7.148  -5.894  -2.872
   39   1HG   ARG   4          HG2       ARG   4  -8.124  -3.269  -3.564
   40   2HG   ARG   4          HG1       ARG   4  -8.670  -4.484  -4.721
   41   1HD   ARG   4          HD2       ARG   4  -9.448  -5.871  -2.812
   42   2HD   ARG   4          HD1       ARG   4  -9.013  -4.552  -1.726
   43    HE   ARG   4           HE       ARG   4 -10.901  -3.427  -2.382
   44   1HH1  ARG   4          HH11      ARG   4 -10.314  -6.059  -4.597
   45   2HH1  ARG   4          HH12      ARG   4 -11.835  -5.883  -5.405
   46   1HH2  ARG   4          HH21      ARG   4 -12.902  -3.193  -3.444
   47   2HH2  ARG   4          HH22      ARG   4 -13.304  -4.256  -4.751
   48    H    LEU   5           HN       LEU   5  -5.989  -1.754  -2.384
   49    HA   LEU   5           HA       LEU   5  -5.875  -1.851   0.394
   50   1HB   LEU   5          HB2       LEU   5  -5.891   0.133  -1.419
   51   2HB   LEU   5          HB1       LEU   5  -7.535   0.273  -0.831
   52    HG   LEU   5           HG       LEU   5  -6.381   0.271   1.529
   53   1HD1  LEU   5          HD11      LEU   5  -4.147   0.639  -0.359
   54   2HD1  LEU   5          HD12      LEU   5  -4.155   0.010   1.289
   55   3HD1  LEU   5          HD13      LEU   5  -4.201   1.751   1.009
   56   1HD2  LEU   5          HD21      LEU   5  -6.083   2.783   1.269
   57   2HD2  LEU   5          HD22      LEU   5  -7.667   2.122   0.860
   58   3HD2  LEU   5          HD23      LEU   5  -6.533   2.551  -0.421
   59    H    LYS   6           HN       LYS   6  -7.656  -1.183   1.910
   60    HA   LYS   6           HA       LYS   6 -10.191  -2.469   1.139
   61   1HB   LYS   6          HB2       LYS   6  -8.392  -3.329   3.096
   62   2HB   LYS   6          HB1       LYS   6  -9.700  -2.566   3.990
   63   1HG   LYS   6          HG2       LYS   6  -9.943  -4.809   1.998
   64   2HG   LYS   6          HG1       LYS   6 -10.153  -4.911   3.747
   65   1HD   LYS   6          HD2       LYS   6 -12.112  -3.519   3.648
   66   2HD   LYS   6          HD1       LYS   6 -11.855  -3.207   1.931
   67   1HE   LYS   6          HE2       LYS   6 -11.912  -5.993   2.189
   68   2HE   LYS   6          HE1       LYS   6 -13.216  -5.399   3.216
   69   1HZ   LYS   6          HZ1       LYS   6 -13.547  -5.835   0.652
   70   2HZ   LYS   6          HZ2       LYS   6 -12.974  -4.248   0.541
   71   3HZ   LYS   6          HZ3       LYS   6 -14.359  -4.584   1.452
   72    H    PHE   7           HN       PHE   7  -8.634   0.159   2.857
   73    HA   PHE   7           HA       PHE   7 -11.156   1.593   2.862
   74   1HB   PHE   7          HB2       PHE   7 -11.251   2.045   5.183
   75   2HB   PHE   7          HB1       PHE   7 -10.985   0.310   5.053
   76    HD1  PHE   7           HD2      PHE   7  -8.847  -0.671   5.676
   77    HD2  PHE   7           HD1      PHE   7  -9.574   3.502   6.090
   78    HE1  PHE   7           HE2      PHE   7  -6.881  -0.477   7.143
   79    HE2  PHE   7           HE1      PHE   7  -7.609   3.703   7.557
   80    HZ   PHE   7           HZ       PHE   7  -6.261   1.712   8.085
   81    H    ASP   8           HN       ASP   8 -10.917   3.876   3.307
   82    HA   ASP   8           HA       ASP   8  -8.620   4.971   2.070
   83   1HB   ASP   8          HB2       ASP   8  -9.627   7.177   2.827
   84   2HB   ASP   8          HB1       ASP   8 -10.657   6.166   1.818
   85    H    PHE   9           HN       PHE   9  -6.680   5.108   2.965
   86    HA   PHE   9           HA       PHE   9  -6.440   5.374   5.868
   87   1HB   PHE   9          HB2       PHE   9  -5.142   3.592   4.773
   88   2HB   PHE   9          HB1       PHE   9  -4.329   4.795   3.778
   89    HD1  PHE   9           HD1      PHE   9  -4.784   3.614   7.251
   90    HD2  PHE   9           HD2      PHE   9  -2.455   5.966   4.576
   91    HE1  PHE   9           HE1      PHE   9  -3.060   3.875   8.987
   92    HE2  PHE   9           HE2      PHE   9  -0.727   6.231   6.306
   93    HZ   PHE   9           HZ       PHE   9  -1.028   5.185   8.516
   94    H    GLN  10           HN       GLN  10  -5.781   7.193   6.835
   95    HA   GLN  10           HA       GLN  10  -5.190   9.499   5.142
   96   1HB   GLN  10          HB2       GLN  10  -6.919   9.390   7.117
   97   2HB   GLN  10          HB1       GLN  10  -5.497   9.668   8.113
   98   1HG   GLN  10          HG2       GLN  10  -6.569  11.761   7.658
   99   2HG   GLN  10          HG1       GLN  10  -5.022  11.707   6.814
  100   1HE2  GLN  10          HE21      GLN  10  -6.045  13.469   5.589
  101   2HE2  GLN  10          HE22      GLN  10  -7.029  13.059   4.230
  102    H    ALA  11           HN       ALA  11  -3.117   9.830   4.692
  103    HA   ALA  11           HA       ALA  11  -0.981   8.805   6.272
  104   1HB   ALA  11          HB1       ALA  11  -0.692   9.040   3.897
  105   2HB   ALA  11          HB2       ALA  11   0.464  10.091   4.715
  106   3HB   ALA  11          HB3       ALA  11  -0.991  10.775   3.990
  107    H    GLN  12           HN       GLN  12   0.271   9.768   7.785
  108    HA   GLN  12           HA       GLN  12  -0.549  12.441   8.668
  109   1HB   GLN  12          HB2       GLN  12   0.908  11.659  10.721
  110   2HB   GLN  12          HB1       GLN  12  -0.757  11.132  10.542
  111   1HG   GLN  12          HG2       GLN  12  -0.013   9.017   9.623
  112   2HG   GLN  12          HG1       GLN  12   1.665   9.550   9.711
  113   1HE2  GLN  12          HE21      GLN  12   2.170  10.449  12.032
  114   2HE2  GLN  12          HE22      GLN  12   1.727   9.381  13.316
  115    H    SER  13           HN       SER  13   2.249  10.509   7.765
  116    HA   SER  13           HA       SER  13   3.954  12.891   7.973
  117   1HB   SER  13          HB2       SER  13   4.444   9.971   8.165
  118   2HB   SER  13          HB1       SER  13   5.709  10.929   7.396
  119    HG   SER  13           HG       SER  13   5.720  10.631   9.809
  120    HA   PRO  14           HA       PRO  14   4.246  13.598   3.643
  121   1HB   PRO  14          HB2       PRO  14   7.205  13.517   3.943
  122   2HB   PRO  14          HB1       PRO  14   6.175  14.786   3.271
  123   1HG   PRO  14          HG2       PRO  14   7.277  15.064   5.679
  124   2HG   PRO  14          HG1       PRO  14   5.627  15.632   5.359
  125   1HD   PRO  14          HD2       PRO  14   6.544  13.185   6.809
  126   2HD   PRO  14          HD1       PRO  14   5.171  14.256   7.157
  127    H    LYS  15           HN       LYS  15   6.187  11.046   5.061
  128    HA   LYS  15           HA       LYS  15   6.882   9.784   2.599
  129   1HB   LYS  15          HB2       LYS  15   8.094   9.517   4.800
  130   2HB   LYS  15          HB1       LYS  15   6.760   8.500   5.329
  131   1HG   LYS  15          HG2       LYS  15   7.236   7.069   3.288
  132   2HG   LYS  15          HG1       LYS  15   8.741   7.979   3.137
  133   1HD   LYS  15          HD2       LYS  15   7.961   6.630   5.705
  134   2HD   LYS  15          HD1       LYS  15   8.810   5.764   4.423
  135   1HE   LYS  15          HE2       LYS  15  10.612   6.492   5.605
  136   2HE   LYS  15          HE1       LYS  15  10.389   7.894   4.560
  137   1HZ   LYS  15          HZ1       LYS  15   9.955   7.624   7.418
  138   2HZ   LYS  15          HZ2       LYS  15   8.797   8.535   6.589
  139   3HZ   LYS  15          HZ3       LYS  15  10.429   8.975   6.517
  140    H    GLU  16           HN       GLU  16   4.152   9.632   4.754
  141    HA   GLU  16           HA       GLU  16   3.096   7.207   3.598
  142   1HB   GLU  16          HB2       GLU  16   2.222   9.124   5.716
  143   2HB   GLU  16          HB1       GLU  16   1.020   8.068   4.987
  144   1HG   GLU  16          HG2       GLU  16   2.595   6.153   5.553
  145   2HG   GLU  16          HG1       GLU  16   3.455   7.314   6.564
  146    H    LEU  17           HN       LEU  17   0.999   7.111   2.544
  147    HA   LEU  17           HA       LEU  17   0.265   9.583   1.130
  148   1HB   LEU  17          HB2       LEU  17   1.662   8.110  -0.308
  149   2HB   LEU  17          HB1       LEU  17   0.453   6.851  -0.137
  150    HG   LEU  17           HG       LEU  17  -1.051   8.959  -1.044
  151   1HD1  LEU  17          HD11      LEU  17   1.733   9.206  -2.094
  152   2HD1  LEU  17          HD12      LEU  17   0.597  10.466  -1.614
  153   3HD1  LEU  17          HD13      LEU  17   0.361   9.598  -3.131
  154   1HD2  LEU  17          HD21      LEU  17  -0.967   7.768  -3.227
  155   2HD2  LEU  17          HD22      LEU  17  -1.268   6.713  -1.847
  156   3HD2  LEU  17          HD23      LEU  17   0.334   6.769  -2.581
  157    H    THR  18           HN       THR  18  -1.876   9.959   0.930
  158    HA   THR  18           HA       THR  18  -3.674   8.103   2.272
  159    HB   THR  18           HB       THR  18  -4.169  10.895   1.221
  160    HG1  THR  18           HG1      THR  18  -2.848  11.139   2.916
  161   1HG2  THR  18          HG21      THR  18  -5.931  10.348   3.297
  162   2HG2  THR  18          HG22      THR  18  -5.987   8.923   2.259
  163   3HG2  THR  18          HG23      THR  18  -6.316  10.519   1.585
  164    H    LEU  19           HN       LEU  19  -4.955   6.740   1.215
  165    HA   LEU  19           HA       LEU  19  -5.936   7.423  -1.444
  166   1HB   LEU  19          HB2       LEU  19  -5.206   5.395  -2.475
  167   2HB   LEU  19          HB1       LEU  19  -3.807   6.188  -1.775
  168    HG   LEU  19           HG       LEU  19  -5.221   4.035  -0.241
  169   1HD1  LEU  19          HD11      LEU  19  -3.453   3.716  -2.624
  170   2HD1  LEU  19          HD12      LEU  19  -4.876   2.792  -2.145
  171   3HD1  LEU  19          HD13      LEU  19  -3.347   2.558  -1.298
  172   1HD2  LEU  19          HD21      LEU  19  -3.160   5.684   0.391
  173   2HD2  LEU  19          HD22      LEU  19  -2.295   4.289  -0.253
  174   3HD2  LEU  19          HD23      LEU  19  -3.415   4.087   1.094
  175    H    GLN  20           HN       GLN  20  -7.911   6.565  -1.915
  176    HA   GLN  20           HA       GLN  20  -9.364   5.385   0.281
  177   1HB   GLN  20          HB2       GLN  20 -10.120   7.123  -1.600
  178   2HB   GLN  20          HB1       GLN  20 -10.591   5.640  -2.418
  179   1HG   GLN  20          HG2       GLN  20 -11.756   5.094  -0.152
  180   2HG   GLN  20          HG1       GLN  20 -11.650   6.836   0.097
  181   1HE2  GLN  20          HE21      GLN  20 -13.633   7.582  -0.213
  182   2HE2  GLN  20          HE22      GLN  20 -14.624   7.267  -1.593
  183    H    LYS  21           HN       LYS  21 -10.663   3.433   0.057
  184    HA   LYS  21           HA       LYS  21  -9.172   1.236  -0.803
  185   1HB   LYS  21          HB2       LYS  21 -11.100  -0.092  -0.243
  186   2HB   LYS  21          HB1       LYS  21 -10.916   1.174   0.956
  187   1HG   LYS  21          HG2       LYS  21 -13.138   1.361   0.619
  188   2HG   LYS  21          HG1       LYS  21 -12.599   2.418  -0.688
  189   1HD   LYS  21          HD2       LYS  21 -12.870   0.682  -2.302
  190   2HD   LYS  21          HD1       LYS  21 -13.134  -0.526  -1.044
  191   1HE   LYS  21          HE2       LYS  21 -15.130   1.031  -0.386
  192   2HE   LYS  21          HE1       LYS  21 -14.965   1.610  -2.043
  193   1HZ   LYS  21          HZ1       LYS  21 -15.628  -0.376  -2.904
  194   2HZ   LYS  21          HZ2       LYS  21 -16.509  -0.404  -1.460
  195   3HZ   LYS  21          HZ3       LYS  21 -15.069  -1.282  -1.588
  196    H    GLY  22           HN       GLY  22  -9.855  -0.413  -2.390
  197   1HA   GLY  22          HA2       GLY  22 -10.877  -1.052  -4.419
  198   2HA   GLY  22          HA1       GLY  22 -11.393   0.616  -4.656
  199    H    ASP  23           HN       ASP  23  -8.315   1.023  -3.792
  200    HA   ASP  23           HA       ASP  23  -7.421   1.077  -6.578
  201   1HB   ASP  23          HB2       ASP  23  -6.786   2.636  -4.138
  202   2HB   ASP  23          HB1       ASP  23  -5.453   2.363  -5.256
  203    H    ILE  24           HN       ILE  24  -5.435   0.211  -7.229
  204    HA   ILE  24           HA       ILE  24  -4.334  -1.824  -5.403
  205    HB   ILE  24           HB       ILE  24  -4.223  -1.909  -8.416
  206   1HG1  ILE  24          HG12      ILE  24  -6.558  -2.022  -7.727
  207   2HG1  ILE  24          HG11      ILE  24  -6.017  -3.609  -8.267
  208   1HG2  ILE  24          HG21      ILE  24  -3.702  -3.999  -6.305
  209   2HG2  ILE  24          HG22      ILE  24  -2.490  -3.187  -7.297
  210   3HG2  ILE  24          HG23      ILE  24  -3.662  -4.271  -8.048
  211   1HD1  ILE  24          HD11      ILE  24  -7.361  -3.879  -6.317
  212   2HD1  ILE  24          HD12      ILE  24  -6.405  -2.690  -5.432
  213   3HD1  ILE  24          HD13      ILE  24  -5.688  -4.235  -5.888
  214    H    VAL  25           HN       VAL  25  -2.147  -1.963  -5.127
  215    HA   VAL  25           HA       VAL  25  -0.467  -0.069  -6.626
  216    HB   VAL  25           HB       VAL  25   0.809   0.397  -4.553
  217   1HG1  VAL  25          HG11      VAL  25  -1.263   1.623  -3.415
  218   2HG1  VAL  25          HG12      VAL  25  -2.021   1.183  -4.946
  219   3HG1  VAL  25          HG13      VAL  25  -0.559   2.169  -4.937
  220   1HG2  VAL  25          HG21      VAL  25  -1.389  -0.520  -2.818
  221   2HG2  VAL  25          HG22      VAL  25   0.353  -0.518  -2.542
  222   3HG2  VAL  25          HG23      VAL  25  -0.384  -1.790  -3.516
  223    H    TYR  26           HN       TYR  26   1.762  -0.631  -6.774
  224    HA   TYR  26           HA       TYR  26   2.203  -3.523  -6.585
  225   1HB   TYR  26          HB2       TYR  26   3.743  -1.408  -8.107
  226   2HB   TYR  26          HB1       TYR  26   4.071  -3.137  -8.149
  227    HD1  TYR  26           HD1      TYR  26   1.200  -0.798  -8.685
  228    HD2  TYR  26           HD2      TYR  26   3.222  -4.329  -9.929
  229    HE1  TYR  26           HE1      TYR  26  -0.392  -1.048 -10.543
  230    HE2  TYR  26           HE2      TYR  26   1.636  -4.588 -11.791
  231    HH   TYR  26           HH       TYR  26  -1.232  -3.188 -11.972
  232    H    ILE  27           HN       ILE  27   3.097  -4.122  -4.721
  233    HA   ILE  27           HA       ILE  27   4.835  -2.364  -3.233
  234    HB   ILE  27           HB       ILE  27   4.440  -5.256  -2.553
  235   1HG1  ILE  27          HG12      ILE  27   2.193  -4.569  -3.001
  236   2HG1  ILE  27          HG11      ILE  27   2.400  -4.527  -1.253
  237   1HG2  ILE  27          HG21      ILE  27   4.844  -4.588  -0.352
  238   2HG2  ILE  27          HG22      ILE  27   4.501  -2.895  -0.707
  239   3HG2  ILE  27          HG23      ILE  27   5.980  -3.640  -1.311
  240   1HD1  ILE  27          HD11      ILE  27   2.033  -2.299  -3.177
  241   2HD1  ILE  27          HD12      ILE  27   2.985  -2.007  -1.721
  242   3HD1  ILE  27          HD13      ILE  27   1.314  -2.557  -1.587
  243    H    HIS  28           HN       HIS  28   6.995  -2.361  -3.198
  244    HA   HIS  28           HA       HIS  28   8.402  -4.248  -4.927
  245   1HB   HIS  28          HB2       HIS  28   8.914  -1.516  -3.919
  246   2HB   HIS  28          HB1       HIS  28  10.334  -2.545  -4.067
  247    HD1  HIS  28           HD1      HIS  28  11.460  -1.985  -6.189
  248    HD2  HIS  28           HD2      HIS  28   7.325  -2.003  -6.600
  249    HE1  HIS  28           HE1      HIS  28  11.024  -1.517  -8.621
  250    HE2  HIS  28           HE2      HIS  28   8.517  -1.604  -8.860
  251    H    LYS  29           HN       LYS  29   8.524  -3.013  -1.603
  252    HA   LYS  29           HA       LYS  29   9.928  -5.481  -0.826
  253   1HB   LYS  29          HB2       LYS  29  10.986  -3.995   1.002
  254   2HB   LYS  29          HB1       LYS  29  11.637  -3.903  -0.628
  255   1HG   LYS  29          HG2       LYS  29  10.769  -1.805  -1.004
  256   2HG   LYS  29          HG1       LYS  29   9.506  -1.994   0.214
  257   1HD   LYS  29          HD2       LYS  29  12.256  -2.122   1.244
  258   2HD   LYS  29          HD1       LYS  29  11.786  -0.562   0.568
  259   1HE   LYS  29          HE2       LYS  29   9.664  -1.592   2.202
  260   2HE   LYS  29          HE1       LYS  29  11.177  -1.604   3.110
  261   1HZ   LYS  29          HZ1       LYS  29   9.629   0.521   2.960
  262   2HZ   LYS  29          HZ2       LYS  29  10.573   0.807   1.586
  263   3HZ   LYS  29          HZ3       LYS  29  11.312   0.640   3.098
  264    H    GLU  30           HN       GLU  30   9.440  -6.297   1.251
  265    HA   GLU  30           HA       GLU  30   6.954  -5.211   2.401
  266   1HB   GLU  30          HB2       GLU  30   7.853  -8.067   2.667
  267   2HB   GLU  30          HB1       GLU  30   6.252  -7.395   2.949
  268   1HG   GLU  30          HG2       GLU  30   6.674  -6.779   0.324
  269   2HG   GLU  30          HG1       GLU  30   7.491  -8.333   0.479
  270    H    VAL  31           HN       VAL  31   7.575  -3.998   4.065
  271    HA   VAL  31           HA       VAL  31   9.602  -5.021   5.907
  272    HB   VAL  31           HB       VAL  31   8.332  -2.482   6.604
  273   1HG1  VAL  31          HG11      VAL  31  10.367  -2.003   7.452
  274   2HG1  VAL  31          HG12      VAL  31  11.223  -2.680   6.066
  275   3HG1  VAL  31          HG13      VAL  31  10.584  -3.748   7.316
  276   1HG2  VAL  31          HG21      VAL  31   8.203  -2.131   4.237
  277   2HG2  VAL  31          HG22      VAL  31   9.842  -2.736   4.009
  278   3HG2  VAL  31          HG23      VAL  31   9.576  -1.205   4.844
  279    H    ASP  32           HN       ASP  32   8.594  -6.573   7.012
  280    HA   ASP  32           HA       ASP  32   5.971  -6.526   7.995
  281   1HB   ASP  32          HB2       ASP  32   8.390  -8.108   8.863
  282   2HB   ASP  32          HB1       ASP  32   6.777  -8.374   9.518
  283    H    LYS  33           HN       LYS  33   8.715  -4.827   9.104
  284    HA   LYS  33           HA       LYS  33   8.459  -4.760  11.841
  285   1HB   LYS  33          HB2       LYS  33  10.055  -3.470  10.183
  286   2HB   LYS  33          HB1       LYS  33   8.880  -2.178  10.394
  287   1HG   LYS  33          HG2       LYS  33   9.418  -3.070  12.973
  288   2HG   LYS  33          HG1       LYS  33  10.982  -3.066  12.158
  289   1HD   LYS  33          HD2       LYS  33  11.094  -0.854  12.343
  290   2HD   LYS  33          HD1       LYS  33   9.582  -0.684  11.449
  291   1HE   LYS  33          HE2       LYS  33   8.296  -0.812  13.451
  292   2HE   LYS  33          HE1       LYS  33   9.707  -1.283  14.398
  293   1HZ   LYS  33          HZ1       LYS  33  10.565   0.846  14.333
  294   2HZ   LYS  33          HZ2       LYS  33   8.907   1.141  14.486
  295   3HZ   LYS  33          HZ3       LYS  33   9.658   1.300  12.979
  296    H    ASN  34           HN       ASN  34   6.782  -2.660   9.519
  297    HA   ASN  34           HA       ASN  34   4.261  -2.717  10.481
  298   1HB   ASN  34          HB2       ASN  34   5.935  -1.375  12.406
  299   2HB   ASN  34          HB1       ASN  34   4.722  -0.262  11.788
  300   1HD2  ASN  34          HD21      ASN  34   4.431  -3.750  12.182
  301   2HD2  ASN  34          HD22      ASN  34   3.169  -3.692  13.360
  302    H    TRP  35           HN       TRP  35   6.029  -1.886   8.170
  303    HA   TRP  35           HA       TRP  35   4.252   0.121   7.154
  304   1HB   TRP  35          HB2       TRP  35   6.647   0.979   8.396
  305   2HB   TRP  35          HB1       TRP  35   6.876   1.176   6.662
  306    HD1  TRP  35           HD1      TRP  35   3.669   1.889   6.192
  307    HE1  TRP  35           HE1      TRP  35   2.916   4.282   6.766
  308    HE3  TRP  35           HE3      TRP  35   7.507   3.224   9.293
  309    HZ2  TRP  35           HZ2      TRP  35   3.829   6.449   8.328
  310    HZ3  TRP  35           HZ3      TRP  35   7.493   5.475  10.286
  311    HH2  TRP  35           HH2      TRP  35   5.691   7.054   9.812
  312    H    LEU  36           HN       LEU  36   3.803  -0.659   5.188
  313    HA   LEU  36           HA       LEU  36   5.788  -2.213   3.750
  314   1HB   LEU  36          HB2       LEU  36   3.438  -2.970   4.055
  315   2HB   LEU  36          HB1       LEU  36   2.916  -1.609   3.080
  316    HG   LEU  36           HG       LEU  36   4.683  -2.723   1.385
  317   1HD1  LEU  36          HD11      LEU  36   3.432  -5.221   2.218
  318   2HD1  LEU  36          HD12      LEU  36   4.585  -4.590   3.396
  319   3HD1  LEU  36          HD13      LEU  36   5.097  -4.891   1.734
  320   1HD2  LEU  36          HD21      LEU  36   1.844  -2.593   1.734
  321   2HD2  LEU  36          HD22      LEU  36   2.278  -4.132   0.984
  322   3HD2  LEU  36          HD23      LEU  36   2.782  -2.614   0.241
  323    H    GLU  37           HN       GLU  37   6.604  -1.656   1.740
  324    HA   GLU  37           HA       GLU  37   6.253   1.156   0.992
  325   1HB   GLU  37          HB2       GLU  37   8.544  -0.197   1.378
  326   2HB   GLU  37          HB1       GLU  37   8.320  -0.498  -0.340
  327   1HG   GLU  37          HG2       GLU  37   7.870   2.160  -0.245
  328   2HG   GLU  37          HG1       GLU  37   9.024   1.977   1.076
  329    H    GLY  38           HN       GLY  38   5.108   1.698  -0.741
  330   1HA   GLY  38          HA2       GLY  38   4.978  -0.122  -3.022
  331   2HA   GLY  38          HA1       GLY  38   3.457   0.263  -2.232
  332    H    GLU  39           HN       GLU  39   4.155   0.835  -4.948
  333    HA   GLU  39           HA       GLU  39   3.674   3.709  -4.902
  334   1HB   GLU  39          HB2       GLU  39   5.334   3.867  -6.901
  335   2HB   GLU  39          HB1       GLU  39   5.957   3.896  -5.257
  336   1HG   GLU  39          HG2       GLU  39   6.580   1.576  -5.402
  337   2HG   GLU  39          HG1       GLU  39   5.841   1.445  -6.998
  338    H    HIS  40           HN       HIS  40   2.880   4.533  -6.961
  339    HA   HIS  40           HA       HIS  40   1.977   2.571  -8.904
  340   1HB   HIS  40          HB2       HIS  40  -0.387   3.466  -8.742
  341   2HB   HIS  40          HB1       HIS  40   0.133   2.456  -7.398
  342    HD1  HIS  40           HD1      HIS  40  -1.957   5.087  -7.711
  343    HD2  HIS  40           HD2      HIS  40   1.527   4.656  -5.488
  344    HE1  HIS  40           HE1      HIS  40  -2.115   6.797  -5.874
  345    HE2  HIS  40           HE2      HIS  40   0.059   6.599  -4.618
  346    H    HIS  41           HN       HIS  41   1.948   3.389 -10.909
  347    HA   HIS  41           HA       HIS  41   2.439   4.837 -12.596
  348   1HB   HIS  41          HB2       HIS  41   0.926   6.742 -12.786
  349   2HB   HIS  41          HB1       HIS  41   0.058   5.314 -12.235
  350    HD1  HIS  41           HD1      HIS  41  -1.190   5.498 -10.064
  351    HD2  HIS  41           HD2      HIS  41   1.367   8.708 -10.716
  352    HE1  HIS  41           HE1      HIS  41  -1.729   7.165  -8.260
  353    HE2  HIS  41           HE2      HIS  41  -0.221   9.130  -8.719
  354    H    GLY  42           HN       GLY  42   4.364   4.928 -10.562
  355   1HA   GLY  42          HA2       GLY  42   6.304   6.206 -10.350
  356   2HA   GLY  42          HA1       GLY  42   5.467   7.558 -11.093
  357    H    ARG  43           HN       ARG  43   3.297   6.779  -8.893
  358    HA   ARG  43           HA       ARG  43   4.363   8.688  -6.966
  359   1HB   ARG  43          HB2       ARG  43   1.832   8.271  -8.025
  360   2HB   ARG  43          HB1       ARG  43   1.707   7.628  -6.393
  361   1HG   ARG  43          HG2       ARG  43   2.668  10.392  -7.104
  362   2HG   ARG  43          HG1       ARG  43   1.053   9.983  -6.521
  363   1HD   ARG  43          HD2       ARG  43   1.877   9.331  -4.406
  364   2HD   ARG  43          HD1       ARG  43   3.544   9.311  -4.978
  365    HE   ARG  43           HE       ARG  43   2.045  11.592  -4.076
  366   1HH1  ARG  43          HH11      ARG  43   4.735  10.523  -6.025
  367   2HH1  ARG  43          HH12      ARG  43   5.565  12.040  -5.935
  368   1HH2  ARG  43          HH21      ARG  43   3.135  13.588  -3.957
  369   2HH2  ARG  43          HH22      ARG  43   4.657  13.781  -4.761
  370    H    LEU  44           HN       LEU  44   5.257   8.077  -5.103
  371    HA   LEU  44           HA       LEU  44   4.973   5.285  -4.283
  372   1HB   LEU  44          HB2       LEU  44   7.013   5.445  -3.222
  373   2HB   LEU  44          HB1       LEU  44   7.228   6.514  -4.593
  374    HG   LEU  44           HG       LEU  44   6.540   7.441  -1.804
  375   1HD1  LEU  44          HD11      LEU  44   8.857   8.185  -1.669
  376   2HD1  LEU  44          HD12      LEU  44   9.188   7.466  -3.245
  377   3HD1  LEU  44          HD13      LEU  44   8.763   6.437  -1.877
  378   1HD2  LEU  44          HD21      LEU  44   7.403   9.630  -2.837
  379   2HD2  LEU  44          HD22      LEU  44   5.780   9.090  -3.266
  380   3HD2  LEU  44          HD23      LEU  44   7.116   8.844  -4.390
  381    H    GLY  45           HN       GLY  45   3.913   4.667  -2.520
  382   1HA   GLY  45          HA2       GLY  45   3.303   6.635  -0.434
  383   2HA   GLY  45          HA1       GLY  45   1.962   5.810  -1.212
  384    H    ILE  46           HN       ILE  46   3.541   5.808   1.540
  385    HA   ILE  46           HA       ILE  46   3.582   2.873   1.796
  386    HB   ILE  46           HB       ILE  46   5.079   4.926   3.428
  387   1HG1  ILE  46          HG12      ILE  46   5.954   3.050   1.229
  388   2HG1  ILE  46          HG11      ILE  46   5.985   4.809   1.202
  389   1HG2  ILE  46          HG21      ILE  46   6.091   2.247   3.630
  390   2HG2  ILE  46          HG22      ILE  46   4.392   2.290   4.091
  391   3HG2  ILE  46          HG23      ILE  46   5.550   3.337   4.905
  392   1HD1  ILE  46          HD11      ILE  46   8.170   4.363   1.622
  393   2HD1  ILE  46          HD12      ILE  46   7.813   2.896   2.535
  394   3HD1  ILE  46          HD13      ILE  46   7.561   4.480   3.272
  395    H    PHE  47           HN       PHE  47   2.631   1.912   3.576
  396    HA   PHE  47           HA       PHE  47   1.360   3.441   5.644
  397   1HB   PHE  47          HB2       PHE  47  -0.937   2.422   5.061
  398   2HB   PHE  47          HB1       PHE  47  -0.401   3.824   4.141
  399    HD1  PHE  47           HD1      PHE  47  -0.079   0.106   3.971
  400    HD2  PHE  47           HD2      PHE  47  -0.770   3.751   1.886
  401    HE1  PHE  47           HE1      PHE  47  -0.392  -1.153   1.880
  402    HE2  PHE  47           HE2      PHE  47  -1.085   2.498  -0.208
  403    HZ   PHE  47           HZ       PHE  47  -0.897   0.043  -0.212
  404    HA   PRO  48           HA       PRO  48   1.859  -0.213   8.040
  405   1HB   PRO  48          HB2       PRO  48  -1.018  -0.032   8.787
  406   2HB   PRO  48          HB1       PRO  48   0.411  -0.131   9.823
  407   1HG   PRO  48          HG2       PRO  48  -0.886   2.175   9.513
  408   2HG   PRO  48          HG1       PRO  48   0.884   2.129   9.613
  409   1HD   PRO  48          HD2       PRO  48  -0.874   2.499   7.228
  410   2HD   PRO  48          HD1       PRO  48   0.700   3.234   7.596
  411    H    ALA  49           HN       ALA  49   1.808  -2.335   7.597
  412    HA   ALA  49           HA       ALA  49   0.390  -3.317   5.356
  413   1HB   ALA  49          HB1       ALA  49   1.715  -4.991   7.475
  414   2HB   ALA  49          HB2       ALA  49   2.604  -4.145   6.208
  415   3HB   ALA  49          HB3       ALA  49   1.440  -5.400   5.782
  416    H    ASN  50           HN       ASN  50  -0.620  -2.853   8.551
  417    HA   ASN  50           HA       ASN  50  -2.495  -5.068   8.570
  418   1HB   ASN  50          HB2       ASN  50  -1.246  -4.144  10.617
  419   2HB   ASN  50          HB1       ASN  50  -2.406  -2.820  10.572
  420   1HD2  ASN  50          HD21      ASN  50  -2.440  -6.363  10.316
  421   2HD2  ASN  50          HD22      ASN  50  -3.775  -6.595  11.388
  422    H    TYR  51           HN       TYR  51  -2.583  -2.540   6.725
  423    HA   TYR  51           HA       TYR  51  -5.455  -2.054   7.149
  424   1HB   TYR  51          HB2       TYR  51  -3.343  -0.044   6.355
  425   2HB   TYR  51          HB1       TYR  51  -5.073   0.258   6.245
  426    HD1  TYR  51           HD2      TYR  51  -5.942  -1.080   8.795
  427    HD2  TYR  51           HD1      TYR  51  -2.690   1.536   7.968
  428    HE1  TYR  51           HE2      TYR  51  -5.960  -0.327  11.135
  429    HE2  TYR  51           HE1      TYR  51  -2.700   2.296  10.307
  430    HH   TYR  51           HH       TYR  51  -4.168   2.397  12.205
  431    H    VAL  52           HN       VAL  52  -3.794  -3.862   5.349
  432    HA   VAL  52           HA       VAL  52  -5.354  -3.380   2.965
  433    HB   VAL  52           HB       VAL  52  -3.355  -2.001   2.550
  434   1HG1  VAL  52          HG11      VAL  52  -1.168  -2.916   2.391
  435   2HG1  VAL  52          HG12      VAL  52  -1.770  -4.561   2.596
  436   3HG1  VAL  52          HG13      VAL  52  -1.826  -3.426   3.946
  437   1HG2  VAL  52          HG21      VAL  52  -4.603  -3.396   0.769
  438   2HG2  VAL  52          HG22      VAL  52  -3.147  -4.391   0.757
  439   3HG2  VAL  52          HG23      VAL  52  -3.048  -2.679   0.349
  440    H    GLU  53           HN       GLU  53  -5.231  -5.173   1.432
  441    HA   GLU  53           HA       GLU  53  -4.386  -7.674   2.742
  442   1HB   GLU  53          HB2       GLU  53  -6.197  -8.721   1.270
  443   2HB   GLU  53          HB1       GLU  53  -6.733  -7.760   2.641
  444   1HG   GLU  53          HG2       GLU  53  -7.094  -5.852   1.124
  445   2HG   GLU  53          HG1       GLU  53  -6.639  -6.880  -0.235
  446    H    VAL  54           HN       VAL  54  -2.776  -8.699   1.771
  447    HA   VAL  54           HA       VAL  54  -1.804  -7.889  -0.792
  448    HB   VAL  54           HB       VAL  54  -0.282  -8.647   0.987
  449   1HG1  VAL  54          HG11      VAL  54  -1.832 -10.446   1.824
  450   2HG1  VAL  54          HG12      VAL  54  -0.135 -10.907   1.691
  451   3HG1  VAL  54          HG13      VAL  54  -1.291 -11.434   0.468
  452   1HG2  VAL  54          HG21      VAL  54   0.073 -10.669  -1.165
  453   2HG2  VAL  54          HG22      VAL  54   1.244  -9.561  -0.448
  454   3HG2  VAL  54          HG23      VAL  54   0.061  -8.963  -1.611
  455    H    LEU  55           HN       LEU  55  -2.500  -8.565  -2.701
  456    HA   LEU  55           HA       LEU  55  -2.977 -11.278  -3.330
  457   1HB   LEU  55          HB2       LEU  55  -5.395 -11.107  -3.845
  458   2HB   LEU  55          HB1       LEU  55  -5.035 -11.025  -2.131
  459    HG   LEU  55           HG       LEU  55  -5.070  -8.360  -2.965
  460   1HD1  LEU  55          HD11      LEU  55  -6.680  -8.015  -4.485
  461   2HD1  LEU  55          HD12      LEU  55  -7.693  -9.315  -3.857
  462   3HD1  LEU  55          HD13      LEU  55  -6.363  -9.685  -4.953
  463   1HD2  LEU  55          HD21      LEU  55  -7.275  -8.370  -1.702
  464   2HD2  LEU  55          HD22      LEU  55  -5.860  -8.969  -0.836
  465   3HD2  LEU  55          HD23      LEU  55  -7.031 -10.106  -1.504
  466    HA   PRO  56           HA       PRO  56  -1.704  -8.427  -6.796
  467   1HB   PRO  56          HB2       PRO  56  -0.732 -11.120  -7.640
  468   2HB   PRO  56          HB1       PRO  56   0.069  -9.549  -7.756
  469   1HG   PRO  56          HG2       PRO  56   0.787 -11.292  -5.881
  470   2HG   PRO  56          HG1       PRO  56   0.700  -9.557  -5.522
  471   1HD   PRO  56          HD2       PRO  56  -1.172 -11.749  -4.759
  472   2HD   PRO  56          HD1       PRO  56  -0.719 -10.286  -3.862
  473    H    LEU  57           HN       LEU  57  -3.444  -7.971  -8.006
  474    HA   LEU  57           HA       LEU  57  -5.088 -10.132  -9.075
  475   1HB   LEU  57          HB2       LEU  57  -5.527  -7.164  -9.363
  476   2HB   LEU  57          HB1       LEU  57  -6.695  -8.444  -9.628
  477    HG   LEU  57           HG       LEU  57  -5.810  -8.721  -6.960
  478   1HD1  LEU  57          HD11      LEU  57  -5.992  -5.908  -7.848
  479   2HD1  LEU  57          HD12      LEU  57  -5.071  -6.628  -6.527
  480   3HD1  LEU  57          HD13      LEU  57  -6.797  -6.320  -6.333
  481   1HD2  LEU  57          HD21      LEU  57  -8.376  -7.366  -7.475
  482   2HD2  LEU  57          HD22      LEU  57  -8.025  -8.828  -6.553
  483   3HD2  LEU  57          HD23      LEU  57  -8.131  -8.898  -8.312
  484    H    GLU  58           HN       GLU  58  -5.577 -10.331 -11.295
  485    HA   GLU  58           HA       GLU  58  -3.915  -8.825 -13.170
  486   1HB   GLU  58          HB2       GLU  58  -3.745 -11.749 -12.633
  487   2HB   GLU  58          HB1       GLU  58  -3.608 -11.217 -14.303
  488   1HG   GLU  58          HG2       GLU  58  -1.585 -10.274 -13.984
  489   2HG   GLU  58          HG1       GLU  58  -1.955  -9.773 -12.335
  Start of MODEL    9
    1   1H    MET   0          HT1       MET   0   2.397  -8.934 -10.627
    2   2H    MET   0          HT2       MET   0   3.787  -9.009 -11.631
    3   3H    MET   0          HT3       MET   0   3.695  -7.844 -10.373
    4    HA   MET   0           HA       MET   0   4.040 -10.747 -10.191
    5   1HB   MET   0          HB2       MET   0   5.846  -8.776 -10.352
    6   2HB   MET   0          HB1       MET   0   5.545  -8.717  -8.621
    7   1HG   MET   0          HG2       MET   0   5.938 -11.428  -9.546
    8   2HG   MET   0          HG1       MET   0   7.303 -10.390  -9.952
    9   1HE   MET   0          HE1       MET   0   5.570 -12.176  -6.548
   10   2HE   MET   0          HE2       MET   0   7.224 -12.786  -6.586
   11   3HE   MET   0          HE3       MET   0   6.234 -12.829  -8.045
   12    H    LYS   1           HN       LYS   1   3.697  -7.892  -8.074
   13    HA   LYS   1           HA       LYS   1   1.904  -9.461  -6.360
   14   1HB   LYS   1          HB2       LYS   1   4.552  -8.846  -5.691
   15   2HB   LYS   1          HB1       LYS   1   3.578  -7.691  -4.791
   16   1HG   LYS   1          HG2       LYS   1   2.224 -10.004  -4.336
   17   2HG   LYS   1          HG1       LYS   1   3.889 -10.580  -4.436
   18   1HD   LYS   1          HD2       LYS   1   4.537  -8.866  -2.770
   19   2HD   LYS   1          HD1       LYS   1   2.840  -8.406  -2.625
   20   1HE   LYS   1          HE2       LYS   1   2.723 -11.107  -2.256
   21   2HE   LYS   1          HE1       LYS   1   4.274 -10.710  -1.518
   22   1HZ   LYS   1          HZ1       LYS   1   3.125  -9.019  -0.184
   23   2HZ   LYS   1          HZ2       LYS   1   2.534 -10.575   0.114
   24   3HZ   LYS   1          HZ3       LYS   1   1.645  -9.503  -0.846
   25    H    ALA   2           HN       ALA   2   0.106  -8.397  -5.859
   26    HA   ALA   2           HA       ALA   2   0.129  -5.479  -5.707
   27   1HB   ALA   2          HB1       ALA   2  -1.404  -7.098  -7.684
   28   2HB   ALA   2          HB2       ALA   2  -0.588  -5.547  -7.886
   29   3HB   ALA   2          HB3       ALA   2  -2.130  -5.629  -7.032
   30    H    ALA   3           HN       ALA   3  -1.626  -4.591  -4.522
   31    HA   ALA   3           HA       ALA   3  -3.235  -6.547  -3.025
   32   1HB   ALA   3          HB1       ALA   3  -1.457  -5.925  -1.551
   33   2HB   ALA   3          HB2       ALA   3  -2.930  -5.129  -0.998
   34   3HB   ALA   3          HB3       ALA   3  -1.712  -4.212  -1.884
   35    H    ARG   4           HN       ARG   4  -5.221  -5.734  -2.160
   36    HA   ARG   4           HA       ARG   4  -6.294  -3.519  -3.754
   37   1HB   ARG   4          HB2       ARG   4  -7.337  -5.888  -3.691
   38   2HB   ARG   4          HB1       ARG   4  -7.946  -5.417  -2.110
   39   1HG   ARG   4          HG2       ARG   4  -9.524  -4.084  -2.975
   40   2HG   ARG   4          HG1       ARG   4  -8.454  -3.465  -4.234
   41   1HD   ARG   4          HD2       ARG   4  -9.252  -4.900  -5.745
   42   2HD   ARG   4          HD1       ARG   4  -9.112  -6.263  -4.635
   43    HE   ARG   4           HE       ARG   4 -11.336  -6.039  -4.129
   44   1HH1  ARG   4          HH11      ARG   4 -10.256  -3.173  -5.802
   45   2HH1  ARG   4          HH12      ARG   4 -11.852  -2.524  -5.980
   46   1HH2  ARG   4          HH21      ARG   4 -13.435  -5.188  -4.363
   47   2HH2  ARG   4          HH22      ARG   4 -13.657  -3.668  -5.163
   48    H    LEU   5           HN       LEU   5  -6.568  -1.615  -2.824
   49    HA   LEU   5           HA       LEU   5  -6.317  -1.314   0.031
   50   1HB   LEU   5          HB2       LEU   5  -6.558   0.551  -2.295
   51   2HB   LEU   5          HB1       LEU   5  -6.826   1.158  -0.673
   52    HG   LEU   5           HG       LEU   5  -4.605   0.822  -0.037
   53   1HD1  LEU   5          HD11      LEU   5  -4.224  -1.428  -0.655
   54   2HD1  LEU   5          HD12      LEU   5  -3.000  -0.473  -1.492
   55   3HD1  LEU   5          HD13      LEU   5  -4.410  -1.065  -2.371
   56   1HD2  LEU   5          HD21      LEU   5  -3.337   2.050  -1.586
   57   2HD2  LEU   5          HD22      LEU   5  -5.002   2.577  -1.834
   58   3HD2  LEU   5          HD23      LEU   5  -4.261   1.436  -2.956
   59    H    LYS   6           HN       LYS   6  -7.881  -0.792   1.482
   60    HA   LYS   6           HA       LYS   6 -10.547  -0.093   0.590
   61   1HB   LYS   6          HB2       LYS   6 -10.037  -2.623   2.165
   62   2HB   LYS   6          HB1       LYS   6 -11.622  -1.937   1.835
   63   1HG   LYS   6          HG2       LYS   6 -11.182  -2.217  -0.589
   64   2HG   LYS   6          HG1       LYS   6  -9.672  -3.032  -0.179
   65   1HD   LYS   6          HD2       LYS   6 -10.783  -4.850   0.791
   66   2HD   LYS   6          HD1       LYS   6 -12.300  -3.960   0.933
   67   1HE   LYS   6          HE2       LYS   6 -11.017  -5.070  -1.551
   68   2HE   LYS   6          HE1       LYS   6 -12.582  -5.487  -0.855
   69   1HZ   LYS   6          HZ1       LYS   6 -11.820  -3.170  -2.464
   70   2HZ   LYS   6          HZ2       LYS   6 -12.992  -2.934  -1.268
   71   3HZ   LYS   6          HZ3       LYS   6 -13.247  -4.079  -2.486
   72    H    PHE   7           HN       PHE   7  -8.619   1.346   2.047
   73    HA   PHE   7           HA       PHE   7 -10.139   1.853   4.474
   74   1HB   PHE   7          HB2       PHE   7  -7.151   1.406   4.588
   75   2HB   PHE   7          HB1       PHE   7  -8.209   1.800   5.938
   76    HD1  PHE   7           HD2      PHE   7  -7.360  -0.812   3.473
   77    HD2  PHE   7           HD1      PHE   7  -9.400   0.124   7.088
   78    HE1  PHE   7           HE2      PHE   7  -7.706  -3.211   3.895
   79    HE2  PHE   7           HE1      PHE   7  -9.749  -2.273   7.518
   80    HZ   PHE   7           HZ       PHE   7  -8.901  -3.945   5.920
   81    H    ASP   8           HN       ASP   8 -10.718   3.879   3.887
   82    HA   ASP   8           HA       ASP   8  -9.071   5.712   2.518
   83   1HB   ASP   8          HB2       ASP   8 -11.341   6.506   4.334
   84   2HB   ASP   8          HB1       ASP   8 -10.785   7.307   2.868
   85    H    PHE   9           HN       PHE   9  -7.078   5.558   3.722
   86    HA   PHE   9           HA       PHE   9  -7.109   6.921   6.323
   87   1HB   PHE   9          HB2       PHE   9  -5.824   4.608   5.526
   88   2HB   PHE   9          HB1       PHE   9  -4.544   5.814   5.454
   89    HD1  PHE   9           HD2      PHE   9  -4.387   7.379   7.561
   90    HD2  PHE   9           HD1      PHE   9  -6.230   3.544   7.518
   91    HE1  PHE   9           HE2      PHE   9  -4.097   7.217   9.999
   92    HE2  PHE   9           HE1      PHE   9  -5.944   3.375   9.956
   93    HZ   PHE   9           HZ       PHE   9  -4.876   5.213  11.200
   94    H    GLN  10           HN       GLN  10  -5.841   8.718   6.723
   95    HA   GLN  10           HA       GLN  10  -4.926  10.133   4.321
   96   1HB   GLN  10          HB2       GLN  10  -5.100  12.172   5.648
   97   2HB   GLN  10          HB1       GLN  10  -6.613  11.278   5.692
   98   1HG   GLN  10          HG2       GLN  10  -5.875  10.335   7.896
   99   2HG   GLN  10          HG1       GLN  10  -4.533  11.478   7.851
  100   1HE2  GLN  10          HE21      GLN  10  -8.057  11.438   7.421
  101   2HE2  GLN  10          HE22      GLN  10  -8.352  12.900   8.292
  102    H    ALA  11           HN       ALA  11  -2.839  10.595   3.996
  103    HA   ALA  11           HA       ALA  11  -0.894   9.610   5.915
  104   1HB   ALA  11          HB1       ALA  11  -0.489   8.994   3.653
  105   2HB   ALA  11          HB2       ALA  11   0.745  10.172   4.102
  106   3HB   ALA  11          HB3       ALA  11  -0.626  10.666   3.108
  107    H    GLN  12           HN       GLN  12   0.398  10.831   7.165
  108    HA   GLN  12           HA       GLN  12   0.060  13.739   7.017
  109   1HB   GLN  12          HB2       GLN  12   1.128  13.546   9.380
  110   2HB   GLN  12          HB1       GLN  12  -0.566  13.144   9.164
  111   1HG   GLN  12          HG2       GLN  12   1.219  10.868   8.809
  112   2HG   GLN  12          HG1       GLN  12   1.323  11.599  10.407
  113   1HE2  GLN  12          HE21      GLN  12  -1.543  11.521   8.374
  114   2HE2  GLN  12          HE22      GLN  12  -2.473  10.498   9.408
  115    H    SER  13           HN       SER  13   2.455  11.169   7.168
  116    HA   SER  13           HA       SER  13   4.668  13.034   7.139
  117   1HB   SER  13          HB2       SER  13   4.920  10.963   8.395
  118   2HB   SER  13          HB1       SER  13   4.602  10.014   6.942
  119    HG   SER  13           HG       SER  13   6.597  10.292   6.342
  120    HA   PRO  14           HA       PRO  14   5.162  13.539   2.788
  121   1HB   PRO  14          HB2       PRO  14   8.058  13.050   3.255
  122   2HB   PRO  14          HB1       PRO  14   7.259  14.422   2.480
  123   1HG   PRO  14          HG2       PRO  14   8.271  14.645   4.934
  124   2HG   PRO  14          HG1       PRO  14   6.743  15.434   4.500
  125   1HD   PRO  14          HD2       PRO  14   7.212  12.951   6.094
  126   2HD   PRO  14          HD1       PRO  14   5.997  14.225   6.319
  127    H    LYS  15           HN       LYS  15   6.666  10.815   4.409
  128    HA   LYS  15           HA       LYS  15   7.158   9.356   1.976
  129   1HB   LYS  15          HB2       LYS  15   7.543   8.877   4.883
  130   2HB   LYS  15          HB1       LYS  15   7.390   7.460   3.854
  131   1HG   LYS  15          HG2       LYS  15   9.240   8.309   2.462
  132   2HG   LYS  15          HG1       LYS  15   9.420   9.666   3.576
  133   1HD   LYS  15          HD2       LYS  15  10.913   8.330   4.600
  134   2HD   LYS  15          HD1       LYS  15   9.483   7.563   5.294
  135   1HE   LYS  15          HE2       LYS  15   9.507   5.849   3.634
  136   2HE   LYS  15          HE1       LYS  15  10.751   6.686   2.707
  137   1HZ   LYS  15          HZ1       LYS  15  11.300   4.713   4.361
  138   2HZ   LYS  15          HZ2       LYS  15  11.399   5.991   5.464
  139   3HZ   LYS  15          HZ3       LYS  15  12.381   5.985   4.087
  140    H    GLU  16           HN       GLU  16   4.604   9.603   4.328
  141    HA   GLU  16           HA       GLU  16   3.260   7.200   3.501
  142   1HB   GLU  16          HB2       GLU  16   2.667   9.443   5.383
  143   2HB   GLU  16          HB1       GLU  16   1.343   8.419   4.847
  144   1HG   GLU  16          HG2       GLU  16   2.752   6.452   5.601
  145   2HG   GLU  16          HG1       GLU  16   3.788   7.635   6.398
  146    H    LEU  17           HN       LEU  17   1.385   7.031   2.278
  147    HA   LEU  17           HA       LEU  17   0.664   9.422   0.712
  148   1HB   LEU  17          HB2       LEU  17   1.938   7.917  -0.687
  149   2HB   LEU  17          HB1       LEU  17   0.914   6.568  -0.232
  150    HG   LEU  17           HG       LEU  17  -1.002   7.953  -1.296
  151   1HD1  LEU  17          HD11      LEU  17  -0.155   9.353  -3.195
  152   2HD1  LEU  17          HD12      LEU  17   1.437   9.295  -2.439
  153   3HD1  LEU  17          HD13      LEU  17   0.085  10.046  -1.591
  154   1HD2  LEU  17          HD21      LEU  17   1.180   6.641  -2.908
  155   2HD2  LEU  17          HD22      LEU  17  -0.414   7.054  -3.540
  156   3HD2  LEU  17          HD23      LEU  17  -0.261   5.877  -2.236
  157    H    THR  18           HN       THR  18  -1.463   9.859   0.470
  158    HA   THR  18           HA       THR  18  -3.324   8.311   2.065
  159    HB   THR  18           HB       THR  18  -3.732  10.848   0.469
  160    HG1  THR  18           HG1      THR  18  -2.463  11.432   2.101
  161   1HG2  THR  18          HG21      THR  18  -5.896  10.571   0.836
  162   2HG2  THR  18          HG22      THR  18  -5.549  10.799   2.550
  163   3HG2  THR  18          HG23      THR  18  -5.616   9.172   1.871
  164    H    LEU  19           HN       LEU  19  -4.907   7.009   1.319
  165    HA   LEU  19           HA       LEU  19  -5.623   7.055  -1.503
  166   1HB   LEU  19          HB2       LEU  19  -5.415   4.496  -1.517
  167   2HB   LEU  19          HB1       LEU  19  -3.960   5.451  -1.722
  168    HG   LEU  19           HG       LEU  19  -3.755   3.440  -0.216
  169   1HD1  LEU  19          HD11      LEU  19  -3.104   5.800   1.442
  170   2HD1  LEU  19          HD12      LEU  19  -2.428   5.742  -0.186
  171   3HD1  LEU  19          HD13      LEU  19  -2.096   4.438   0.954
  172   1HD2  LEU  19          HD21      LEU  19  -4.695   3.409   1.919
  173   2HD2  LEU  19          HD22      LEU  19  -6.019   3.931   0.877
  174   3HD2  LEU  19          HD23      LEU  19  -5.143   5.113   1.849
  175    H    GLN  20           HN       GLN  20  -7.539   5.751  -1.977
  176    HA   GLN  20           HA       GLN  20  -9.212   5.333   0.411
  177   1HB   GLN  20          HB2       GLN  20  -9.619   7.130  -1.753
  178   2HB   GLN  20          HB1       GLN  20 -10.836   5.868  -1.881
  179   1HG   GLN  20          HG2       GLN  20 -12.000   6.719  -0.203
  180   2HG   GLN  20          HG1       GLN  20 -10.581   6.752   0.843
  181   1HE2  GLN  20          HE21      GLN  20 -11.546   8.720   1.668
  182   2HE2  GLN  20          HE22      GLN  20 -11.274  10.210   0.837
  183    H    LYS  21           HN       LYS  21 -11.078   3.849   0.005
  184    HA   LYS  21           HA       LYS  21 -10.235   1.334  -0.757
  185   1HB   LYS  21          HB2       LYS  21 -13.054   2.422  -0.716
  186   2HB   LYS  21          HB1       LYS  21 -12.638   0.715  -0.788
  187   1HG   LYS  21          HG2       LYS  21 -12.218   0.602   1.402
  188   2HG   LYS  21          HG1       LYS  21 -11.363   2.145   1.416
  189   1HD   LYS  21          HD2       LYS  21 -13.471   3.345   1.458
  190   2HD   LYS  21          HD1       LYS  21 -14.363   1.826   1.341
  191   1HE   LYS  21          HE2       LYS  21 -13.386   1.123   3.494
  192   2HE   LYS  21          HE1       LYS  21 -12.574   2.683   3.614
  193   1HZ   LYS  21          HZ1       LYS  21 -14.419   3.205   4.766
  194   2HZ   LYS  21          HZ2       LYS  21 -15.368   2.010   4.036
  195   3HZ   LYS  21          HZ3       LYS  21 -15.080   3.470   3.231
  196    H    GLY  22           HN       GLY  22 -10.376   0.081  -2.580
  197   1HA   GLY  22          HA2       GLY  22 -11.048  -0.440  -4.782
  198   2HA   GLY  22          HA1       GLY  22 -11.592   1.223  -4.983
  199    H    ASP  23           HN       ASP  23  -8.677   1.613  -3.620
  200    HA   ASP  23           HA       ASP  23  -7.433   2.153  -6.181
  201   1HB   ASP  23          HB2       ASP  23  -7.022   2.991  -3.385
  202   2HB   ASP  23          HB1       ASP  23  -5.546   2.821  -4.330
  203    H    ILE  24           HN       ILE  24  -5.423   1.344  -6.853
  204    HA   ILE  24           HA       ILE  24  -4.657  -1.208  -5.589
  205    HB   ILE  24           HB       ILE  24  -4.197  -0.461  -8.475
  206   1HG1  ILE  24          HG12      ILE  24  -6.603  -0.558  -8.065
  207   2HG1  ILE  24          HG11      ILE  24  -6.090  -1.957  -9.003
  208   1HG2  ILE  24          HG21      ILE  24  -2.948  -2.346  -7.021
  209   2HG2  ILE  24          HG22      ILE  24  -3.263  -2.497  -8.749
  210   3HG2  ILE  24          HG23      ILE  24  -4.341  -3.268  -7.586
  211   1HD1  ILE  24          HD11      ILE  24  -5.907  -2.915  -6.473
  212   2HD1  ILE  24          HD12      ILE  24  -7.308  -3.104  -7.527
  213   3HD1  ILE  24          HD13      ILE  24  -7.270  -1.806  -6.334
  214    H    VAL  25           HN       VAL  25  -2.521  -1.591  -5.142
  215    HA   VAL  25           HA       VAL  25  -0.587   0.491  -5.901
  216    HB   VAL  25           HB       VAL  25   0.439   0.357  -3.660
  217   1HG1  VAL  25          HG11      VAL  25  -2.383   1.288  -3.989
  218   2HG1  VAL  25          HG12      VAL  25  -0.898   2.233  -3.880
  219   3HG1  VAL  25          HG13      VAL  25  -1.562   1.465  -2.438
  220   1HG2  VAL  25          HG21      VAL  25  -0.232  -1.790  -2.899
  221   2HG2  VAL  25          HG22      VAL  25  -1.941  -1.392  -3.075
  222   3HG2  VAL  25          HG23      VAL  25  -0.979  -0.613  -1.819
  223    H    TYR  26           HN       TYR  26   1.648  -0.178  -5.803
  224    HA   TYR  26           HA       TYR  26   1.958  -3.079  -6.209
  225   1HB   TYR  26          HB2       TYR  26   2.546  -1.024  -7.957
  226   2HB   TYR  26          HB1       TYR  26   4.112  -1.386  -7.240
  227    HD1  TYR  26           HD1      TYR  26   4.840  -3.871  -7.243
  228    HD2  TYR  26           HD2      TYR  26   1.744  -2.320  -9.715
  229    HE1  TYR  26           HE1      TYR  26   5.087  -5.797  -8.752
  230    HE2  TYR  26           HE2      TYR  26   1.982  -4.242 -11.230
  231    HH   TYR  26           HH       TYR  26   3.589  -5.920 -11.838
  232    H    ILE  27           HN       ILE  27   2.889  -4.035  -4.536
  233    HA   ILE  27           HA       ILE  27   4.521  -2.560  -2.670
  234    HB   ILE  27           HB       ILE  27   3.859  -5.507  -2.723
  235   1HG1  ILE  27          HG12      ILE  27   2.320  -4.772  -0.802
  236   2HG1  ILE  27          HG11      ILE  27   2.538  -3.135  -1.413
  237   1HG2  ILE  27          HG21      ILE  27   4.355  -4.863  -0.127
  238   2HG2  ILE  27          HG22      ILE  27   5.525  -3.850  -0.972
  239   3HG2  ILE  27          HG23      ILE  27   5.526  -5.595  -1.224
  240   1HD1  ILE  27          HD11      ILE  27   1.369  -3.568  -3.352
  241   2HD1  ILE  27          HD12      ILE  27   0.487  -4.516  -2.154
  242   3HD1  ILE  27          HD13      ILE  27   1.626  -5.310  -3.242
  243    H    HIS  28           HN       HIS  28   6.688  -2.715  -2.351
  244    HA   HIS  28           HA       HIS  28   8.206  -4.213  -4.380
  245   1HB   HIS  28          HB2       HIS  28   8.411  -1.663  -4.232
  246   2HB   HIS  28          HB1       HIS  28   9.270  -1.932  -2.719
  247    HD1  HIS  28           HD1      HIS  28  10.530  -4.651  -4.273
  248    HD2  HIS  28           HD2      HIS  28  10.949  -0.609  -5.138
  249    HE1  HIS  28           HE1      HIS  28  12.648  -4.468  -5.616
  250    HE2  HIS  28           HE2      HIS  28  12.833  -2.025  -6.204
  251    H    LYS  29           HN       LYS  29   8.756  -2.990  -1.076
  252    HA   LYS  29           HA       LYS  29  10.068  -5.550  -0.442
  253   1HB   LYS  29          HB2       LYS  29  11.191  -4.272   1.396
  254   2HB   LYS  29          HB1       LYS  29  11.624  -3.738  -0.222
  255   1HG   LYS  29          HG2       LYS  29  11.002  -1.674   0.261
  256   2HG   LYS  29          HG1       LYS  29   9.376  -2.229   0.663
  257   1HD   LYS  29          HD2       LYS  29  10.561  -2.970   2.904
  258   2HD   LYS  29          HD1       LYS  29  11.706  -1.708   2.442
  259   1HE   LYS  29          HE2       LYS  29   9.627  -0.232   2.118
  260   2HE   LYS  29          HE1       LYS  29   8.778  -1.465   3.051
  261   1HZ   LYS  29          HZ1       LYS  29   9.452   0.064   4.635
  262   2HZ   LYS  29          HZ2       LYS  29  10.959   0.327   3.913
  263   3HZ   LYS  29          HZ3       LYS  29  10.658  -1.120   4.736
  264    H    GLU  30           HN       GLU  30   9.492  -6.656   1.421
  265    HA   GLU  30           HA       GLU  30   6.972  -5.766   2.642
  266   1HB   GLU  30          HB2       GLU  30   8.095  -8.551   2.782
  267   2HB   GLU  30          HB1       GLU  30   6.443  -8.026   3.075
  268   1HG   GLU  30          HG2       GLU  30   5.908  -8.356   0.957
  269   2HG   GLU  30          HG1       GLU  30   7.215  -7.303   0.418
  270    H    VAL  31           HN       VAL  31   7.386  -4.637   4.407
  271    HA   VAL  31           HA       VAL  31   9.485  -5.519   6.235
  272    HB   VAL  31           HB       VAL  31   7.839  -3.258   7.091
  273   1HG1  VAL  31          HG11      VAL  31  10.229  -4.247   7.788
  274   2HG1  VAL  31          HG12      VAL  31   9.760  -2.567   8.053
  275   3HG1  VAL  31          HG13      VAL  31  10.742  -2.998   6.653
  276   1HG2  VAL  31          HG21      VAL  31   9.492  -3.011   4.580
  277   2HG2  VAL  31          HG22      VAL  31   8.854  -1.653   5.506
  278   3HG2  VAL  31          HG23      VAL  31   7.750  -2.778   4.718
  279    H    ASP  32           HN       ASP  32   8.692  -7.289   7.176
  280    HA   ASP  32           HA       ASP  32   6.070  -7.709   8.065
  281   1HB   ASP  32          HB2       ASP  32   7.115  -9.535   9.475
  282   2HB   ASP  32          HB1       ASP  32   7.457  -9.612   7.749
  283    H    LYS  33           HN       LYS  33   8.509  -5.735   9.406
  284    HA   LYS  33           HA       LYS  33   8.164  -5.932  12.129
  285   1HB   LYS  33          HB2       LYS  33   8.857  -3.709  10.281
  286   2HB   LYS  33          HB1       LYS  33   8.414  -3.271  11.925
  287   1HG   LYS  33          HG2       LYS  33  10.500  -5.347  11.351
  288   2HG   LYS  33          HG1       LYS  33  10.882  -3.626  11.426
  289   1HD   LYS  33          HD2       LYS  33   9.584  -3.777  13.711
  290   2HD   LYS  33          HD1       LYS  33  10.022  -5.482  13.593
  291   1HE   LYS  33          HE2       LYS  33  11.950  -3.167  13.451
  292   2HE   LYS  33          HE1       LYS  33  11.670  -4.173  14.871
  293   1HZ   LYS  33          HZ1       LYS  33  12.364  -5.566  12.412
  294   2HZ   LYS  33          HZ2       LYS  33  12.838  -5.879  14.005
  295   3HZ   LYS  33          HZ3       LYS  33  13.595  -4.650  13.124
  296    H    ASN  34           HN       ASN  34   6.286  -3.898   9.901
  297    HA   ASN  34           HA       ASN  34   3.764  -4.353  10.705
  298   1HB   ASN  34          HB2       ASN  34   5.172  -2.890  12.814
  299   2HB   ASN  34          HB1       ASN  34   3.681  -2.107  12.307
  300   1HD2  ASN  34          HD21      ASN  34   1.858  -3.825  11.953
  301   2HD2  ASN  34          HD22      ASN  34   1.641  -4.913  13.277
  302    H    TRP  35           HN       TRP  35   5.434  -3.136   8.565
  303    HA   TRP  35           HA       TRP  35   3.526  -1.157   7.740
  304   1HB   TRP  35          HB2       TRP  35   5.652  -0.184   9.182
  305   2HB   TRP  35          HB1       TRP  35   6.222  -0.018   7.525
  306    HD1  TRP  35           HD1      TRP  35   4.286   1.280   5.854
  307    HE1  TRP  35           HE1      TRP  35   2.969   3.418   6.417
  308    HE3  TRP  35           HE3      TRP  35   4.731   1.187  10.945
  309    HZ2  TRP  35           HZ2      TRP  35   2.218   4.873   8.717
  310    HZ3  TRP  35           HZ3      TRP  35   3.684   2.989  12.253
  311    HH2  TRP  35           HH2      TRP  35   2.454   4.793  11.161
  312    H    LEU  36           HN       LEU  36   3.132  -1.745   5.703
  313    HA   LEU  36           HA       LEU  36   5.193  -3.033   4.120
  314   1HB   LEU  36          HB2       LEU  36   2.885  -3.920   4.290
  315   2HB   LEU  36          HB1       LEU  36   2.299  -2.465   3.507
  316    HG   LEU  36           HG       LEU  36   4.026  -3.205   1.639
  317   1HD1  LEU  36          HD11      LEU  36   4.791  -5.290   1.767
  318   2HD1  LEU  36          HD12      LEU  36   3.183  -5.927   2.112
  319   3HD1  LEU  36          HD13      LEU  36   4.196  -5.329   3.427
  320   1HD2  LEU  36          HD21      LEU  36   1.773  -4.867   1.218
  321   2HD2  LEU  36          HD22      LEU  36   2.077  -3.252   0.577
  322   3HD2  LEU  36          HD23      LEU  36   1.229  -3.446   2.112
  323    H    GLU  37           HN       GLU  37   5.756  -2.311   2.000
  324    HA   GLU  37           HA       GLU  37   5.368   0.584   1.612
  325   1HB   GLU  37          HB2       GLU  37   7.684   0.075   2.004
  326   2HB   GLU  37          HB1       GLU  37   7.658  -1.217   0.813
  327   1HG   GLU  37          HG2       GLU  37   7.351   0.396  -0.969
  328   2HG   GLU  37          HG1       GLU  37   7.288   1.708   0.205
  329    H    GLY  38           HN       GLY  38   4.930   1.381  -0.461
  330   1HA   GLY  38          HA2       GLY  38   4.641  -0.396  -2.707
  331   2HA   GLY  38          HA1       GLY  38   3.101   0.094  -2.018
  332    H    GLU  39           HN       GLU  39   3.315   0.790  -4.506
  333    HA   GLU  39           HA       GLU  39   3.674   3.682  -4.402
  334   1HB   GLU  39          HB2       GLU  39   4.755   3.456  -6.771
  335   2HB   GLU  39          HB1       GLU  39   5.752   3.273  -5.335
  336   1HG   GLU  39          HG2       GLU  39   5.454   0.803  -5.540
  337   2HG   GLU  39          HG1       GLU  39   4.653   1.088  -7.084
  338    H    HIS  40           HN       HIS  40   2.744   4.750  -6.372
  339    HA   HIS  40           HA       HIS  40   0.816   3.166  -7.858
  340   1HB   HIS  40          HB2       HIS  40  -0.204   3.982  -5.615
  341   2HB   HIS  40          HB1       HIS  40  -0.227   5.566  -6.382
  342    HD1  HIS  40           HD1      HIS  40  -2.771   3.832  -5.553
  343    HD2  HIS  40           HD2      HIS  40  -1.199   4.245  -9.377
  344    HE1  HIS  40           HE1      HIS  40  -4.673   3.328  -7.120
  345    HE2  HIS  40           HE2      HIS  40  -3.719   3.665  -9.427
  346    H    HIS  41           HN       HIS  41   0.795   3.832  -9.892
  347    HA   HIS  41           HA       HIS  41   1.150   5.075 -11.763
  348   1HB   HIS  41          HB2       HIS  41  -0.784   6.301 -10.723
  349   2HB   HIS  41          HB1       HIS  41   0.378   7.426 -10.029
  350    HD1  HIS  41           HD1      HIS  41  -0.864   6.248 -13.406
  351    HD2  HIS  41           HD2      HIS  41   1.149   9.454 -11.692
  352    HE1  HIS  41           HE1      HIS  41  -0.665   7.970 -15.228
  353    HE2  HIS  41           HE2      HIS  41   0.487   9.931 -14.146
  354    H    GLY  42           HN       GLY  42   3.451   4.575 -10.186
  355   1HA   GLY  42          HA2       GLY  42   5.683   5.170 -10.513
  356   2HA   GLY  42          HA1       GLY  42   5.152   6.692 -11.210
  357    H    ARG  43           HN       ARG  43   3.396   6.718  -8.558
  358    HA   ARG  43           HA       ARG  43   5.378   8.259  -7.084
  359   1HB   ARG  43          HB2       ARG  43   2.559   8.451  -7.489
  360   2HB   ARG  43          HB1       ARG  43   2.853   8.266  -5.765
  361   1HG   ARG  43          HG2       ARG  43   4.058  10.361  -7.561
  362   2HG   ARG  43          HG1       ARG  43   2.776  10.606  -6.373
  363   1HD   ARG  43          HD2       ARG  43   4.303   9.979  -4.579
  364   2HD   ARG  43          HD1       ARG  43   5.582   9.686  -5.756
  365    HE   ARG  43           HE       ARG  43   5.982  11.930  -5.808
  366   1HH1  ARG  43          HH11      ARG  43   2.797  11.410  -4.479
  367   2HH1  ARG  43          HH12      ARG  43   2.558  13.077  -4.075
  368   1HH2  ARG  43          HH21      ARG  43   5.669  14.122  -5.277
  369   2HH2  ARG  43          HH22      ARG  43   4.187  14.617  -4.529
  370    H    LEU  44           HN       LEU  44   5.647   7.995  -4.780
  371    HA   LEU  44           HA       LEU  44   5.511   5.175  -4.021
  372   1HB   LEU  44          HB2       LEU  44   7.176   7.502  -3.161
  373   2HB   LEU  44          HB1       LEU  44   6.976   6.143  -2.070
  374    HG   LEU  44           HG       LEU  44   7.661   4.931  -4.455
  375   1HD1  LEU  44          HD11      LEU  44   8.816   7.647  -4.328
  376   2HD1  LEU  44          HD12      LEU  44   8.471   6.621  -5.720
  377   3HD1  LEU  44          HD13      LEU  44   9.916   6.335  -4.751
  378   1HD2  LEU  44          HD21      LEU  44   8.693   4.000  -2.669
  379   2HD2  LEU  44          HD22      LEU  44   8.987   5.554  -1.888
  380   3HD2  LEU  44          HD23      LEU  44  10.028   5.018  -3.208
  381    H    GLY  45           HN       GLY  45   4.171   4.437  -2.529
  382   1HA   GLY  45          HA2       GLY  45   3.040   6.291  -0.553
  383   2HA   GLY  45          HA1       GLY  45   1.939   5.368  -1.564
  384    H    ILE  46           HN       ILE  46   3.478   5.437   1.360
  385    HA   ILE  46           HA       ILE  46   3.328   2.509   1.645
  386    HB   ILE  46           HB       ILE  46   4.987   4.460   3.244
  387   1HG1  ILE  46          HG12      ILE  46   5.698   2.534   1.030
  388   2HG1  ILE  46          HG11      ILE  46   5.849   4.288   1.003
  389   1HG2  ILE  46          HG21      ILE  46   5.619   2.791   4.610
  390   2HG2  ILE  46          HG22      ILE  46   5.616   1.593   3.318
  391   3HG2  ILE  46          HG23      ILE  46   4.107   2.046   4.101
  392   1HD1  ILE  46          HD11      ILE  46   8.009   3.643   1.370
  393   2HD1  ILE  46          HD12      ILE  46   7.544   2.258   2.359
  394   3HD1  ILE  46          HD13      ILE  46   7.443   3.890   3.022
  395    H    PHE  47           HN       PHE  47   2.365   1.631   3.457
  396    HA   PHE  47           HA       PHE  47   1.208   3.262   5.519
  397   1HB   PHE  47          HB2       PHE  47  -1.137   2.492   5.054
  398   2HB   PHE  47          HB1       PHE  47  -0.504   3.635   3.874
  399    HD1  PHE  47           HD1      PHE  47   0.712   2.459   1.811
  400    HD2  PHE  47           HD2      PHE  47  -2.269   0.668   4.263
  401    HE1  PHE  47           HE1      PHE  47   0.172   0.886  -0.002
  402    HE2  PHE  47           HE2      PHE  47  -2.815  -0.909   2.455
  403    HZ   PHE  47           HZ       PHE  47  -1.593  -0.802   0.319
  404    HA   PRO  48           HA       PRO  48   1.712  -0.363   7.958
  405   1HB   PRO  48          HB2       PRO  48  -1.079   0.013   8.919
  406   2HB   PRO  48          HB1       PRO  48   0.419  -0.148   9.843
  407   1HG   PRO  48          HG2       PRO  48  -0.766   2.226   9.562
  408   2HG   PRO  48          HG1       PRO  48   1.001   2.074   9.541
  409   1HD   PRO  48          HD2       PRO  48  -0.894   2.506   7.276
  410   2HD   PRO  48          HD1       PRO  48   0.749   3.136   7.511
  411    H    ALA  49           HN       ALA  49   1.520  -2.477   7.546
  412    HA   ALA  49           HA       ALA  49  -0.118  -3.429   5.459
  413   1HB   ALA  49          HB1       ALA  49   1.835  -4.580   7.332
  414   2HB   ALA  49          HB2       ALA  49   1.665  -4.794   5.590
  415   3HB   ALA  49          HB3       ALA  49   0.638  -5.707   6.694
  416    H    ASN  50           HN       ASN  50  -0.808  -2.891   8.749
  417    HA   ASN  50           HA       ASN  50  -2.670  -4.966   9.213
  418   1HB   ASN  50          HB2       ASN  50  -1.813  -2.514  10.555
  419   2HB   ASN  50          HB1       ASN  50  -3.520  -2.872  10.800
  420   1HD2  ASN  50          HD21      ASN  50  -3.813  -3.871  12.644
  421   2HD2  ASN  50          HD22      ASN  50  -2.808  -5.109  13.309
  422    H    TYR  51           HN       TYR  51  -2.841  -2.258   7.180
  423    HA   TYR  51           HA       TYR  51  -5.766  -2.547   7.020
  424   1HB   TYR  51          HB2       TYR  51  -4.335   0.035   6.416
  425   2HB   TYR  51          HB1       TYR  51  -6.056  -0.224   6.684
  426    HD1  TYR  51           HD2      TYR  51  -6.824  -0.850   9.023
  427    HD2  TYR  51           HD1      TYR  51  -2.909   0.593   8.197
  428    HE1  TYR  51           HE2      TYR  51  -6.543  -0.271  11.397
  429    HE2  TYR  51           HE1      TYR  51  -2.616   1.176  10.568
  430    HH   TYR  51           HH       TYR  51  -3.915   1.636  12.526
  431    H    VAL  52           HN       VAL  52  -4.395  -4.188   5.470
  432    HA   VAL  52           HA       VAL  52  -4.884  -3.127   2.806
  433    HB   VAL  52           HB       VAL  52  -2.469  -2.693   3.254
  434   1HG1  VAL  52          HG11      VAL  52  -2.444  -5.082   4.514
  435   2HG1  VAL  52          HG12      VAL  52  -1.000  -4.269   3.910
  436   3HG1  VAL  52          HG13      VAL  52  -1.767  -5.534   2.949
  437   1HG2  VAL  52          HG21      VAL  52  -1.829  -3.216   1.108
  438   2HG2  VAL  52          HG22      VAL  52  -3.583  -3.354   0.979
  439   3HG2  VAL  52          HG23      VAL  52  -2.594  -4.804   1.151
  440    H    GLU  53           HN       GLU  53  -4.934  -4.820   1.150
  441    HA   GLU  53           HA       GLU  53  -5.513  -7.473   2.296
  442   1HB   GLU  53          HB2       GLU  53  -6.951  -5.935   0.142
  443   2HB   GLU  53          HB1       GLU  53  -7.119  -7.678   0.306
  444   1HG   GLU  53          HG2       GLU  53  -7.515  -6.356   2.837
  445   2HG   GLU  53          HG1       GLU  53  -8.595  -5.711   1.601
  446    H    VAL  54           HN       VAL  54  -4.198  -9.011   1.598
  447    HA   VAL  54           HA       VAL  54  -2.476  -8.543  -0.680
  448    HB   VAL  54           HB       VAL  54  -1.581  -9.584   1.371
  449   1HG1  VAL  54          HG11      VAL  54  -3.118 -12.061   0.636
  450   2HG1  VAL  54          HG12      VAL  54  -3.703 -10.898   1.826
  451   3HG1  VAL  54          HG13      VAL  54  -2.181 -11.746   2.096
  452   1HG2  VAL  54          HG21      VAL  54  -0.351 -11.405   0.267
  453   2HG2  VAL  54          HG22      VAL  54  -0.447  -9.961  -0.740
  454   3HG2  VAL  54          HG23      VAL  54  -1.490 -11.342  -1.078
  455    H    LEU  55           HN       LEU  55  -3.053  -9.042  -2.681
  456    HA   LEU  55           HA       LEU  55  -4.026 -11.578  -3.434
  457   1HB   LEU  55          HB2       LEU  55  -6.252 -10.873  -4.287
  458   2HB   LEU  55          HB1       LEU  55  -6.132 -10.902  -2.538
  459    HG   LEU  55           HG       LEU  55  -5.478  -8.272  -3.502
  460   1HD1  LEU  55          HD11      LEU  55  -7.949  -9.542  -4.611
  461   2HD1  LEU  55          HD12      LEU  55  -6.779  -8.486  -5.405
  462   3HD1  LEU  55          HD13      LEU  55  -7.914  -7.820  -4.231
  463   1HD2  LEU  55          HD21      LEU  55  -7.659  -7.856  -2.111
  464   2HD2  LEU  55          HD22      LEU  55  -6.169  -8.362  -1.315
  465   3HD2  LEU  55          HD23      LEU  55  -7.435  -9.543  -1.648
  466    HA   PRO  56           HA       PRO  56  -1.831  -8.875  -6.596
  467   1HB   PRO  56          HB2       PRO  56  -0.718 -11.581  -7.142
  468   2HB   PRO  56          HB1       PRO  56   0.105 -10.020  -7.065
  469   1HG   PRO  56          HG2       PRO  56   0.342 -11.779  -5.080
  470   2HG   PRO  56          HG1       PRO  56   0.215 -10.041  -4.748
  471   1HD   PRO  56          HD2       PRO  56  -1.847 -12.183  -4.466
  472   2HD   PRO  56          HD1       PRO  56  -1.552 -10.758  -3.448
  473    H    LEU  57           HN       LEU  57  -2.450  -8.675  -8.695
  474    HA   LEU  57           HA       LEU  57  -4.099 -10.835  -9.828
  475   1HB   LEU  57          HB2       LEU  57  -5.291  -8.916 -11.057
  476   2HB   LEU  57          HB1       LEU  57  -5.689  -9.212  -9.377
  477    HG   LEU  57           HG       LEU  57  -5.465  -6.798 -10.012
  478   1HD1  LEU  57          HD11      LEU  57  -3.370  -7.060  -8.011
  479   2HD1  LEU  57          HD12      LEU  57  -4.764  -8.092  -7.695
  480   3HD1  LEU  57          HD13      LEU  57  -4.980  -6.352  -7.885
  481   1HD2  LEU  57          HD21      LEU  57  -2.502  -7.213  -9.974
  482   2HD2  LEU  57          HD22      LEU  57  -3.431  -5.833 -10.559
  483   3HD2  LEU  57          HD23      LEU  57  -3.411  -7.336 -11.480
  484    H    GLU  58           HN       GLU  58  -1.228 -10.215 -10.150
  485    HA   GLU  58           HA       GLU  58   0.357 -10.047 -11.778
  486   1HB   GLU  58          HB2       GLU  58  -1.886 -11.042 -13.544
  487   2HB   GLU  58          HB1       GLU  58  -0.164 -11.154 -13.885
  488   1HG   GLU  58          HG2       GLU  58  -1.343 -12.412 -11.439
  489   2HG   GLU  58          HG1       GLU  58  -1.380 -13.229 -13.001
  Start of MODEL   10
    1   1H    MET   0          HT1       MET   0   4.529  -8.993  -9.991
    2   2H    MET   0          HT2       MET   0   5.583  -9.472  -8.723
    3   3H    MET   0          HT3       MET   0   6.221  -8.778 -10.158
    4    HA   MET   0           HA       MET   0   6.300  -7.089  -8.648
    5   1HB   MET   0          HB2       MET   0   4.309  -7.085 -10.747
    6   2HB   MET   0          HB1       MET   0   3.850  -5.980  -9.460
    7   1HG   MET   0          HG2       MET   0   5.865  -4.748  -9.685
    8   2HG   MET   0          HG1       MET   0   6.556  -5.959 -10.763
    9   1HE   MET   0          HE1       MET   0   6.453  -2.735 -12.228
   10   2HE   MET   0          HE2       MET   0   5.923  -2.846 -10.550
   11   3HE   MET   0          HE3       MET   0   4.834  -2.201 -11.777
   12    H    LYS   1           HN       LYS   1   3.432  -9.039  -8.300
   13    HA   LYS   1           HA       LYS   1   2.012  -9.396  -6.560
   14   1HB   LYS   1          HB2       LYS   1   4.138  -9.681  -5.312
   15   2HB   LYS   1          HB1       LYS   1   4.115  -7.966  -4.925
   16   1HG   LYS   1          HG2       LYS   1   1.754  -8.533  -3.943
   17   2HG   LYS   1          HG1       LYS   1   2.410 -10.170  -3.881
   18   1HD   LYS   1          HD2       LYS   1   3.992  -9.621  -2.311
   19   2HD   LYS   1          HD1       LYS   1   4.059  -7.931  -2.813
   20   1HE   LYS   1          HE2       LYS   1   1.492  -8.141  -1.927
   21   2HE   LYS   1          HE1       LYS   1   2.329  -9.254  -0.846
   22   1HZ   LYS   1          HZ1       LYS   1   3.972  -7.332  -0.549
   23   2HZ   LYS   1          HZ2       LYS   1   2.475  -7.224   0.230
   24   3HZ   LYS   1          HZ3       LYS   1   2.750  -6.355  -1.195
   25    H    ALA   2           HN       ALA   2   0.151  -8.343  -6.541
   26    HA   ALA   2           HA       ALA   2   0.170  -5.455  -5.946
   27   1HB   ALA   2          HB1       ALA   2  -1.616  -5.109  -7.430
   28   2HB   ALA   2          HB2       ALA   2  -1.970  -6.834  -7.541
   29   3HB   ALA   2          HB3       ALA   2  -0.512  -6.182  -8.291
   30    H    ALA   3           HN       ALA   3  -1.568  -4.620  -4.703
   31    HA   ALA   3           HA       ALA   3  -3.146  -6.623  -3.237
   32   1HB   ALA   3          HB1       ALA   3  -2.254  -4.287  -1.677
   33   2HB   ALA   3          HB2       ALA   3  -1.003  -5.459  -2.094
   34   3HB   ALA   3          HB3       ALA   3  -2.432  -5.975  -1.197
   35    H    ARG   4           HN       ARG   4  -5.202  -6.006  -2.652
   36    HA   ARG   4           HA       ARG   4  -6.158  -3.525  -3.889
   37   1HB   ARG   4          HB2       ARG   4  -7.114  -6.053  -4.139
   38   2HB   ARG   4          HB1       ARG   4  -8.121  -5.459  -2.826
   39   1HG   ARG   4          HG2       ARG   4  -9.396  -4.350  -4.253
   40   2HG   ARG   4          HG1       ARG   4  -7.996  -3.477  -4.878
   41   1HD   ARG   4          HD2       ARG   4  -7.537  -5.251  -6.447
   42   2HD   ARG   4          HD1       ARG   4  -8.827  -6.238  -5.761
   43    HE   ARG   4           HE       ARG   4  -9.104  -4.068  -7.629
   44   1HH1  ARG   4          HH11      ARG   4 -10.715  -5.961  -5.178
   45   2HH1  ARG   4          HH12      ARG   4 -12.301  -5.627  -5.786
   46   1HH2  ARG   4          HH21      ARG   4 -11.190  -3.626  -8.428
   47   2HH2  ARG   4          HH22      ARG   4 -12.572  -4.301  -7.631
   48    H    LEU   5           HN       LEU   5  -6.213  -1.859  -2.529
   49    HA   LEU   5           HA       LEU   5  -6.401  -2.135   0.296
   50   1HB   LEU   5          HB2       LEU   5  -5.819  -0.069  -1.564
   51   2HB   LEU   5          HB1       LEU   5  -7.120   0.503  -0.539
   52    HG   LEU   5           HG       LEU   5  -4.848   1.120   0.266
   53   1HD1  LEU   5          HD11      LEU   5  -6.848   0.897   1.752
   54   2HD1  LEU   5          HD12      LEU   5  -5.295   0.685   2.562
   55   3HD1  LEU   5          HD13      LEU   5  -6.282  -0.722   2.165
   56   1HD2  LEU   5          HD21      LEU   5  -3.229  -0.375   0.711
   57   2HD2  LEU   5          HD22      LEU   5  -4.130  -1.403  -0.404
   58   3HD2  LEU   5          HD23      LEU   5  -4.362  -1.573   1.336
   59    H    LYS   6           HN       LYS   6  -8.103  -1.661   1.681
   60    HA   LYS   6           HA       LYS   6 -10.690  -1.013   0.528
   61   1HB   LYS   6          HB2       LYS   6 -11.845  -2.901   1.351
   62   2HB   LYS   6          HB1       LYS   6 -10.419  -3.534   0.542
   63   1HG   LYS   6          HG2       LYS   6  -9.324  -3.915   2.639
   64   2HG   LYS   6          HG1       LYS   6 -10.629  -3.110   3.513
   65   1HD   LYS   6          HD2       LYS   6 -11.528  -5.298   1.791
   66   2HD   LYS   6          HD1       LYS   6 -10.437  -5.808   3.080
   67   1HE   LYS   6          HE2       LYS   6 -11.864  -4.783   4.742
   68   2HE   LYS   6          HE1       LYS   6 -12.917  -4.141   3.482
   69   1HZ   LYS   6          HZ1       LYS   6 -13.695  -6.265   2.957
   70   2HZ   LYS   6          HZ2       LYS   6 -13.659  -6.248   4.648
   71   3HZ   LYS   6          HZ3       LYS   6 -12.442  -7.044   3.785
   72    H    PHE   7           HN       PHE   7  -8.621   0.081   2.477
   73    HA   PHE   7           HA       PHE   7 -10.559   0.833   4.537
   74   1HB   PHE   7          HB2       PHE   7  -7.705   0.151   5.241
   75   2HB   PHE   7          HB1       PHE   7  -9.038   0.484   6.341
   76    HD1  PHE   7           HD1      PHE   7 -10.870  -1.176   6.587
   77    HD2  PHE   7           HD2      PHE   7  -7.328  -2.013   4.382
   78    HE1  PHE   7           HE1      PHE   7 -11.359  -3.583   6.724
   79    HE2  PHE   7           HE2      PHE   7  -7.811  -4.421   4.513
   80    HZ   PHE   7           HZ       PHE   7  -9.829  -5.210   5.685
   81    H    ASP   8           HN       ASP   8 -10.742   2.850   3.536
   82    HA   ASP   8           HA       ASP   8  -8.788   4.508   2.584
   83   1HB   ASP   8          HB2       ASP   8 -10.283   6.386   3.088
   84   2HB   ASP   8          HB1       ASP   8 -11.185   5.017   2.446
   85    H    PHE   9           HN       PHE   9  -6.890   4.887   3.534
   86    HA   PHE   9           HA       PHE   9  -6.873   5.652   6.378
   87   1HB   PHE   9          HB2       PHE   9  -5.537   3.606   5.549
   88   2HB   PHE   9          HB1       PHE   9  -4.447   4.782   4.822
   89    HD1  PHE   9           HD2      PHE   9  -3.163   6.324   6.244
   90    HD2  PHE   9           HD1      PHE   9  -5.562   3.222   7.896
   91    HE1  PHE   9           HE2      PHE   9  -1.981   6.558   8.390
   92    HE2  PHE   9           HE1      PHE   9  -4.386   3.451  10.045
   93    HZ   PHE   9           HZ       PHE   9  -2.592   5.120  10.293
   94    H    GLN  10           HN       GLN  10  -5.811   7.500   7.034
   95    HA   GLN  10           HA       GLN  10  -5.255   9.428   4.898
   96   1HB   GLN  10          HB2       GLN  10  -5.439  11.130   6.697
   97   2HB   GLN  10          HB1       GLN  10  -6.900  10.171   6.498
   98   1HG   GLN  10          HG2       GLN  10  -5.269   8.878   8.419
   99   2HG   GLN  10          HG1       GLN  10  -5.349  10.589   8.835
  100   1HE2  GLN  10          HE21      GLN  10  -7.079   7.621   8.577
  101   2HE2  GLN  10          HE22      GLN  10  -8.554   8.168   9.292
  102    H    ALA  11           HN       ALA  11  -3.302  10.380   4.632
  103    HA   ALA  11           HA       ALA  11  -1.021   9.123   5.805
  104   1HB   ALA  11          HB1       ALA  11  -1.309  11.481   3.955
  105   2HB   ALA  11          HB2       ALA  11  -0.839   9.832   3.543
  106   3HB   ALA  11          HB3       ALA  11   0.248  10.849   4.490
  107    H    GLN  12           HN       GLN  12   0.274   9.790   7.429
  108    HA   GLN  12           HA       GLN  12  -0.610  12.105   8.970
  109   1HB   GLN  12          HB2       GLN  12   1.129  11.109  10.623
  110   2HB   GLN  12          HB1       GLN  12  -0.417  10.303  10.416
  111   1HG   GLN  12          HG2       GLN  12   0.541   8.597   9.104
  112   2HG   GLN  12          HG1       GLN  12   2.042   9.498   8.895
  113   1HE2  GLN  12          HE21      GLN  12   1.281   6.804  10.079
  114   2HE2  GLN  12          HE22      GLN  12   2.088   6.781  11.606
  115    H    SER  13           HN       SER  13   2.265  10.796   7.389
  116    HA   SER  13           HA       SER  13   3.577  13.408   7.765
  117   1HB   SER  13          HB2       SER  13   4.591  10.631   7.905
  118   2HB   SER  13          HB1       SER  13   5.636  11.786   7.078
  119    HG   SER  13           HG       SER  13   6.002  12.785   8.912
  120    HA   PRO  14           HA       PRO  14   3.488  14.225   3.438
  121   1HB   PRO  14          HB2       PRO  14   6.355  14.971   3.696
  122   2HB   PRO  14          HB1       PRO  14   4.999  15.911   3.065
  123   1HG   PRO  14          HG2       PRO  14   6.030  16.446   5.463
  124   2HG   PRO  14          HG1       PRO  14   4.282  16.543   5.177
  125   1HD   PRO  14          HD2       PRO  14   5.863  14.424   6.569
  126   2HD   PRO  14          HD1       PRO  14   4.253  15.068   6.951
  127    H    LYS  15           HN       LYS  15   6.014  12.235   4.804
  128    HA   LYS  15           HA       LYS  15   7.065  11.293   2.326
  129   1HB   LYS  15          HB2       LYS  15   7.869  11.160   4.943
  130   2HB   LYS  15          HB1       LYS  15   7.339   9.510   4.646
  131   1HG   LYS  15          HG2       LYS  15   8.801   9.726   2.499
  132   2HG   LYS  15          HG1       LYS  15   9.570  11.039   3.393
  133   1HD   LYS  15          HD2       LYS  15  10.868   9.407   4.234
  134   2HD   LYS  15          HD1       LYS  15   9.485   9.089   5.284
  135   1HE   LYS  15          HE2       LYS  15   9.394   7.801   2.638
  136   2HE   LYS  15          HE1       LYS  15  10.666   7.228   3.716
  137   1HZ   LYS  15          HZ1       LYS  15   7.817   7.416   4.516
  138   2HZ   LYS  15          HZ2       LYS  15   9.070   6.641   5.346
  139   3HZ   LYS  15          HZ3       LYS  15   8.513   6.011   3.879
  140    H    GLU  16           HN       GLU  16   4.420  10.355   4.386
  141    HA   GLU  16           HA       GLU  16   4.050   7.788   3.119
  142   1HB   GLU  16          HB2       GLU  16   2.731   9.316   5.301
  143   2HB   GLU  16          HB1       GLU  16   1.756   8.120   4.458
  144   1HG   GLU  16          HG2       GLU  16   3.950   6.656   4.927
  145   2HG   GLU  16          HG1       GLU  16   4.031   7.763   6.296
  146    H    LEU  17           HN       LEU  17   1.657   7.334   2.407
  147    HA   LEU  17           HA       LEU  17   0.718   9.537   0.702
  148   1HB   LEU  17          HB2       LEU  17   2.008   8.051  -0.706
  149   2HB   LEU  17          HB1       LEU  17   1.121   6.660  -0.111
  150    HG   LEU  17           HG       LEU  17  -0.901   8.206  -1.112
  151   1HD1  LEU  17          HD11      LEU  17   1.614   8.901  -2.511
  152   2HD1  LEU  17          HD12      LEU  17   0.148   9.851  -2.266
  153   3HD1  LEU  17          HD13      LEU  17   0.190   8.600  -3.508
  154   1HD2  LEU  17          HD21      LEU  17  -0.136   5.723  -1.443
  155   2HD2  LEU  17          HD22      LEU  17   0.541   6.350  -2.946
  156   3HD2  LEU  17          HD23      LEU  17  -1.187   6.503  -2.625
  157    H    THR  18           HN       THR  18  -1.447   9.806   0.614
  158    HA   THR  18           HA       THR  18  -3.059   8.155   2.382
  159    HB   THR  18           HB       THR  18  -3.779  10.657   0.842
  160    HG1  THR  18           HG1      THR  18  -2.897  11.690   2.422
  161   1HG2  THR  18          HG21      THR  18  -5.870  10.322   1.464
  162   2HG2  THR  18          HG22      THR  18  -5.347  10.412   3.146
  163   3HG2  THR  18          HG23      THR  18  -5.422   8.851   2.327
  164    H    LEU  19           HN       LEU  19  -4.268   6.526   1.690
  165    HA   LEU  19           HA       LEU  19  -5.160   6.523  -1.116
  166   1HB   LEU  19          HB2       LEU  19  -3.328   4.895  -0.649
  167   2HB   LEU  19          HB1       LEU  19  -4.376   4.108   0.517
  168    HG   LEU  19           HG       LEU  19  -5.943   3.514  -1.250
  169   1HD1  LEU  19          HD11      LEU  19  -4.586   3.933  -3.621
  170   2HD1  LEU  19          HD12      LEU  19  -4.392   5.453  -2.749
  171   3HD1  LEU  19          HD13      LEU  19  -6.006   4.813  -3.057
  172   1HD2  LEU  19          HD21      LEU  19  -3.598   2.312  -0.735
  173   2HD2  LEU  19          HD22      LEU  19  -3.396   2.640  -2.456
  174   3HD2  LEU  19          HD23      LEU  19  -4.773   1.692  -1.894
  175    H    GLN  20           HN       GLN  20  -7.169   5.414  -1.528
  176    HA   GLN  20           HA       GLN  20  -8.907   5.343   0.849
  177   1HB   GLN  20          HB2       GLN  20  -9.235   7.040  -1.155
  178   2HB   GLN  20          HB1       GLN  20 -10.037   5.660  -1.893
  179   1HG   GLN  20          HG2       GLN  20 -11.160   5.690   0.587
  180   2HG   GLN  20          HG1       GLN  20 -10.910   7.408   0.280
  181   1HE2  GLN  20          HE21      GLN  20 -11.780   4.677  -1.811
  182   2HE2  GLN  20          HE22      GLN  20 -13.230   5.387  -2.426
  183    H    LYS  21           HN       LYS  21 -10.645   3.806   0.861
  184    HA   LYS  21           HA       LYS  21  -9.870   1.195   0.277
  185   1HB   LYS  21          HB2       LYS  21 -11.480   1.499   1.977
  186   2HB   LYS  21          HB1       LYS  21 -12.528   2.444   0.935
  187   1HG   LYS  21          HG2       LYS  21 -12.241  -0.130  -0.226
  188   2HG   LYS  21          HG1       LYS  21 -12.606  -0.332   1.487
  189   1HD   LYS  21          HD2       LYS  21 -14.211   1.719   0.140
  190   2HD   LYS  21          HD1       LYS  21 -14.459   0.082  -0.471
  191   1HE   LYS  21          HE2       LYS  21 -16.015   0.215   1.236
  192   2HE   LYS  21          HE1       LYS  21 -14.646  -0.559   2.032
  193   1HZ   LYS  21          HZ1       LYS  21 -14.990   1.047   3.544
  194   2HZ   LYS  21          HZ2       LYS  21 -15.796   2.068   2.463
  195   3HZ   LYS  21          HZ3       LYS  21 -14.105   2.014   2.474
  196    H    GLY  22           HN       GLY  22 -10.118  -0.133  -1.439
  197   1HA   GLY  22          HA2       GLY  22 -11.216  -0.906  -3.404
  198   2HA   GLY  22          HA1       GLY  22 -11.870   0.713  -3.637
  199    H    ASP  23           HN       ASP  23  -8.773   1.319  -2.878
  200    HA   ASP  23           HA       ASP  23  -8.038   1.582  -5.682
  201   1HB   ASP  23          HB2       ASP  23  -7.229   2.868  -3.144
  202   2HB   ASP  23          HB1       ASP  23  -5.955   2.684  -4.346
  203    H    ILE  24           HN       ILE  24  -6.210   0.706  -6.613
  204    HA   ILE  24           HA       ILE  24  -4.921  -1.455  -5.078
  205    HB   ILE  24           HB       ILE  24  -4.536  -2.619  -7.191
  206   1HG1  ILE  24          HG12      ILE  24  -6.177  -1.531  -9.076
  207   2HG1  ILE  24          HG11      ILE  24  -5.553  -0.079  -8.300
  208   1HG2  ILE  24          HG21      ILE  24  -7.149  -2.751  -7.794
  209   2HG2  ILE  24          HG22      ILE  24  -7.241  -1.949  -6.226
  210   3HG2  ILE  24          HG23      ILE  24  -6.439  -3.513  -6.370
  211   1HD1  ILE  24          HD11      ILE  24  -3.252  -1.323  -8.625
  212   2HD1  ILE  24          HD12      ILE  24  -3.984  -0.367  -9.913
  213   3HD1  ILE  24          HD13      ILE  24  -4.146  -2.123  -9.917
  214    H    VAL  25           HN       VAL  25  -2.728  -1.553  -5.007
  215    HA   VAL  25           HA       VAL  25  -1.197   0.291  -6.697
  216    HB   VAL  25           HB       VAL  25  -1.330   1.590  -4.767
  217   1HG1  VAL  25          HG11      VAL  25  -1.177   0.823  -2.512
  218   2HG1  VAL  25          HG12      VAL  25  -0.692  -0.789  -3.038
  219   3HG1  VAL  25          HG13      VAL  25  -2.328  -0.212  -3.358
  220   1HG2  VAL  25          HG21      VAL  25   0.978   1.350  -5.533
  221   2HG2  VAL  25          HG22      VAL  25   1.205   0.001  -4.419
  222   3HG2  VAL  25          HG23      VAL  25   0.896   1.620  -3.792
  223    H    TYR  26           HN       TYR  26   1.092  -0.173  -6.752
  224    HA   TYR  26           HA       TYR  26   1.584  -3.060  -6.566
  225   1HB   TYR  26          HB2       TYR  26   2.934  -0.875  -8.155
  226   2HB   TYR  26          HB1       TYR  26   3.556  -2.519  -8.059
  227    HD1  TYR  26           HD2      TYR  26   0.231  -0.910  -8.679
  228    HD2  TYR  26           HD1      TYR  26   3.089  -3.818  -9.897
  229    HE1  TYR  26           HE2      TYR  26  -1.239  -1.568 -10.536
  230    HE2  TYR  26           HE1      TYR  26   1.627  -4.483 -11.758
  231    HH   TYR  26           HH       TYR  26  -0.717  -2.747 -12.969
  232    H    ILE  27           HN       ILE  27   2.568  -3.695  -4.766
  233    HA   ILE  27           HA       ILE  27   4.218  -1.889  -3.232
  234    HB   ILE  27           HB       ILE  27   3.660  -4.819  -2.749
  235   1HG1  ILE  27          HG12      ILE  27   2.124  -3.845  -0.954
  236   2HG1  ILE  27          HG11      ILE  27   2.278  -2.310  -1.802
  237   1HG2  ILE  27          HG21      ILE  27   4.256  -3.241  -0.413
  238   2HG2  ILE  27          HG22      ILE  27   5.569  -3.150  -1.586
  239   3HG2  ILE  27          HG23      ILE  27   5.021  -4.719  -0.996
  240   1HD1  ILE  27          HD11      ILE  27   1.071  -3.042  -3.612
  241   2HD1  ILE  27          HD12      ILE  27   0.268  -3.875  -2.281
  242   3HD1  ILE  27          HD13      ILE  27   1.422  -4.741  -3.295
  243    H    HIS  28           HN       HIS  28   6.395  -1.905  -3.034
  244    HA   HIS  28           HA       HIS  28   7.868  -3.547  -4.953
  245   1HB   HIS  28          HB2       HIS  28   8.151  -1.034  -4.842
  246   2HB   HIS  28          HB1       HIS  28   8.933  -1.269  -3.282
  247    HD1  HIS  28           HD1      HIS  28   9.885  -0.595  -6.536
  248    HD2  HIS  28           HD2      HIS  28  11.099  -3.484  -3.808
  249    HE1  HIS  28           HE1      HIS  28  12.158  -1.339  -7.313
  250    HE2  HIS  28           HE2      HIS  28  12.828  -3.159  -5.704
  251    H    LYS  29           HN       LYS  29   8.439  -2.394  -1.625
  252    HA   LYS  29           HA       LYS  29   9.720  -4.984  -1.050
  253   1HB   LYS  29          HB2       LYS  29  10.904  -3.761   0.782
  254   2HB   LYS  29          HB1       LYS  29  11.316  -3.204  -0.834
  255   1HG   LYS  29          HG2       LYS  29  10.502  -1.152  -0.470
  256   2HG   LYS  29          HG1       LYS  29   9.097  -1.757   0.410
  257   1HD   LYS  29          HD2       LYS  29  11.076  -2.325   2.167
  258   2HD   LYS  29          HD1       LYS  29  11.722  -0.870   1.406
  259   1HE   LYS  29          HE2       LYS  29   8.876  -0.895   2.296
  260   2HE   LYS  29          HE1       LYS  29  10.148  -0.722   3.507
  261   1HZ   LYS  29          HZ1       LYS  29   9.330   1.421   2.690
  262   2HZ   LYS  29          HZ2       LYS  29   9.830   1.022   1.125
  263   3HZ   LYS  29          HZ3       LYS  29  10.974   1.207   2.355
  264    H    GLU  30           HN       GLU  30   9.321  -5.964   0.992
  265    HA   GLU  30           HA       GLU  30   6.794  -5.088   2.226
  266   1HB   GLU  30          HB2       GLU  30   7.904  -7.892   2.159
  267   2HB   GLU  30          HB1       GLU  30   6.328  -7.394   2.758
  268   1HG   GLU  30          HG2       GLU  30   5.558  -7.932   0.748
  269   2HG   GLU  30          HG1       GLU  30   6.324  -6.448   0.183
  270    H    VAL  31           HN       VAL  31   7.260  -4.017   4.013
  271    HA   VAL  31           HA       VAL  31   9.440  -4.935   5.727
  272    HB   VAL  31           HB       VAL  31   7.901  -2.680   6.734
  273   1HG1  VAL  31          HG11      VAL  31   9.971  -3.101   7.731
  274   2HG1  VAL  31          HG12      VAL  31  10.256  -1.688   6.714
  275   3HG1  VAL  31          HG13      VAL  31  10.783  -3.283   6.176
  276   1HG2  VAL  31          HG21      VAL  31   8.779  -1.053   5.064
  277   2HG2  VAL  31          HG22      VAL  31   7.538  -2.128   4.421
  278   3HG2  VAL  31          HG23      VAL  31   9.235  -2.416   4.043
  279    H    ASP  32           HN       ASP  32   8.644  -6.729   6.650
  280    HA   ASP  32           HA       ASP  32   6.070  -7.086   7.702
  281   1HB   ASP  32          HB2       ASP  32   7.113  -9.001   8.959
  282   2HB   ASP  32          HB1       ASP  32   7.395  -9.014   7.221
  283    H    LYS  33           HN       LYS  33   8.661  -5.230   8.913
  284    HA   LYS  33           HA       LYS  33   8.535  -5.491  11.644
  285   1HB   LYS  33          HB2       LYS  33  10.000  -3.927  10.261
  286   2HB   LYS  33          HB1       LYS  33   8.647  -2.804  10.278
  287   1HG   LYS  33          HG2       LYS  33   9.427  -2.005  12.188
  288   2HG   LYS  33          HG1       LYS  33   9.007  -3.544  12.942
  289   1HD   LYS  33          HD2       LYS  33  11.560  -3.455  11.452
  290   2HD   LYS  33          HD1       LYS  33  11.491  -2.528  12.952
  291   1HE   LYS  33          HE2       LYS  33  11.363  -4.378  14.247
  292   2HE   LYS  33          HE1       LYS  33  10.395  -5.263  13.069
  293   1HZ   LYS  33          HZ1       LYS  33  12.621  -5.254  11.744
  294   2HZ   LYS  33          HZ2       LYS  33  12.366  -6.390  12.970
  295   3HZ   LYS  33          HZ3       LYS  33  13.312  -5.021  13.271
  296    H    ASN  34           HN       ASN  34   6.509  -3.358   9.650
  297    HA   ASN  34           HA       ASN  34   4.069  -3.821  10.709
  298   1HB   ASN  34          HB2       ASN  34   3.844  -1.852  12.373
  299   2HB   ASN  34          HB1       ASN  34   4.586  -3.346  12.935
  300   1HD2  ASN  34          HD21      ASN  34   5.476  -0.269  11.413
  301   2HD2  ASN  34          HD22      ASN  34   6.928  -0.043  12.322
  302    H    TRP  35           HN       TRP  35   5.615  -2.507   8.449
  303    HA   TRP  35           HA       TRP  35   3.544  -0.665   7.729
  304   1HB   TRP  35          HB2       TRP  35   5.689   0.446   9.081
  305   2HB   TRP  35          HB1       TRP  35   6.097   0.715   7.389
  306    HD1  TRP  35           HD1      TRP  35   4.306   2.188   5.936
  307    HE1  TRP  35           HE1      TRP  35   2.690   4.045   6.688
  308    HE3  TRP  35           HE3      TRP  35   4.249   1.231  10.958
  309    HZ2  TRP  35           HZ2      TRP  35   1.544   4.981   9.092
  310    HZ3  TRP  35           HZ3      TRP  35   2.867   2.654  12.414
  311    HH2  TRP  35           HH2      TRP  35   1.544   4.490  11.499
  312    H    LEU  36           HN       LEU  36   3.121  -1.256   5.695
  313    HA   LEU  36           HA       LEU  36   5.180  -2.440   4.049
  314   1HB   LEU  36          HB2       LEU  36   2.903  -3.375   4.210
  315   2HB   LEU  36          HB1       LEU  36   2.268  -1.902   3.502
  316    HG   LEU  36           HG       LEU  36   4.001  -2.545   1.580
  317   1HD1  LEU  36          HD11      LEU  36   4.694  -4.665   1.554
  318   2HD1  LEU  36          HD12      LEU  36   3.099  -5.278   1.994
  319   3HD1  LEU  36          HD13      LEU  36   4.211  -4.729   3.250
  320   1HD2  LEU  36          HD21      LEU  36   1.723  -4.156   1.091
  321   2HD2  LEU  36          HD22      LEU  36   2.048  -2.517   0.525
  322   3HD2  LEU  36          HD23      LEU  36   1.200  -2.771   2.051
  323    H    GLU  37           HN       GLU  37   5.734  -1.681   1.953
  324    HA   GLU  37           HA       GLU  37   5.262   1.204   1.573
  325   1HB   GLU  37          HB2       GLU  37   7.598   0.724   2.045
  326   2HB   GLU  37          HB1       GLU  37   7.639  -0.478   0.764
  327   1HG   GLU  37          HG2       GLU  37   6.748   1.957  -0.372
  328   2HG   GLU  37          HG1       GLU  37   8.167   2.306   0.614
  329    H    GLY  38           HN       GLY  38   4.359   1.877  -0.281
  330   1HA   GLY  38          HA2       GLY  38   4.047  -0.120  -2.438
  331   2HA   GLY  38          HA1       GLY  38   2.757   0.976  -1.968
  332    H    GLU  39           HN       GLU  39   3.843   0.684  -4.584
  333    HA   GLU  39           HA       GLU  39   4.693   3.450  -5.023
  334   1HB   GLU  39          HB2       GLU  39   6.260   1.024  -5.617
  335   2HB   GLU  39          HB1       GLU  39   6.142   2.168  -6.947
  336   1HG   GLU  39          HG2       GLU  39   6.934   3.943  -5.375
  337   2HG   GLU  39          HG1       GLU  39   7.233   2.671  -4.193
  338    H    HIS  40           HN       HIS  40   3.981   4.337  -6.965
  339    HA   HIS  40           HA       HIS  40   2.556   2.617  -8.841
  340   1HB   HIS  40          HB2       HIS  40   0.569   4.140  -8.794
  341   2HB   HIS  40          HB1       HIS  40   0.791   3.203  -7.321
  342    HD1  HIS  40           HD1      HIS  40   2.450   4.744  -5.531
  343    HD2  HIS  40           HD2      HIS  40  -0.135   6.658  -8.162
  344    HE1  HIS  40           HE1      HIS  40   2.073   7.032  -4.558
  345    HE2  HIS  40           HE2      HIS  40   0.442   8.142  -6.124
  346    H    HIS  41           HN       HIS  41   3.047   3.170 -10.847
  347    HA   HIS  41           HA       HIS  41   3.917   4.305 -12.619
  348   1HB   HIS  41          HB2       HIS  41   2.202   6.367 -11.264
  349   2HB   HIS  41          HB1       HIS  41   3.101   6.765 -12.724
  350    HD1  HIS  41           HD1      HIS  41   1.637   6.616 -14.699
  351    HD2  HIS  41           HD2      HIS  41   0.685   3.729 -11.866
  352    HE1  HIS  41           HE1      HIS  41  -0.266   5.306 -15.689
  353    HE2  HIS  41           HE2      HIS  41  -0.772   3.513 -13.992
  354    H    GLY  42           HN       GLY  42   5.680   4.077 -10.410
  355   1HA   GLY  42          HA2       GLY  42   7.870   4.809 -10.107
  356   2HA   GLY  42          HA1       GLY  42   7.506   6.223 -11.083
  357    H    ARG  43           HN       ARG  43   5.033   6.350  -9.081
  358    HA   ARG  43           HA       ARG  43   6.330   8.260  -7.347
  359   1HB   ARG  43          HB2       ARG  43   3.844   8.148  -8.465
  360   2HB   ARG  43          HB1       ARG  43   3.507   7.591  -6.831
  361   1HG   ARG  43          HG2       ARG  43   5.111  10.073  -7.262
  362   2HG   ARG  43          HG1       ARG  43   3.352  10.115  -7.390
  363   1HD   ARG  43          HD2       ARG  43   3.119  10.078  -5.177
  364   2HD   ARG  43          HD1       ARG  43   4.180   8.679  -5.027
  365    HE   ARG  43           HE       ARG  43   5.916  10.707  -5.406
  366   1HH1  ARG  43          HH11      ARG  43   3.249  10.260  -3.200
  367   2HH1  ARG  43          HH12      ARG  43   3.951  11.241  -1.957
  368   1HH2  ARG  43          HH21      ARG  43   6.840  11.996  -3.772
  369   2HH2  ARG  43          HH22      ARG  43   5.988  12.226  -2.281
  370    H    LEU  44           HN       LEU  44   6.137   8.231  -5.032
  371    HA   LEU  44           HA       LEU  44   6.314   5.509  -3.974
  372   1HB   LEU  44          HB2       LEU  44   8.216   6.914  -3.512
  373   2HB   LEU  44          HB1       LEU  44   7.185   8.171  -2.855
  374    HG   LEU  44           HG       LEU  44   6.575   5.986  -1.279
  375   1HD1  LEU  44          HD11      LEU  44   8.266   4.542  -1.832
  376   2HD1  LEU  44          HD12      LEU  44   9.024   5.446  -0.521
  377   3HD1  LEU  44          HD13      LEU  44   9.404   5.838  -2.198
  378   1HD2  LEU  44          HD21      LEU  44   8.768   7.749  -0.374
  379   2HD2  LEU  44          HD22      LEU  44   7.241   7.341   0.407
  380   3HD2  LEU  44          HD23      LEU  44   7.276   8.535  -0.890
  381    H    GLY  45           HN       GLY  45   4.828   4.671  -2.661
  382   1HA   GLY  45          HA2       GLY  45   3.031   6.442  -1.179
  383   2HA   GLY  45          HA1       GLY  45   2.307   5.311  -2.310
  384    H    ILE  46           HN       ILE  46   3.460   5.763   0.832
  385    HA   ILE  46           HA       ILE  46   3.433   2.863   1.336
  386    HB   ILE  46           HB       ILE  46   4.716   5.047   2.978
  387   1HG1  ILE  46          HG12      ILE  46   5.823   3.065   0.992
  388   2HG1  ILE  46          HG11      ILE  46   5.900   4.822   0.914
  389   1HG2  ILE  46          HG21      ILE  46   5.479   2.218   3.328
  390   2HG2  ILE  46          HG22      ILE  46   3.897   2.680   3.947
  391   3HG2  ILE  46          HG23      ILE  46   5.340   3.511   4.517
  392   1HD1  ILE  46          HD11      ILE  46   7.458   2.937   2.617
  393   2HD1  ILE  46          HD12      ILE  46   7.254   4.624   3.094
  394   3HD1  ILE  46          HD13      ILE  46   8.027   4.229   1.559
  395    H    PHE  47           HN       PHE  47   2.289   2.042   3.072
  396    HA   PHE  47           HA       PHE  47   0.712   3.747   4.778
  397   1HB   PHE  47          HB2       PHE  47  -1.438   2.537   4.043
  398   2HB   PHE  47          HB1       PHE  47  -0.833   3.825   3.007
  399    HD1  PHE  47           HD1      PHE  47  -1.023   0.157   3.405
  400    HD2  PHE  47           HD2      PHE  47  -0.211   3.405   0.778
  401    HE1  PHE  47           HE1      PHE  47  -0.992  -1.398   1.499
  402    HE2  PHE  47           HE2      PHE  47  -0.180   1.856  -1.134
  403    HZ   PHE  47           HZ       PHE  47  -0.571  -0.549  -0.775
  404    HA   PRO  48           HA       PRO  48   0.984   0.470   7.697
  405   1HB   PRO  48          HB2       PRO  48  -1.986   0.520   7.932
  406   2HB   PRO  48          HB1       PRO  48  -0.755   0.652   9.193
  407   1HG   PRO  48          HG2       PRO  48  -2.096   2.802   8.377
  408   2HG   PRO  48          HG1       PRO  48  -0.367   2.899   8.764
  409   1HD   PRO  48          HD2       PRO  48  -1.717   2.846   6.101
  410   2HD   PRO  48          HD1       PRO  48  -0.267   3.732   6.615
  411    H    ALA  49           HN       ALA  49   1.187  -1.670   7.475
  412    HA   ALA  49           HA       ALA  49   0.164  -3.030   5.217
  413   1HB   ALA  49          HB1       ALA  49   2.238  -3.465   6.873
  414   2HB   ALA  49          HB2       ALA  49   1.579  -4.690   5.790
  415   3HB   ALA  49          HB3       ALA  49   1.098  -4.662   7.486
  416    H    ASN  50           HN       ASN  50  -0.963  -2.689   8.498
  417    HA   ASN  50           HA       ASN  50  -2.750  -4.893   8.503
  418   1HB   ASN  50          HB2       ASN  50  -1.892  -3.667  10.537
  419   2HB   ASN  50          HB1       ASN  50  -3.009  -2.366  10.136
  420   1HD2  ASN  50          HD21      ASN  50  -2.982  -5.886  10.574
  421   2HD2  ASN  50          HD22      ASN  50  -4.493  -5.964  11.409
  422    H    TYR  51           HN       TYR  51  -2.921  -1.701   7.185
  423    HA   TYR  51           HA       TYR  51  -5.817  -1.903   6.815
  424   1HB   TYR  51          HB2       TYR  51  -3.849   0.355   6.507
  425   2HB   TYR  51          HB1       TYR  51  -5.483   0.462   5.861
  426    HD1  TYR  51           HD1      TYR  51  -3.573  -0.064   9.004
  427    HD2  TYR  51           HD2      TYR  51  -7.279   1.067   7.246
  428    HE1  TYR  51           HE1      TYR  51  -4.389   0.663  11.206
  429    HE2  TYR  51           HE2      TYR  51  -8.105   1.799   9.444
  430    HH   TYR  51           HH       TYR  51  -6.602   0.990  12.335
  431    H    VAL  52           HN       VAL  52  -4.211  -3.719   5.370
  432    HA   VAL  52           HA       VAL  52  -5.072  -3.069   2.686
  433    HB   VAL  52           HB       VAL  52  -2.845  -2.061   2.711
  434   1HG1  VAL  52          HG11      VAL  52  -0.896  -3.765   2.844
  435   2HG1  VAL  52          HG12      VAL  52  -2.046  -4.749   3.749
  436   3HG1  VAL  52          HG13      VAL  52  -1.605  -3.145   4.335
  437   1HG2  VAL  52          HG21      VAL  52  -2.169  -2.889   0.673
  438   2HG2  VAL  52          HG22      VAL  52  -3.829  -3.481   0.745
  439   3HG2  VAL  52          HG23      VAL  52  -2.489  -4.563   1.125
  440    H    GLU  53           HN       GLU  53  -5.141  -4.887   1.290
  441    HA   GLU  53           HA       GLU  53  -4.832  -7.470   2.676
  442   1HB   GLU  53          HB2       GLU  53  -7.188  -6.380   1.801
  443   2HB   GLU  53          HB1       GLU  53  -6.730  -7.384   0.432
  444   1HG   GLU  53          HG2       GLU  53  -6.625  -8.552   3.165
  445   2HG   GLU  53          HG1       GLU  53  -8.192  -8.331   2.388
  446    H    VAL  54           HN       VAL  54  -3.347  -8.749   1.815
  447    HA   VAL  54           HA       VAL  54  -2.136  -8.143  -0.714
  448    HB   VAL  54           HB       VAL  54  -0.806  -9.010   1.168
  449   1HG1  VAL  54          HG11      VAL  54  -0.997 -11.197   2.005
  450   2HG1  VAL  54          HG12      VAL  54  -2.061 -11.697   0.690
  451   3HG1  VAL  54          HG13      VAL  54  -2.651 -10.590   1.930
  452   1HG2  VAL  54          HG21      VAL  54  -0.297  -9.406  -1.344
  453   2HG2  VAL  54          HG22      VAL  54  -0.671 -11.090  -0.977
  454   3HG2  VAL  54          HG23      VAL  54   0.640 -10.273  -0.126
  455    H    LEU  55           HN       LEU  55  -2.835  -8.804  -2.629
  456    HA   LEU  55           HA       LEU  55  -3.569 -11.448  -3.228
  457   1HB   LEU  55          HB2       LEU  55  -5.948 -11.166  -3.708
  458   2HB   LEU  55          HB1       LEU  55  -5.602 -10.939  -2.004
  459    HG   LEU  55           HG       LEU  55  -5.501  -8.394  -3.321
  460   1HD1  LEU  55          HD11      LEU  55  -8.040  -8.395  -3.796
  461   2HD1  LEU  55          HD12      LEU  55  -7.838 -10.137  -3.985
  462   3HD1  LEU  55          HD13      LEU  55  -6.940  -9.028  -5.021
  463   1HD2  LEU  55          HD21      LEU  55  -7.261  -9.641  -1.223
  464   2HD2  LEU  55          HD22      LEU  55  -7.385  -7.951  -1.709
  465   3HD2  LEU  55          HD23      LEU  55  -5.892  -8.554  -0.989
  466    HA   PRO  56           HA       PRO  56  -2.072  -8.719  -6.706
  467   1HB   PRO  56          HB2       PRO  56  -1.231 -11.468  -7.507
  468   2HB   PRO  56          HB1       PRO  56  -0.344  -9.943  -7.617
  469   1HG   PRO  56          HG2       PRO  56   0.243 -11.709  -5.719
  470   2HG   PRO  56          HG1       PRO  56   0.243  -9.969  -5.371
  471   1HD   PRO  56          HD2       PRO  56  -1.765 -12.051  -4.639
  472   2HD   PRO  56          HD1       PRO  56  -1.242 -10.617  -3.733
  473    H    LEU  57           HN       LEU  57  -3.014  -8.435  -8.683
  474    HA   LEU  57           HA       LEU  57  -4.953 -10.466  -9.567
  475   1HB   LEU  57          HB2       LEU  57  -5.363  -7.476  -9.660
  476   2HB   LEU  57          HB1       LEU  57  -6.489  -8.693 -10.230
  477    HG   LEU  57           HG       LEU  57  -6.224  -9.477  -7.658
  478   1HD1  LEU  57          HD11      LEU  57  -5.948  -6.475  -7.633
  479   2HD1  LEU  57          HD12      LEU  57  -4.736  -7.635  -7.089
  480   3HD1  LEU  57          HD13      LEU  57  -6.270  -7.495  -6.231
  481   1HD2  LEU  57          HD21      LEU  57  -8.287  -7.889  -7.318
  482   2HD2  LEU  57          HD22      LEU  57  -8.377  -9.267  -8.415
  483   3HD2  LEU  57          HD23      LEU  57  -8.111  -7.645  -9.056
  484    H    GLU  58           HN       GLU  58  -2.231 -10.024 -10.432
  485    HA   GLU  58           HA       GLU  58  -2.044  -8.542 -12.798
  486   1HB   GLU  58          HB2       GLU  58  -0.327 -10.083 -11.293
  487   2HB   GLU  58          HB1       GLU  58  -0.460 -11.006 -12.784
  488   1HG   GLU  58          HG2       GLU  58   0.314  -9.171 -14.082
  489   2HG   GLU  58          HG1       GLU  58   0.209  -8.077 -12.704
  Start of MODEL   11
    1   1H    MET   0          HT1       MET   0   5.729  -6.195  -9.269
    2   2H    MET   0          HT2       MET   0   6.950  -7.228  -9.893
    3   3H    MET   0          HT3       MET   0   6.498  -7.329  -8.240
    4    HA   MET   0           HA       MET   0   4.607  -7.808 -10.429
    5   1HB   MET   0          HB2       MET   0   6.561  -9.675  -9.090
    6   2HB   MET   0          HB1       MET   0   5.106 -10.258  -9.886
    7   1HG   MET   0          HG2       MET   0   6.804  -8.445 -11.468
    8   2HG   MET   0          HG1       MET   0   7.488 -10.026 -11.097
    9   1HE   MET   0          HE1       MET   0   6.143 -10.179 -14.844
   10   2HE   MET   0          HE2       MET   0   7.577 -10.011 -13.832
   11   3HE   MET   0          HE3       MET   0   6.502  -8.634 -14.075
   12    H    LYS   1           HN       LYS   1   4.106  -6.363  -8.081
   13    HA   LYS   1           HA       LYS   1   2.461  -8.289  -6.575
   14   1HB   LYS   1          HB2       LYS   1   4.401  -6.308  -5.621
   15   2HB   LYS   1          HB1       LYS   1   2.837  -6.199  -4.824
   16   1HG   LYS   1          HG2       LYS   1   4.312  -7.636  -3.570
   17   2HG   LYS   1          HG1       LYS   1   2.981  -8.579  -4.244
   18   1HD   LYS   1          HD2       LYS   1   4.347  -9.797  -5.555
   19   2HD   LYS   1          HD1       LYS   1   5.356  -8.408  -5.962
   20   1HE   LYS   1          HE2       LYS   1   5.515  -9.425  -3.185
   21   2HE   LYS   1          HE1       LYS   1   6.215 -10.436  -4.448
   22   1HZ   LYS   1          HZ1       LYS   1   7.997  -9.139  -4.046
   23   2HZ   LYS   1          HZ2       LYS   1   7.084  -7.846  -3.450
   24   3HZ   LYS   1          HZ3       LYS   1   7.225  -8.082  -5.119
   25    H    ALA   2           HN       ALA   2   0.397  -7.640  -5.996
   26    HA   ALA   2           HA       ALA   2  -0.515  -4.973  -6.703
   27   1HB   ALA   2          HB1       ALA   2  -1.993  -7.297  -7.889
   28   2HB   ALA   2          HB2       ALA   2  -0.666  -6.516  -8.751
   29   3HB   ALA   2          HB3       ALA   2  -2.097  -5.586  -8.305
   30    H    ALA   3           HN       ALA   3  -1.673  -4.312  -5.027
   31    HA   ALA   3           HA       ALA   3  -3.530  -6.197  -3.752
   32   1HB   ALA   3          HB1       ALA   3  -2.517  -4.414  -1.766
   33   2HB   ALA   3          HB2       ALA   3  -1.164  -5.213  -2.567
   34   3HB   ALA   3          HB3       ALA   3  -2.439  -6.175  -1.821
   35    H    ARG   4           HN       ARG   4  -5.379  -5.265  -2.824
   36    HA   ARG   4           HA       ARG   4  -5.901  -2.505  -3.711
   37   1HB   ARG   4          HB2       ARG   4  -7.268  -4.699  -4.467
   38   2HB   ARG   4          HB1       ARG   4  -8.171  -4.279  -3.018
   39   1HG   ARG   4          HG2       ARG   4  -8.394  -1.958  -3.969
   40   2HG   ARG   4          HG1       ARG   4  -7.744  -2.606  -5.476
   41   1HD   ARG   4          HD2       ARG   4 -10.298  -3.368  -4.078
   42   2HD   ARG   4          HD1       ARG   4 -10.109  -2.637  -5.669
   43    HE   ARG   4           HE       ARG   4  -9.509  -4.711  -6.541
   44   1HH1  ARG   4          HH11      ARG   4 -10.009  -4.913  -3.086
   45   2HH1  ARG   4          HH12      ARG   4 -10.084  -6.642  -3.078
   46   1HH2  ARG   4          HH21      ARG   4  -9.614  -6.981  -6.522
   47   2HH2  ARG   4          HH22      ARG   4  -9.862  -7.815  -5.025
   48    H    LEU   5           HN       LEU   5  -6.421  -1.000  -2.250
   49    HA   LEU   5           HA       LEU   5  -6.107  -1.485   0.507
   50   1HB   LEU   5          HB2       LEU   5  -5.968   0.717  -0.968
   51   2HB   LEU   5          HB1       LEU   5  -7.627   0.897  -0.431
   52    HG   LEU   5           HG       LEU   5  -6.542   0.473   1.949
   53   1HD1  LEU   5          HD11      LEU   5  -4.337   0.872   2.188
   54   2HD1  LEU   5          HD12      LEU   5  -4.296   2.046   0.872
   55   3HD1  LEU   5          HD13      LEU   5  -4.275   0.320   0.514
   56   1HD2  LEU   5          HD21      LEU   5  -6.766   2.968   0.326
   57   2HD2  LEU   5          HD22      LEU   5  -6.088   3.041   1.953
   58   3HD2  LEU   5          HD23      LEU   5  -7.725   2.434   1.706
   59    H    LYS   6           HN       LYS   6  -7.587  -1.527   2.197
   60    HA   LYS   6           HA       LYS   6 -10.370  -2.074   1.400
   61   1HB   LYS   6          HB2       LYS   6  -8.544  -3.715   2.798
   62   2HB   LYS   6          HB1       LYS   6  -9.746  -3.192   3.970
   63   1HG   LYS   6          HG2       LYS   6 -11.083  -3.951   1.574
   64   2HG   LYS   6          HG1       LYS   6  -9.954  -5.229   2.028
   65   1HD   LYS   6          HD2       LYS   6 -10.935  -5.409   4.207
   66   2HD   LYS   6          HD1       LYS   6 -11.937  -3.984   3.926
   67   1HE   LYS   6          HE2       LYS   6 -12.652  -5.544   1.827
   68   2HE   LYS   6          HE1       LYS   6 -12.307  -6.767   3.049
   69   1HZ   LYS   6          HZ1       LYS   6 -14.454  -6.347   3.563
   70   2HZ   LYS   6          HZ2       LYS   6 -14.424  -4.763   2.971
   71   3HZ   LYS   6          HZ3       LYS   6 -13.763  -5.110   4.489
   72    H    PHE   7           HN       PHE   7  -8.340  -0.042   3.203
   73    HA   PHE   7           HA       PHE   7 -10.665   1.261   4.379
   74   1HB   PHE   7          HB2       PHE   7  -8.247   0.692   6.090
   75   2HB   PHE   7          HB1       PHE   7  -9.808   1.330   6.597
   76    HD1  PHE   7           HD1      PHE   7 -11.766  -0.149   6.727
   77    HD2  PHE   7           HD2      PHE   7  -7.886  -1.643   5.827
   78    HE1  PHE   7           HE1      PHE   7 -12.528  -2.429   7.252
   79    HE2  PHE   7           HE2      PHE   7  -8.639  -3.926   6.349
   80    HZ   PHE   7           HZ       PHE   7 -10.963  -4.321   7.063
   81    H    ASP   8           HN       ASP   8 -10.529   3.424   4.285
   82    HA   ASP   8           HA       ASP   8  -8.464   4.675   2.848
   83   1HB   ASP   8          HB2       ASP   8  -9.558   6.798   3.535
   84   2HB   ASP   8          HB1       ASP   8 -10.697   5.618   2.895
   85    H    PHE   9           HN       PHE   9  -6.469   5.096   3.493
   86    HA   PHE   9           HA       PHE   9  -5.950   5.474   6.360
   87   1HB   PHE   9          HB2       PHE   9  -4.729   3.648   5.163
   88   2HB   PHE   9          HB1       PHE   9  -3.961   4.875   4.162
   89    HD1  PHE   9           HD1      PHE   9  -4.629   4.607   7.825
   90    HD2  PHE   9           HD2      PHE   9  -1.753   5.095   4.727
   91    HE1  PHE   9           HE1      PHE   9  -2.859   4.869   9.515
   92    HE2  PHE   9           HE2      PHE   9   0.022   5.358   6.410
   93    HZ   PHE   9           HZ       PHE   9  -0.530   5.245   8.807
   94    H    GLN  10           HN       GLN  10  -5.325   7.388   7.124
   95    HA   GLN  10           HA       GLN  10  -4.937   9.575   5.231
   96   1HB   GLN  10          HB2       GLN  10  -6.526   9.708   7.214
   97   2HB   GLN  10          HB1       GLN  10  -5.097   9.778   8.235
   98   1HG   GLN  10          HG2       GLN  10  -5.808  12.000   7.917
   99   2HG   GLN  10          HG1       GLN  10  -4.376  11.785   6.910
  100   1HE2  GLN  10          HE21      GLN  10  -7.897  11.384   6.680
  101   2HE2  GLN  10          HE22      GLN  10  -8.045  12.081   5.107
  102    H    ALA  11           HN       ALA  11  -2.908   9.797   4.535
  103    HA   ALA  11           HA       ALA  11  -0.622   8.986   6.017
  104   1HB   ALA  11          HB1       ALA  11  -0.915  10.648   3.523
  105   2HB   ALA  11          HB2       ALA  11  -0.498   8.938   3.639
  106   3HB   ALA  11          HB3       ALA  11   0.640  10.163   4.200
  107    H    GLN  12           HN       GLN  12   0.551  10.058   7.472
  108    HA   GLN  12           HA       GLN  12  -0.091  12.879   7.953
  109   1HB   GLN  12          HB2       GLN  12   1.282  12.275  10.134
  110   2HB   GLN  12          HB1       GLN  12  -0.426  11.898   9.991
  111   1HG   GLN  12          HG2       GLN  12   0.128   9.608   9.364
  112   2HG   GLN  12          HG1       GLN  12   1.845   9.988   9.489
  113   1HE2  GLN  12          HE21      GLN  12  -1.157   9.991  11.357
  114   2HE2  GLN  12          HE22      GLN  12  -0.423   9.599  12.871
  115    H    SER  13           HN       SER  13   2.532  10.661   7.283
  116    HA   SER  13           HA       SER  13   4.528  12.762   7.517
  117   1HB   SER  13          HB2       SER  13   4.703  10.138   8.063
  118   2HB   SER  13          HB1       SER  13   5.253  10.111   6.388
  119    HG   SER  13           HG       SER  13   6.361  11.514   8.580
  120    HA   PRO  14           HA       PRO  14   4.530  14.100   3.316
  121   1HB   PRO  14          HB2       PRO  14   7.495  13.925   3.463
  122   2HB   PRO  14          HB1       PRO  14   6.468  15.295   3.026
  123   1HG   PRO  14          HG2       PRO  14   7.685  15.205   5.394
  124   2HG   PRO  14          HG1       PRO  14   6.041  15.851   5.235
  125   1HD   PRO  14          HD2       PRO  14   6.949  13.206   6.287
  126   2HD   PRO  14          HD1       PRO  14   5.621  14.247   6.841
  127    H    LYS  15           HN       LYS  15   6.490  11.354   4.274
  128    HA   LYS  15           HA       LYS  15   6.893  10.430   1.574
  129   1HB   LYS  15          HB2       LYS  15   7.854   8.415   2.696
  130   2HB   LYS  15          HB1       LYS  15   8.608   9.929   3.175
  131   1HG   LYS  15          HG2       LYS  15   6.474   9.426   4.968
  132   2HG   LYS  15          HG1       LYS  15   7.409   7.939   4.807
  133   1HD   LYS  15          HD2       LYS  15   9.294  10.007   5.006
  134   2HD   LYS  15          HD1       LYS  15   8.059  10.367   6.214
  135   1HE   LYS  15          HE2       LYS  15   9.237   7.620   5.949
  136   2HE   LYS  15          HE1       LYS  15  10.036   8.873   6.898
  137   1HZ   LYS  15          HZ1       LYS  15   7.291   7.823   7.330
  138   2HZ   LYS  15          HZ2       LYS  15   7.987   9.093   8.204
  139   3HZ   LYS  15          HZ3       LYS  15   8.642   7.538   8.309
  140    H    GLU  16           HN       GLU  16   4.604   9.898   4.144
  141    HA   GLU  16           HA       GLU  16   3.503   7.479   3.125
  142   1HB   GLU  16          HB2       GLU  16   2.640   9.509   5.155
  143   2HB   GLU  16          HB1       GLU  16   1.522   8.258   4.632
  144   1HG   GLU  16          HG2       GLU  16   3.916   6.937   5.215
  145   2HG   GLU  16          HG1       GLU  16   3.682   8.108   6.512
  146    H    LEU  17           HN       LEU  17   1.312   7.246   2.276
  147    HA   LEU  17           HA       LEU  17   0.395   9.589   0.752
  148   1HB   LEU  17          HB2       LEU  17   1.673   8.086  -0.720
  149   2HB   LEU  17          HB1       LEU  17   0.601   6.765  -0.294
  150    HG   LEU  17           HG       LEU  17  -0.629   9.214  -1.450
  151   1HD1  LEU  17          HD11      LEU  17   0.758   7.152  -3.152
  152   2HD1  LEU  17          HD12      LEU  17   1.384   8.771  -2.839
  153   3HD1  LEU  17          HD13      LEU  17  -0.139   8.566  -3.704
  154   1HD2  LEU  17          HD21      LEU  17  -2.128   7.499  -0.820
  155   2HD2  LEU  17          HD22      LEU  17  -1.130   6.251  -1.566
  156   3HD2  LEU  17          HD23      LEU  17  -1.994   7.410  -2.576
  157    H    THR  18           HN       THR  18  -1.761   9.915   0.712
  158    HA   THR  18           HA       THR  18  -3.404   8.099   2.306
  159    HB   THR  18           HB       THR  18  -4.017  10.866   1.248
  160    HG1  THR  18           HG1      THR  18  -2.700  11.350   2.818
  161   1HG2  THR  18          HG21      THR  18  -5.553  10.351   3.507
  162   2HG2  THR  18          HG22      THR  18  -5.707   8.910   2.501
  163   3HG2  THR  18          HG23      THR  18  -6.112  10.495   1.841
  164    H    LEU  19           HN       LEU  19  -4.869   6.776   1.438
  165    HA   LEU  19           HA       LEU  19  -6.018   7.377  -1.171
  166   1HB   LEU  19          HB2       LEU  19  -5.522   5.148  -2.050
  167   2HB   LEU  19          HB1       LEU  19  -4.061   6.063  -1.730
  168    HG   LEU  19           HG       LEU  19  -5.113   4.079   0.265
  169   1HD1  LEU  19          HD11      LEU  19  -4.856   2.562  -1.403
  170   2HD1  LEU  19          HD12      LEU  19  -3.172   2.676  -0.891
  171   3HD1  LEU  19          HD13      LEU  19  -3.727   3.575  -2.303
  172   1HD2  LEU  19          HD21      LEU  19  -2.552   3.982   0.646
  173   2HD2  LEU  19          HD22      LEU  19  -3.463   5.363   1.258
  174   3HD2  LEU  19          HD23      LEU  19  -2.535   5.511  -0.234
  175    H    GLN  20           HN       GLN  20  -8.017   6.439  -1.533
  176    HA   GLN  20           HA       GLN  20  -9.331   5.419   0.858
  177   1HB   GLN  20          HB2       GLN  20 -10.288   7.278  -0.580
  178   2HB   GLN  20          HB1       GLN  20 -10.604   6.054  -1.803
  179   1HG   GLN  20          HG2       GLN  20 -12.326   5.146  -0.653
  180   2HG   GLN  20          HG1       GLN  20 -11.616   5.511   0.919
  181   1HE2  GLN  20          HE21      GLN  20 -14.246   5.938   0.588
  182   2HE2  GLN  20          HE22      GLN  20 -14.590   7.629   0.515
  183    H    LYS  21           HN       LYS  21 -10.945   3.637   0.579
  184    HA   LYS  21           HA       LYS  21  -9.743   1.268  -0.162
  185   1HB   LYS  21          HB2       LYS  21 -12.714   1.819  -0.118
  186   2HB   LYS  21          HB1       LYS  21 -11.950   0.240   0.000
  187   1HG   LYS  21          HG2       LYS  21 -12.223   0.553   2.200
  188   2HG   LYS  21          HG1       LYS  21 -10.751   1.514   2.052
  189   1HD   LYS  21          HD2       LYS  21 -11.907   3.226   2.890
  190   2HD   LYS  21          HD1       LYS  21 -12.801   3.267   1.369
  191   1HE   LYS  21          HE2       LYS  21 -14.553   3.053   2.805
  192   2HE   LYS  21          HE1       LYS  21 -14.181   1.346   2.570
  193   1HZ   LYS  21          HZ1       LYS  21 -14.181   1.370   4.809
  194   2HZ   LYS  21          HZ2       LYS  21 -13.814   3.018   4.920
  195   3HZ   LYS  21          HZ3       LYS  21 -12.585   1.898   4.610
  196    H    GLY  22           HN       GLY  22 -10.065  -0.194  -1.897
  197   1HA   GLY  22          HA2       GLY  22 -10.716  -0.813  -4.064
  198   2HA   GLY  22          HA1       GLY  22 -11.364   0.807  -4.306
  199    H    ASP  23           HN       ASP  23  -8.568   1.656  -3.125
  200    HA   ASP  23           HA       ASP  23  -7.383   2.080  -5.709
  201   1HB   ASP  23          HB2       ASP  23  -7.397   3.667  -3.643
  202   2HB   ASP  23          HB1       ASP  23  -6.015   2.713  -3.112
  203    H    ILE  24           HN       ILE  24  -5.764   0.988  -6.639
  204    HA   ILE  24           HA       ILE  24  -4.458  -1.128  -5.057
  205    HB   ILE  24           HB       ILE  24  -5.882  -2.011  -6.852
  206   1HG1  ILE  24          HG12      ILE  24  -3.357  -2.709  -8.086
  207   2HG1  ILE  24          HG11      ILE  24  -3.201  -2.657  -6.333
  208   1HG2  ILE  24          HG21      ILE  24  -4.276  -1.323  -9.123
  209   2HG2  ILE  24          HG22      ILE  24  -4.845   0.144  -8.325
  210   3HG2  ILE  24          HG23      ILE  24  -6.002  -1.075  -8.858
  211   1HD1  ILE  24          HD11      ILE  24  -3.766  -4.869  -6.889
  212   2HD1  ILE  24          HD12      ILE  24  -5.051  -4.349  -7.979
  213   3HD1  ILE  24          HD13      ILE  24  -5.234  -4.143  -6.237
  214    H    VAL  25           HN       VAL  25  -2.283  -1.197  -4.969
  215    HA   VAL  25           HA       VAL  25  -0.741   0.508  -6.795
  216    HB   VAL  25           HB       VAL  25   0.682   1.267  -4.924
  217   1HG1  VAL  25          HG11      VAL  25  -1.153   2.726  -3.827
  218   2HG1  VAL  25          HG12      VAL  25  -2.233   1.942  -4.979
  219   3HG1  VAL  25          HG13      VAL  25  -0.858   2.882  -5.558
  220   1HG2  VAL  25          HG21      VAL  25  -0.175  -0.742  -3.474
  221   2HG2  VAL  25          HG22      VAL  25  -1.409   0.415  -2.975
  222   3HG2  VAL  25          HG23      VAL  25   0.297   0.776  -2.711
  223    H    TYR  26           HN       TYR  26   1.517  -0.057  -6.948
  224    HA   TYR  26           HA       TYR  26   1.918  -2.907  -6.808
  225   1HB   TYR  26          HB2       TYR  26   3.755  -0.686  -7.723
  226   2HB   TYR  26          HB1       TYR  26   4.092  -2.405  -7.894
  227    HD1  TYR  26           HD1      TYR  26   2.754  -3.780  -9.453
  228    HD2  TYR  26           HD2      TYR  26   2.248   0.437  -9.206
  229    HE1  TYR  26           HE1      TYR  26   1.573  -3.801 -11.610
  230    HE2  TYR  26           HE2      TYR  26   1.065   0.428 -11.361
  231    HH   TYR  26           HH       TYR  26   1.008  -2.322 -13.416
  232    H    ILE  27           HN       ILE  27   2.801  -3.967  -5.168
  233    HA   ILE  27           HA       ILE  27   3.934  -2.523  -2.944
  234    HB   ILE  27           HB       ILE  27   3.906  -5.515  -3.187
  235   1HG1  ILE  27          HG12      ILE  27   1.665  -4.979  -3.765
  236   2HG1  ILE  27          HG11      ILE  27   1.631  -5.368  -2.049
  237   1HG2  ILE  27          HG21      ILE  27   4.183  -3.515  -1.033
  238   2HG2  ILE  27          HG22      ILE  27   4.927  -5.104  -1.213
  239   3HG2  ILE  27          HG23      ILE  27   3.261  -4.969  -0.649
  240   1HD1  ILE  27          HD11      ILE  27   1.689  -2.938  -1.557
  241   2HD1  ILE  27          HD12      ILE  27   0.254  -3.456  -2.442
  242   3HD1  ILE  27          HD13      ILE  27   1.562  -2.629  -3.289
  243    H    HIS  28           HN       HIS  28   6.031  -2.465  -2.290
  244    HA   HIS  28           HA       HIS  28   8.009  -3.500  -4.193
  245   1HB   HIS  28          HB2       HIS  28   7.743  -1.007  -2.999
  246   2HB   HIS  28          HB1       HIS  28   9.051  -1.764  -2.096
  247    HD1  HIS  28           HD1      HIS  28  10.738  -0.085  -3.158
  248    HD2  HIS  28           HD2      HIS  28   8.827  -2.571  -5.885
  249    HE1  HIS  28           HE1      HIS  28  12.037   0.142  -5.300
  250    HE2  HIS  28           HE2      HIS  28  10.899  -1.418  -6.919
  251    H    LYS  29           HN       LYS  29   7.319  -3.332  -0.711
  252    HA   LYS  29           HA       LYS  29   8.507  -5.924  -0.325
  253   1HB   LYS  29          HB2       LYS  29  10.013  -5.003   1.554
  254   2HB   LYS  29          HB1       LYS  29  10.568  -4.856  -0.106
  255   1HG   LYS  29          HG2       LYS  29  10.961  -2.726   0.408
  256   2HG   LYS  29          HG1       LYS  29   9.219  -2.509   0.250
  257   1HD   LYS  29          HD2       LYS  29   9.993  -3.517   2.869
  258   2HD   LYS  29          HD1       LYS  29  10.734  -1.962   2.491
  259   1HE   LYS  29          HE2       LYS  29   8.182  -1.552   1.661
  260   2HE   LYS  29          HE1       LYS  29   7.927  -2.642   3.019
  261   1HZ   LYS  29          HZ1       LYS  29   9.594  -0.990   4.162
  262   2HZ   LYS  29          HZ2       LYS  29   7.938  -0.653   4.094
  263   3HZ   LYS  29          HZ3       LYS  29   8.996   0.082   2.997
  264    H    GLU  30           HN       GLU  30   7.808  -6.919   1.546
  265    HA   GLU  30           HA       GLU  30   5.674  -5.490   2.952
  266   1HB   GLU  30          HB2       GLU  30   6.257  -8.445   2.811
  267   2HB   GLU  30          HB1       GLU  30   4.884  -7.711   3.629
  268   1HG   GLU  30          HG2       GLU  30   3.816  -7.186   1.668
  269   2HG   GLU  30          HG1       GLU  30   5.313  -7.155   0.737
  270    H    VAL  31           HN       VAL  31   6.473  -4.420   4.615
  271    HA   VAL  31           HA       VAL  31   8.470  -5.633   6.327
  272    HB   VAL  31           HB       VAL  31   7.052  -3.201   7.232
  273   1HG1  VAL  31          HG11      VAL  31   9.151  -2.604   8.108
  274   2HG1  VAL  31          HG12      VAL  31  10.002  -3.717   7.036
  275   3HG1  VAL  31          HG13      VAL  31   9.015  -4.344   8.357
  276   1HG2  VAL  31          HG21      VAL  31   8.743  -1.892   5.728
  277   2HG2  VAL  31          HG22      VAL  31   7.189  -2.400   5.070
  278   3HG2  VAL  31          HG23      VAL  31   8.644  -3.328   4.710
  279    H    ASP  32           HN       ASP  32   7.648  -7.277   7.372
  280    HA   ASP  32           HA       ASP  32   5.029  -7.579   8.299
  281   1HB   ASP  32          HB2       ASP  32   7.593  -8.985   8.679
  282   2HB   ASP  32          HB1       ASP  32   6.427  -9.205   9.980
  283    H    LYS  33           HN       LYS  33   7.548  -5.644   9.541
  284    HA   LYS  33           HA       LYS  33   7.021  -5.712  12.291
  285   1HB   LYS  33          HB2       LYS  33   8.095  -3.571  10.465
  286   2HB   LYS  33          HB1       LYS  33   7.873  -3.279  12.185
  287   1HG   LYS  33          HG2       LYS  33   9.491  -4.861  12.780
  288   2HG   LYS  33          HG1       LYS  33   9.478  -5.603  11.178
  289   1HD   LYS  33          HD2       LYS  33  11.482  -4.282  11.430
  290   2HD   LYS  33          HD1       LYS  33  10.422  -3.512  10.248
  291   1HE   LYS  33          HE2       LYS  33   9.594  -2.320  12.535
  292   2HE   LYS  33          HE1       LYS  33  11.299  -2.585  12.899
  293   1HZ   LYS  33          HZ1       LYS  33  11.674  -1.555  10.591
  294   2HZ   LYS  33          HZ2       LYS  33  11.284  -0.528  11.877
  295   3HZ   LYS  33          HZ3       LYS  33  10.098  -0.961  10.752
  296    H    ASN  34           HN       ASN  34   5.746  -3.545   9.770
  297    HA   ASN  34           HA       ASN  34   3.114  -3.537  10.481
  298   1HB   ASN  34          HB2       ASN  34   4.662  -2.141  12.464
  299   2HB   ASN  34          HB1       ASN  34   3.561  -1.015  11.676
  300   1HD2  ASN  34          HD21      ASN  34   1.862  -0.760  12.923
  301   2HD2  ASN  34          HD22      ASN  34   0.974  -2.018  13.706
  302    H    TRP  35           HN       TRP  35   5.027  -2.971   8.248
  303    HA   TRP  35           HA       TRP  35   3.468  -0.901   7.010
  304   1HB   TRP  35          HB2       TRP  35   5.916  -0.207   8.292
  305   2HB   TRP  35          HB1       TRP  35   6.151  -0.066   6.554
  306    HD1  TRP  35           HD1      TRP  35   3.715   1.267   5.436
  307    HE1  TRP  35           HE1      TRP  35   2.866   3.568   6.214
  308    HE3  TRP  35           HE3      TRP  35   5.957   1.450  10.027
  309    HZ2  TRP  35           HZ2      TRP  35   3.113   5.240   8.473
  310    HZ3  TRP  35           HZ3      TRP  35   5.600   3.437  11.435
  311    HH2  TRP  35           HH2      TRP  35   4.207   5.292  10.672
  312    H    LEU  36           HN       LEU  36   4.417  -0.411   4.742
  313    HA   LEU  36           HA       LEU  36   6.004  -2.464   3.520
  314   1HB   LEU  36          HB2       LEU  36   4.388  -3.510   2.197
  315   2HB   LEU  36          HB1       LEU  36   3.643  -3.425   3.783
  316    HG   LEU  36           HG       LEU  36   2.785  -1.095   2.627
  317   1HD1  LEU  36          HD11      LEU  36   1.917  -1.760   0.410
  318   2HD1  LEU  36          HD12      LEU  36   2.914  -3.212   0.499
  319   3HD1  LEU  36          HD13      LEU  36   3.673  -1.621   0.480
  320   1HD2  LEU  36          HD21      LEU  36   1.690  -3.568   3.514
  321   2HD2  LEU  36          HD22      LEU  36   0.879  -3.108   2.017
  322   3HD2  LEU  36          HD23      LEU  36   0.901  -1.996   3.385
  323    H    GLU  37           HN       GLU  37   6.227  -2.033   1.125
  324    HA   GLU  37           HA       GLU  37   6.087   0.863   0.675
  325   1HB   GLU  37          HB2       GLU  37   7.869  -1.306  -0.316
  326   2HB   GLU  37          HB1       GLU  37   7.600   0.080  -1.362
  327   1HG   GLU  37          HG2       GLU  37   8.203   0.880   1.352
  328   2HG   GLU  37          HG1       GLU  37   9.471  -0.131   0.660
  329    H    GLY  38           HN       GLY  38   4.901   1.756  -0.908
  330   1HA   GLY  38          HA2       GLY  38   3.697  -0.020  -2.923
  331   2HA   GLY  38          HA1       GLY  38   2.665   1.038  -1.972
  332    H    GLU  39           HN       GLU  39   3.980   0.747  -4.902
  333    HA   GLU  39           HA       GLU  39   4.194   3.664  -5.254
  334   1HB   GLU  39          HB2       GLU  39   6.211   1.782  -5.686
  335   2HB   GLU  39          HB1       GLU  39   5.601   2.152  -7.293
  336   1HG   GLU  39          HG2       GLU  39   6.132   4.428  -7.088
  337   2HG   GLU  39          HG1       GLU  39   6.359   4.300  -5.345
  338    H    HIS  40           HN       HIS  40   3.255   4.545  -7.095
  339    HA   HIS  40           HA       HIS  40   1.947   2.787  -9.004
  340   1HB   HIS  40          HB2       HIS  40   0.308   3.045  -7.162
  341   2HB   HIS  40          HB1       HIS  40   0.359   4.791  -7.388
  342    HD1  HIS  40           HD1      HIS  40   0.111   2.163 -10.110
  343    HD2  HIS  40           HD2      HIS  40  -2.122   5.236  -8.428
  344    HE1  HIS  40           HE1      HIS  40  -1.928   2.385 -11.564
  345    HE2  HIS  40           HE2      HIS  40  -3.219   4.312 -10.580
  346    H    HIS  41           HN       HIS  41   2.215   3.593 -10.969
  347    HA   HIS  41           HA       HIS  41   2.699   5.019 -12.673
  348   1HB   HIS  41          HB2       HIS  41   0.430   5.932 -11.535
  349   2HB   HIS  41          HB1       HIS  41   1.456   7.347 -11.325
  350    HD1  HIS  41           HD1      HIS  41  -0.762   7.919 -13.103
  351    HD2  HIS  41           HD2      HIS  41   2.666   6.054 -14.532
  352    HE1  HIS  41           HE1      HIS  41  -0.756   8.333 -15.584
  353    HE2  HIS  41           HE2      HIS  41   1.284   7.125 -16.438
  354    H    GLY  42           HN       GLY  42   4.697   4.765 -10.684
  355   1HA   GLY  42          HA2       GLY  42   6.796   5.706 -10.410
  356   2HA   GLY  42          HA1       GLY  42   6.241   7.119 -11.292
  357    H    ARG  43           HN       ARG  43   3.977   6.625  -8.960
  358    HA   ARG  43           HA       ARG  43   5.167   8.682  -7.270
  359   1HB   ARG  43          HB2       ARG  43   2.699   8.559  -8.241
  360   2HB   ARG  43          HB1       ARG  43   2.426   7.612  -6.784
  361   1HG   ARG  43          HG2       ARG  43   3.815  10.228  -6.534
  362   2HG   ARG  43          HG1       ARG  43   2.073  10.214  -6.815
  363   1HD   ARG  43          HD2       ARG  43   2.001   8.518  -4.873
  364   2HD   ARG  43          HD1       ARG  43   3.622   9.103  -4.500
  365    HE   ARG  43           HE       ARG  43   1.144  10.475  -4.056
  366   1HH1  ARG  43          HH11      ARG  43   4.563  10.892  -4.614
  367   2HH1  ARG  43          HH12      ARG  43   4.625  12.446  -3.853
  368   1HH2  ARG  43          HH21      ARG  43   1.222  12.519  -3.056
  369   2HH2  ARG  43          HH22      ARG  43   2.729  13.370  -2.968
  370    H    LEU  44           HN       LEU  44   5.425   8.475  -5.040
  371    HA   LEU  44           HA       LEU  44   5.700   5.707  -4.133
  372   1HB   LEU  44          HB2       LEU  44   7.626   7.302  -3.996
  373   2HB   LEU  44          HB1       LEU  44   6.713   8.222  -2.815
  374    HG   LEU  44           HG       LEU  44   6.616   5.969  -1.508
  375   1HD1  LEU  44          HD11      LEU  44   7.848   4.976  -3.680
  376   2HD1  LEU  44          HD12      LEU  44   8.019   4.295  -2.062
  377   3HD1  LEU  44          HD13      LEU  44   9.250   5.388  -2.694
  378   1HD2  LEU  44          HD21      LEU  44   9.368   7.023  -1.466
  379   2HD2  LEU  44          HD22      LEU  44   8.201   6.833  -0.157
  380   3HD2  LEU  44          HD23      LEU  44   8.081   8.210  -1.253
  381    H    GLY  45           HN       GLY  45   4.448   4.834  -2.615
  382   1HA   GLY  45          HA2       GLY  45   2.974   6.543  -0.762
  383   2HA   GLY  45          HA1       GLY  45   2.016   5.549  -1.847
  384    H    ILE  46           HN       ILE  46   3.550   5.686   1.124
  385    HA   ILE  46           HA       ILE  46   3.627   2.757   1.375
  386    HB   ILE  46           HB       ILE  46   4.950   4.931   2.994
  387   1HG1  ILE  46          HG12      ILE  46   6.171   2.601   1.516
  388   2HG1  ILE  46          HG11      ILE  46   5.926   4.182   0.782
  389   1HG2  ILE  46          HG21      ILE  46   4.680   3.542   4.745
  390   2HG2  ILE  46          HG22      ILE  46   6.009   2.657   3.995
  391   3HG2  ILE  46          HG23      ILE  46   4.345   2.146   3.723
  392   1HD1  ILE  46          HD11      ILE  46   7.238   4.791   3.104
  393   2HD1  ILE  46          HD12      ILE  46   7.972   4.638   1.508
  394   3HD1  ILE  46          HD13      ILE  46   7.979   3.267   2.618
  395    H    PHE  47           HN       PHE  47   2.595   1.722   3.091
  396    HA   PHE  47           HA       PHE  47   1.038   3.189   5.008
  397   1HB   PHE  47          HB2       PHE  47  -1.122   2.016   4.231
  398   2HB   PHE  47          HB1       PHE  47  -0.589   3.435   3.337
  399    HD1  PHE  47           HD2      PHE  47  -0.074  -0.262   3.281
  400    HD2  PHE  47           HD1      PHE  47  -0.678   3.313   1.054
  401    HE1  PHE  47           HE2      PHE  47  -0.101  -1.570   1.198
  402    HE2  PHE  47           HE1      PHE  47  -0.707   2.012  -1.034
  403    HZ   PHE  47           HZ       PHE  47  -0.419  -0.433  -0.964
  404    HA   PRO  48           HA       PRO  48   1.565  -0.434   7.442
  405   1HB   PRO  48          HB2       PRO  48  -1.284  -0.261   8.242
  406   2HB   PRO  48          HB1       PRO  48   0.170  -0.224   9.243
  407   1HG   PRO  48          HG2       PRO  48  -1.253   1.992   8.804
  408   2HG   PRO  48          HG1       PRO  48   0.518   2.038   8.889
  409   1HD   PRO  48          HD2       PRO  48  -1.269   2.118   6.490
  410   2HD   PRO  48          HD1       PRO  48   0.230   3.015   6.811
  411    H    ALA  49           HN       ALA  49   1.401  -2.600   7.192
  412    HA   ALA  49           HA       ALA  49   0.031  -3.654   4.951
  413   1HB   ALA  49          HB1       ALA  49   1.855  -4.933   5.358
  414   2HB   ALA  49          HB2       ALA  49   0.685  -5.879   6.279
  415   3HB   ALA  49          HB3       ALA  49   1.742  -4.735   7.107
  416    H    ASN  50           HN       ASN  50  -0.867  -3.220   8.260
  417    HA   ASN  50           HA       ASN  50  -2.911  -5.213   8.332
  418   1HB   ASN  50          HB2       ASN  50  -1.664  -3.543  10.194
  419   2HB   ASN  50          HB1       ASN  50  -3.345  -3.017  10.178
  420   1HD2  ASN  50          HD21      ASN  50  -4.939  -4.395  10.892
  421   2HD2  ASN  50          HD22      ASN  50  -4.596  -5.856  11.749
  422    H    TYR  51           HN       TYR  51  -2.715  -2.258   6.744
  423    HA   TYR  51           HA       TYR  51  -5.577  -1.712   6.927
  424   1HB   TYR  51          HB2       TYR  51  -3.215  -0.137   6.386
  425   2HB   TYR  51          HB1       TYR  51  -4.410   0.086   5.112
  426    HD1  TYR  51           HD2      TYR  51  -4.451  -0.212   8.845
  427    HD2  TYR  51           HD1      TYR  51  -5.775   1.913   5.405
  428    HE1  TYR  51           HE2      TYR  51  -5.690   1.345  10.290
  429    HE2  TYR  51           HE1      TYR  51  -7.017   3.475   6.840
  430    HH   TYR  51           HH       TYR  51  -7.969   3.584   9.054
  431    H    VAL  52           HN       VAL  52  -3.192  -2.964   4.709
  432    HA   VAL  52           HA       VAL  52  -5.342  -3.415   2.743
  433    HB   VAL  52           HB       VAL  52  -3.767  -1.744   1.890
  434   1HG1  VAL  52          HG11      VAL  52  -1.803  -3.676   2.877
  435   2HG1  VAL  52          HG12      VAL  52  -1.661  -1.936   2.628
  436   3HG1  VAL  52          HG13      VAL  52  -1.449  -3.041   1.270
  437   1HG2  VAL  52          HG21      VAL  52  -3.302  -4.322   0.412
  438   2HG2  VAL  52          HG22      VAL  52  -3.435  -2.691  -0.246
  439   3HG2  VAL  52          HG23      VAL  52  -4.859  -3.494   0.416
  440    H    GLU  53           HN       GLU  53  -5.108  -5.328   1.420
  441    HA   GLU  53           HA       GLU  53  -3.636  -7.460   2.821
  442   1HB   GLU  53          HB2       GLU  53  -6.311  -7.342   2.343
  443   2HB   GLU  53          HB1       GLU  53  -5.765  -8.227   0.926
  444   1HG   GLU  53          HG2       GLU  53  -6.355  -9.824   2.564
  445   2HG   GLU  53          HG1       GLU  53  -4.594  -9.807   2.471
  446    H    VAL  54           HN       VAL  54  -1.935  -8.266   1.802
  447    HA   VAL  54           HA       VAL  54  -1.370  -7.585  -0.927
  448    HB   VAL  54           HB       VAL  54   0.133  -9.540   0.811
  449   1HG1  VAL  54          HG11      VAL  54   0.807  -8.008  -1.684
  450   2HG1  VAL  54          HG12      VAL  54   0.868  -9.750  -1.413
  451   3HG1  VAL  54          HG13      VAL  54   2.047  -8.695  -0.635
  452   1HG2  VAL  54          HG21      VAL  54   1.597  -7.288   0.959
  453   2HG2  VAL  54          HG22      VAL  54   0.392  -7.747   2.162
  454   3HG2  VAL  54          HG23      VAL  54  -0.024  -6.595   0.892
  455    H    LEU  55           HN       LEU  55  -2.143  -8.630  -2.624
  456    HA   LEU  55           HA       LEU  55  -1.973 -11.445  -2.910
  457   1HB   LEU  55          HB2       LEU  55  -4.453 -11.815  -3.206
  458   2HB   LEU  55          HB1       LEU  55  -3.892 -11.627  -1.556
  459    HG   LEU  55           HG       LEU  55  -4.570  -9.046  -2.272
  460   1HD1  LEU  55          HD11      LEU  55  -7.080  -9.761  -2.975
  461   2HD1  LEU  55          HD12      LEU  55  -6.137 -10.964  -3.854
  462   3HD1  LEU  55          HD13      LEU  55  -5.838  -9.246  -4.117
  463   1HD2  LEU  55          HD21      LEU  55  -6.208 -11.146  -0.857
  464   2HD2  LEU  55          HD22      LEU  55  -6.513  -9.410  -0.796
  465   3HD2  LEU  55          HD23      LEU  55  -5.018 -10.067  -0.128
  466    HA   PRO  56           HA       PRO  56  -1.708  -8.952  -6.809
  467   1HB   PRO  56          HB2       PRO  56  -0.385 -11.533  -7.507
  468   2HB   PRO  56          HB1       PRO  56   0.111  -9.878  -7.879
  469   1HG   PRO  56          HG2       PRO  56   1.335 -11.257  -5.961
  470   2HG   PRO  56          HG1       PRO  56   0.998  -9.527  -5.764
  471   1HD   PRO  56          HD2       PRO  56  -0.372 -11.878  -4.544
  472   2HD   PRO  56          HD1       PRO  56  -0.066 -10.269  -3.861
  473    H    LEU  57           HN       LEU  57  -3.668  -8.947  -7.747
  474    HA   LEU  57           HA       LEU  57  -5.015 -11.458  -8.351
  475   1HB   LEU  57          HB2       LEU  57  -6.068  -8.729  -9.017
  476   2HB   LEU  57          HB1       LEU  57  -6.964 -10.203  -8.701
  477    HG   LEU  57           HG       LEU  57  -5.824  -9.914  -6.301
  478   1HD1  LEU  57          HD11      LEU  57  -5.593  -7.289  -7.626
  479   2HD1  LEU  57          HD12      LEU  57  -4.655  -7.984  -6.304
  480   3HD1  LEU  57          HD13      LEU  57  -6.241  -7.281  -5.986
  481   1HD2  LEU  57          HD21      LEU  57  -8.348  -8.861  -7.472
  482   2HD2  LEU  57          HD22      LEU  57  -7.942  -8.425  -5.811
  483   3HD2  LEU  57          HD23      LEU  57  -8.100 -10.122  -6.264
  484    H    GLU  58           HN       GLU  58  -4.230  -8.472 -10.145
  485    HA   GLU  58           HA       GLU  58  -4.642  -9.731 -12.682
  486   1HB   GLU  58          HB2       GLU  58  -3.452  -7.070 -11.896
  487   2HB   GLU  58          HB1       GLU  58  -3.634  -7.586 -13.567
  488   1HG   GLU  58          HG2       GLU  58  -6.141  -7.992 -12.528
  489   2HG   GLU  58          HG1       GLU  58  -5.604  -6.527 -11.709
  Start of MODEL   12
    1   1H    MET   0          HT1       MET   0   7.418 -10.739  -7.297
    2   2H    MET   0          HT2       MET   0   7.560 -10.099  -8.884
    3   3H    MET   0          HT3       MET   0   6.215 -11.081  -8.469
    4    HA   MET   0           HA       MET   0   6.815  -8.529  -7.149
    5   1HB   MET   0          HB2       MET   0   5.125  -9.128  -9.583
    6   2HB   MET   0          HB1       MET   0   5.013  -7.633  -8.664
    7   1HG   MET   0          HG2       MET   0   6.507  -6.861 -10.125
    8   2HG   MET   0          HG1       MET   0   7.680  -7.757  -9.162
    9   1HE   MET   0          HE1       MET   0   9.035 -10.367 -11.021
   10   2HE   MET   0          HE2       MET   0   9.112  -9.086  -9.810
   11   3HE   MET   0          HE3       MET   0   9.579  -8.752 -11.477
   12    H    LYS   1           HN       LYS   1   4.792  -7.647  -6.206
   13    HA   LYS   1           HA       LYS   1   2.678  -9.565  -5.676
   14   1HB   LYS   1          HB2       LYS   1   4.780  -9.489  -3.917
   15   2HB   LYS   1          HB1       LYS   1   3.660  -8.346  -3.190
   16   1HG   LYS   1          HG2       LYS   1   2.266  -9.956  -2.527
   17   2HG   LYS   1          HG1       LYS   1   2.386 -10.820  -4.061
   18   1HD   LYS   1          HD2       LYS   1   4.806 -10.916  -2.398
   19   2HD   LYS   1          HD1       LYS   1   3.396 -11.711  -1.696
   20   1HE   LYS   1          HE2       LYS   1   3.417 -12.503  -4.371
   21   2HE   LYS   1          HE1       LYS   1   5.105 -12.562  -3.865
   22   1HZ   LYS   1          HZ1       LYS   1   4.074 -14.663  -3.430
   23   2HZ   LYS   1          HZ2       LYS   1   2.817 -13.935  -2.564
   24   3HZ   LYS   1          HZ3       LYS   1   4.392 -13.912  -1.947
   25    H    ALA   2           HN       ALA   2   0.895  -8.445  -6.065
   26    HA   ALA   2           HA       ALA   2   0.826  -5.587  -5.383
   27   1HB   ALA   2          HB1       ALA   2  -0.003  -5.343  -7.428
   28   2HB   ALA   2          HB2       ALA   2  -1.440  -6.221  -6.907
   29   3HB   ALA   2          HB3       ALA   2  -0.097  -7.090  -7.648
   30    H    ALA   3           HN       ALA   3  -1.030  -4.702  -4.359
   31    HA   ALA   3           HA       ALA   3  -2.827  -6.625  -3.063
   32   1HB   ALA   3          HB1       ALA   3  -0.939  -6.063  -1.527
   33   2HB   ALA   3          HB2       ALA   3  -2.536  -5.649  -0.902
   34   3HB   ALA   3          HB3       ALA   3  -1.489  -4.388  -1.554
   35    H    ARG   4           HN       ARG   4  -4.852  -5.789  -2.450
   36    HA   ARG   4           HA       ARG   4  -5.525  -3.236  -3.752
   37   1HB   ARG   4          HB2       ARG   4  -6.636  -5.280  -4.646
   38   2HB   ARG   4          HB1       ARG   4  -7.372  -5.530  -3.069
   39   1HG   ARG   4          HG2       ARG   4  -8.663  -3.545  -3.264
   40   2HG   ARG   4          HG1       ARG   4  -7.775  -3.038  -4.703
   41   1HD   ARG   4          HD2       ARG   4  -9.983  -3.961  -5.256
   42   2HD   ARG   4          HD1       ARG   4  -8.672  -4.914  -5.950
   43    HE   ARG   4           HE       ARG   4  -9.191  -6.164  -3.601
   44   1HH1  ARG   4          HH11      ARG   4 -11.176  -5.211  -6.309
   45   2HH1  ARG   4          HH12      ARG   4 -12.300  -6.512  -6.103
   46   1HH2  ARG   4          HH21      ARG   4 -10.668  -7.876  -3.329
   47   2HH2  ARG   4          HH22      ARG   4 -12.012  -8.026  -4.412
   48    H    LEU   5           HN       LEU   5  -5.946  -1.588  -2.452
   49    HA   LEU   5           HA       LEU   5  -6.159  -1.873   0.363
   50   1HB   LEU   5          HB2       LEU   5  -5.597   0.190  -1.380
   51   2HB   LEU   5          HB1       LEU   5  -7.157   0.649  -0.725
   52    HG   LEU   5           HG       LEU   5  -5.926   0.051   1.571
   53   1HD1  LEU   5          HD11      LEU   5  -3.850  -0.492   0.113
   54   2HD1  LEU   5          HD12      LEU   5  -3.648   0.429   1.603
   55   3HD1  LEU   5          HD13      LEU   5  -3.657   1.259   0.047
   56   1HD2  LEU   5          HD21      LEU   5  -6.784   2.141   1.598
   57   2HD2  LEU   5          HD22      LEU   5  -6.209   2.518  -0.026
   58   3HD2  LEU   5          HD23      LEU   5  -5.099   2.595   1.343
   59    H    LYS   6           HN       LYS   6  -7.912  -1.566   1.731
   60    HA   LYS   6           HA       LYS   6 -10.566  -1.291   0.551
   61   1HB   LYS   6          HB2       LYS   6  -9.701  -3.645   2.235
   62   2HB   LYS   6          HB1       LYS   6 -11.382  -3.240   1.918
   63   1HG   LYS   6          HG2       LYS   6  -9.374  -3.804  -0.249
   64   2HG   LYS   6          HG1       LYS   6 -10.421  -5.032   0.464
   65   1HD   LYS   6          HD2       LYS   6 -12.261  -3.177  -0.139
   66   2HD   LYS   6          HD1       LYS   6 -11.070  -2.821  -1.391
   67   1HE   LYS   6          HE2       LYS   6 -11.323  -4.867  -2.405
   68   2HE   LYS   6          HE1       LYS   6 -11.857  -5.655  -0.921
   69   1HZ   LYS   6          HZ1       LYS   6 -13.401  -4.210  -2.912
   70   2HZ   LYS   6          HZ2       LYS   6 -13.845  -3.935  -1.303
   71   3HZ   LYS   6          HZ3       LYS   6 -13.850  -5.508  -1.923
   72    H    PHE   7           HN       PHE   7  -8.756   0.282   2.324
   73    HA   PHE   7           HA       PHE   7 -10.750   0.965   4.304
   74   1HB   PHE   7          HB2       PHE   7  -7.961   0.313   5.258
   75   2HB   PHE   7          HB1       PHE   7  -9.373   0.697   6.237
   76    HD1  PHE   7           HD2      PHE   7  -7.772  -1.868   4.150
   77    HD2  PHE   7           HD1      PHE   7 -10.995  -0.964   6.778
   78    HE1  PHE   7           HE2      PHE   7  -8.286  -4.266   4.337
   79    HE2  PHE   7           HE1      PHE   7 -11.515  -3.362   6.971
   80    HZ   PHE   7           HZ       PHE   7 -10.160  -5.016   5.749
   81    H    ASP   8           HN       ASP   8 -10.908   3.098   4.245
   82    HA   ASP   8           HA       ASP   8  -9.136   4.785   2.895
   83   1HB   ASP   8          HB2       ASP   8 -10.411   6.634   3.892
   84   2HB   ASP   8          HB1       ASP   8 -11.482   5.368   3.299
   85    H    PHE   9           HN       PHE   9  -7.136   5.323   3.438
   86    HA   PHE   9           HA       PHE   9  -6.492   5.649   6.296
   87   1HB   PHE   9          HB2       PHE   9  -5.383   3.730   4.969
   88   2HB   PHE   9          HB1       PHE   9  -4.447   4.999   4.186
   89    HD1  PHE   9           HD1      PHE   9  -5.464   4.071   7.658
   90    HD2  PHE   9           HD2      PHE   9  -2.362   5.364   5.047
   91    HE1  PHE   9           HE1      PHE   9  -3.878   4.054   9.540
   92    HE2  PHE   9           HE2      PHE   9  -0.770   5.349   6.924
   93    HZ   PHE   9           HZ       PHE   9  -1.528   4.693   9.174
   94    H    GLN  10           HN       GLN  10  -5.428   7.467   6.943
   95    HA   GLN  10           HA       GLN  10  -5.022   9.531   4.882
   96   1HB   GLN  10          HB2       GLN  10  -6.728   9.752   6.895
   97   2HB   GLN  10          HB1       GLN  10  -5.280  10.224   7.773
   98   1HG   GLN  10          HG2       GLN  10  -5.576  12.279   7.018
   99   2HG   GLN  10          HG1       GLN  10  -5.195  11.684   5.403
  100   1HE2  GLN  10          HE21      GLN  10  -7.914  11.851   7.675
  101   2HE2  GLN  10          HE22      GLN  10  -9.112  12.209   6.483
  102    H    ALA  11           HN       ALA  11  -3.004  10.144   4.496
  103    HA   ALA  11           HA       ALA  11  -0.862   9.232   6.223
  104   1HB   ALA  11          HB1       ALA  11  -0.805  10.709   3.595
  105   2HB   ALA  11          HB2       ALA  11  -0.576   8.977   3.839
  106   3HB   ALA  11          HB3       ALA  11   0.617  10.121   4.455
  107    H    GLN  12           HN       GLN  12   0.376  10.469   7.532
  108    HA   GLN  12           HA       GLN  12  -0.398  13.283   7.813
  109   1HB   GLN  12          HB2       GLN  12   0.985  12.917  10.028
  110   2HB   GLN  12          HB1       GLN  12  -0.691  12.406   9.913
  111   1HG   GLN  12          HG2       GLN  12   0.019  10.126   9.468
  112   2HG   GLN  12          HG1       GLN  12   1.708  10.630   9.521
  113   1HE2  GLN  12          HE21      GLN  12   2.582   9.855  11.299
  114   2HE2  GLN  12          HE22      GLN  12   1.888   9.905  12.880
  115    H    SER  13           HN       SER  13   2.358  11.145   7.385
  116    HA   SER  13           HA       SER  13   4.216  13.383   7.381
  117   1HB   SER  13          HB2       SER  13   4.597  10.399   7.109
  118   2HB   SER  13          HB1       SER  13   5.920  11.553   6.942
  119    HG   SER  13           HG       SER  13   5.946  11.019   9.050
  120    HA   PRO  14           HA       PRO  14   4.130  14.175   3.036
  121   1HB   PRO  14          HB2       PRO  14   7.090  14.380   3.245
  122   2HB   PRO  14          HB1       PRO  14   5.922  15.548   2.616
  123   1HG   PRO  14          HG2       PRO  14   7.071  15.914   4.991
  124   2HG   PRO  14          HG1       PRO  14   5.367  16.328   4.727
  125   1HD   PRO  14          HD2       PRO  14   6.552  13.972   6.131
  126   2HD   PRO  14          HD1       PRO  14   5.095  14.908   6.525
  127    H    LYS  15           HN       LYS  15   6.371  11.830   4.372
  128    HA   LYS  15           HA       LYS  15   7.080  10.645   1.873
  129   1HB   LYS  15          HB2       LYS  15   8.403  10.533   4.043
  130   2HB   LYS  15          HB1       LYS  15   7.241   9.328   4.581
  131   1HG   LYS  15          HG2       LYS  15   8.245   7.720   3.427
  132   2HG   LYS  15          HG1       LYS  15   8.281   8.697   1.959
  133   1HD   LYS  15          HD2       LYS  15  10.375   9.523   2.396
  134   2HD   LYS  15          HD1       LYS  15  10.195   9.351   4.143
  135   1HE   LYS  15          HE2       LYS  15  11.650   7.641   3.748
  136   2HE   LYS  15          HE1       LYS  15  10.127   6.783   3.520
  137   1HZ   LYS  15          HZ1       LYS  15  11.345   6.188   1.670
  138   2HZ   LYS  15          HZ2       LYS  15  12.046   7.716   1.488
  139   3HZ   LYS  15          HZ3       LYS  15  10.424   7.476   1.074
  140    H    GLU  16           HN       GLU  16   4.501  10.202   4.170
  141    HA   GLU  16           HA       GLU  16   3.663   7.662   3.093
  142   1HB   GLU  16          HB2       GLU  16   2.682   9.519   5.213
  143   2HB   GLU  16          HB1       GLU  16   1.549   8.355   4.538
  144   1HG   GLU  16          HG2       GLU  16   3.423   6.632   5.040
  145   2HG   GLU  16          HG1       GLU  16   4.025   7.879   6.131
  146    H    LEU  17           HN       LEU  17   1.491   7.338   2.187
  147    HA   LEU  17           HA       LEU  17   0.601   9.652   0.594
  148   1HB   LEU  17          HB2       LEU  17   1.803   8.012  -0.786
  149   2HB   LEU  17          HB1       LEU  17   0.692   6.760  -0.266
  150    HG   LEU  17           HG       LEU  17  -0.567   9.123  -1.508
  151   1HD1  LEU  17          HD11      LEU  17   0.011   8.546  -3.754
  152   2HD1  LEU  17          HD12      LEU  17   0.964   7.165  -3.210
  153   3HD1  LEU  17          HD13      LEU  17   1.506   8.806  -2.854
  154   1HD2  LEU  17          HD21      LEU  17  -1.551   6.981  -2.770
  155   2HD2  LEU  17          HD22      LEU  17  -2.132   7.518  -1.194
  156   3HD2  LEU  17          HD23      LEU  17  -0.963   6.201  -1.302
  157    H    THR  18           HN       THR  18  -1.534  10.083   0.567
  158    HA   THR  18           HA       THR  18  -3.247   8.405   2.242
  159    HB   THR  18           HB       THR  18  -3.711  11.184   1.142
  160    HG1  THR  18           HG1      THR  18  -2.858  11.899   2.932
  161   1HG2  THR  18          HG21      THR  18  -5.264  10.846   3.399
  162   2HG2  THR  18          HG22      THR  18  -5.485   9.349   2.493
  163   3HG2  THR  18          HG23      THR  18  -5.827  10.901   1.729
  164    H    LEU  19           HN       LEU  19  -4.655   7.048   1.367
  165    HA   LEU  19           HA       LEU  19  -5.943   7.704  -1.162
  166   1HB   LEU  19          HB2       LEU  19  -5.415   5.611  -2.209
  167   2HB   LEU  19          HB1       LEU  19  -3.921   6.406  -1.750
  168    HG   LEU  19           HG       LEU  19  -5.166   4.286  -0.019
  169   1HD1  LEU  19          HD11      LEU  19  -3.173   2.963  -1.231
  170   2HD1  LEU  19          HD12      LEU  19  -3.700   3.992  -2.563
  171   3HD1  LEU  19          HD13      LEU  19  -4.849   2.908  -1.778
  172   1HD2  LEU  19          HD21      LEU  19  -3.533   5.172   1.272
  173   2HD2  LEU  19          HD22      LEU  19  -2.632   5.804  -0.107
  174   3HD2  LEU  19          HD23      LEU  19  -2.514   4.096   0.316
  175    H    GLN  20           HN       GLN  20  -7.986   6.885  -1.356
  176    HA   GLN  20           HA       GLN  20  -9.182   5.839   1.044
  177   1HB   GLN  20          HB2       GLN  20 -10.214   7.530  -0.592
  178   2HB   GLN  20          HB1       GLN  20 -10.563   6.141  -1.613
  179   1HG   GLN  20          HG2       GLN  20 -12.284   5.497  -0.352
  180   2HG   GLN  20          HG1       GLN  20 -11.415   5.794   1.154
  181   1HE2  GLN  20          HE21      GLN  20 -11.309   8.002   1.915
  182   2HE2  GLN  20          HE22      GLN  20 -12.606   9.087   1.558
  183    H    LYS  21           HN       LYS  21 -10.666   3.950   0.966
  184    HA   LYS  21           HA       LYS  21  -9.319   1.624   0.236
  185   1HB   LYS  21          HB2       LYS  21 -11.455   0.482   0.743
  186   2HB   LYS  21          HB1       LYS  21 -10.982   1.624   1.988
  187   1HG   LYS  21          HG2       LYS  21 -12.524   3.274   0.755
  188   2HG   LYS  21          HG1       LYS  21 -13.185   1.835  -0.024
  189   1HD   LYS  21          HD2       LYS  21 -14.345   1.278   1.799
  190   2HD   LYS  21          HD1       LYS  21 -12.938   1.487   2.843
  191   1HE   LYS  21          HE2       LYS  21 -13.348   3.943   2.789
  192   2HE   LYS  21          HE1       LYS  21 -14.834   3.631   1.893
  193   1HZ   LYS  21          HZ1       LYS  21 -15.191   3.915   4.296
  194   2HZ   LYS  21          HZ2       LYS  21 -14.239   2.549   4.593
  195   3HZ   LYS  21          HZ3       LYS  21 -15.694   2.396   3.745
  196    H    GLY  22           HN       GLY  22  -9.697   0.079  -1.387
  197   1HA   GLY  22          HA2       GLY  22 -10.767  -0.715  -3.359
  198   2HA   GLY  22          HA1       GLY  22 -11.405   0.905  -3.628
  199    H    ASP  23           HN       ASP  23  -8.412   1.662  -2.859
  200    HA   ASP  23           HA       ASP  23  -7.581   1.855  -5.622
  201   1HB   ASP  23          HB2       ASP  23  -6.886   3.157  -3.085
  202   2HB   ASP  23          HB1       ASP  23  -5.504   2.875  -4.140
  203    H    ILE  24           HN       ILE  24  -5.943   0.777  -6.592
  204    HA   ILE  24           HA       ILE  24  -4.572  -1.280  -4.986
  205    HB   ILE  24           HB       ILE  24  -6.096  -2.226  -6.668
  206   1HG1  ILE  24          HG12      ILE  24  -3.568  -2.952  -7.940
  207   2HG1  ILE  24          HG11      ILE  24  -3.461  -2.934  -6.183
  208   1HG2  ILE  24          HG21      ILE  24  -5.359  -0.145  -8.251
  209   2HG2  ILE  24          HG22      ILE  24  -6.190  -1.593  -8.818
  210   3HG2  ILE  24          HG23      ILE  24  -4.437  -1.469  -8.963
  211   1HD1  ILE  24          HD11      ILE  24  -5.012  -4.704  -7.976
  212   2HD1  ILE  24          HD12      ILE  24  -5.710  -4.308  -6.405
  213   3HD1  ILE  24          HD13      ILE  24  -4.125  -5.076  -6.498
  214    H    VAL  25           HN       VAL  25  -2.421  -1.207  -4.876
  215    HA   VAL  25           HA       VAL  25  -0.940   0.289  -6.926
  216    HB   VAL  25           HB       VAL  25   0.519   1.254  -5.187
  217   1HG1  VAL  25          HG11      VAL  25  -2.348   1.898  -5.458
  218   2HG1  VAL  25          HG12      VAL  25  -0.925   2.895  -5.761
  219   3HG1  VAL  25          HG13      VAL  25  -1.501   2.658  -4.111
  220   1HG2  VAL  25          HG21      VAL  25  -0.463  -0.638  -3.529
  221   2HG2  VAL  25          HG22      VAL  25  -1.421   0.756  -3.028
  222   3HG2  VAL  25          HG23      VAL  25   0.340   0.833  -2.978
  223    H    TYR  26           HN       TYR  26   1.331  -0.259  -7.058
  224    HA   TYR  26           HA       TYR  26   1.762  -3.081  -6.566
  225   1HB   TYR  26          HB2       TYR  26   2.690  -1.161  -8.461
  226   2HB   TYR  26          HB1       TYR  26   4.091  -1.850  -7.650
  227    HD1  TYR  26           HD1      TYR  26   0.864  -3.009  -9.149
  228    HD2  TYR  26           HD2      TYR  26   5.020  -3.734  -8.599
  229    HE1  TYR  26           HE1      TYR  26   0.700  -5.002 -10.580
  230    HE2  TYR  26           HE2      TYR  26   4.867  -5.728 -10.029
  231    HH   TYR  26           HH       TYR  26   3.074  -7.353 -10.738
  232    H    ILE  27           HN       ILE  27   2.792  -3.873  -4.868
  233    HA   ILE  27           HA       ILE  27   4.045  -2.098  -2.972
  234    HB   ILE  27           HB       ILE  27   3.712  -5.101  -2.914
  235   1HG1  ILE  27          HG12      ILE  27   2.006  -4.478  -1.125
  236   2HG1  ILE  27          HG11      ILE  27   2.143  -2.822  -1.706
  237   1HG2  ILE  27          HG21      ILE  27   4.731  -3.174  -0.838
  238   2HG2  ILE  27          HG22      ILE  27   5.563  -4.569  -1.524
  239   3HG2  ILE  27          HG23      ILE  27   4.177  -4.805  -0.459
  240   1HD1  ILE  27          HD11      ILE  27   1.480  -5.045  -3.587
  241   2HD1  ILE  27          HD12      ILE  27   1.145  -3.319  -3.734
  242   3HD1  ILE  27          HD13      ILE  27   0.236  -4.301  -2.584
  243    H    HIS  28           HN       HIS  28   6.171  -1.824  -2.601
  244    HA   HIS  28           HA       HIS  28   8.029  -3.102  -4.456
  245   1HB   HIS  28          HB2       HIS  28   7.941  -0.572  -4.048
  246   2HB   HIS  28          HB1       HIS  28   8.698  -0.913  -2.496
  247    HD1  HIS  28           HD1      HIS  28   9.419  -1.912  -6.107
  248    HD2  HIS  28           HD2      HIS  28  11.366  -0.596  -2.680
  249    HE1  HIS  28           HE1      HIS  28  11.848  -1.738  -6.738
  250    HE2  HIS  28           HE2      HIS  28  12.991  -0.852  -4.675
  251    H    LYS  29           HN       LYS  29   7.419  -2.742  -0.999
  252    HA   LYS  29           HA       LYS  29   9.094  -5.087  -0.520
  253   1HB   LYS  29          HB2       LYS  29  10.218  -4.042   1.389
  254   2HB   LYS  29          HB1       LYS  29  10.583  -3.192  -0.106
  255   1HG   LYS  29          HG2       LYS  29   9.969  -1.307   0.872
  256   2HG   LYS  29          HG1       LYS  29   8.322  -1.933   0.962
  257   1HD   LYS  29          HD2       LYS  29   8.814  -2.947   3.122
  258   2HD   LYS  29          HD1       LYS  29  10.473  -2.355   3.033
  259   1HE   LYS  29          HE2       LYS  29   8.647  -0.186   2.610
  260   2HE   LYS  29          HE1       LYS  29   8.216  -1.041   4.089
  261   1HZ   LYS  29          HZ1       LYS  29   9.777   0.303   4.957
  262   2HZ   LYS  29          HZ2       LYS  29  10.573   0.543   3.484
  263   3HZ   LYS  29          HZ3       LYS  29  10.852  -0.867   4.375
  264    H    GLU  30           HN       GLU  30   8.470  -6.309   1.261
  265    HA   GLU  30           HA       GLU  30   5.926  -5.478   2.490
  266   1HB   GLU  30          HB2       GLU  30   6.848  -8.318   2.130
  267   2HB   GLU  30          HB1       GLU  30   5.243  -7.751   2.568
  268   1HG   GLU  30          HG2       GLU  30   4.649  -7.384   0.441
  269   2HG   GLU  30          HG1       GLU  30   6.232  -6.747   0.000
  270    H    VAL  31           HN       VAL  31   6.435  -4.644   4.388
  271    HA   VAL  31           HA       VAL  31   8.333  -6.061   6.102
  272    HB   VAL  31           HB       VAL  31   6.954  -3.672   7.148
  273   1HG1  VAL  31          HG11      VAL  31   9.563  -5.026   7.380
  274   2HG1  VAL  31          HG12      VAL  31   8.551  -4.285   8.620
  275   3HG1  VAL  31          HG13      VAL  31   9.563  -3.274   7.588
  276   1HG2  VAL  31          HG21      VAL  31   9.069  -3.411   5.015
  277   2HG2  VAL  31          HG22      VAL  31   8.356  -2.093   5.944
  278   3HG2  VAL  31          HG23      VAL  31   7.365  -3.009   4.810
  279    H    ASP  32           HN       ASP  32   7.318  -7.769   6.865
  280    HA   ASP  32           HA       ASP  32   4.612  -7.980   7.543
  281   1HB   ASP  32          HB2       ASP  32   7.018  -9.581   8.411
  282   2HB   ASP  32          HB1       ASP  32   5.374 -10.002   8.881
  283    H    LYS  33           HN       LYS  33   7.182  -6.452   9.206
  284    HA   LYS  33           HA       LYS  33   6.397  -6.770  11.874
  285   1HB   LYS  33          HB2       LYS  33   8.411  -5.434  10.598
  286   2HB   LYS  33          HB1       LYS  33   7.408  -4.099  11.147
  287   1HG   LYS  33          HG2       LYS  33   7.640  -4.727  13.411
  288   2HG   LYS  33          HG1       LYS  33   8.328  -6.294  12.979
  289   1HD   LYS  33          HD2       LYS  33  10.101  -4.854  13.726
  290   2HD   LYS  33          HD1       LYS  33  10.272  -5.103  11.988
  291   1HE   LYS  33          HE2       LYS  33   9.476  -2.949  11.492
  292   2HE   LYS  33          HE1       LYS  33   8.818  -2.729  13.113
  293   1HZ   LYS  33          HZ1       LYS  33  10.812  -2.131  13.938
  294   2HZ   LYS  33          HZ2       LYS  33  11.132  -1.703  12.334
  295   3HZ   LYS  33          HZ3       LYS  33  11.686  -3.182  12.940
  296    H    ASN  34           HN       ASN  34   5.571  -4.204   9.545
  297    HA   ASN  34           HA       ASN  34   2.902  -3.987  10.049
  298   1HB   ASN  34          HB2       ASN  34   4.411  -2.992  12.297
  299   2HB   ASN  34          HB1       ASN  34   3.475  -1.686  11.577
  300   1HD2  ASN  34          HD21      ASN  34   2.438  -1.836  13.729
  301   2HD2  ASN  34          HD22      ASN  34   1.108  -2.924  13.907
  302    H    TRP  35           HN       TRP  35   4.928  -3.466   8.004
  303    HA   TRP  35           HA       TRP  35   3.794  -1.034   6.971
  304   1HB   TRP  35          HB2       TRP  35   6.187  -0.827   8.433
  305   2HB   TRP  35          HB1       TRP  35   6.648  -0.694   6.739
  306    HD1  TRP  35           HD1      TRP  35   3.793   0.824   5.964
  307    HE1  TRP  35           HE1      TRP  35   3.631   3.331   6.520
  308    HE3  TRP  35           HE3      TRP  35   7.508   1.121   9.464
  309    HZ2  TRP  35           HZ2      TRP  35   4.908   5.190   8.219
  310    HZ3  TRP  35           HZ3      TRP  35   7.974   3.301  10.507
  311    HH2  TRP  35           HH2      TRP  35   6.701   5.292   9.895
  312    H    LEU  36           HN       LEU  36   4.715  -0.489   4.786
  313    HA   LEU  36           HA       LEU  36   6.151  -2.487   3.334
  314   1HB   LEU  36          HB2       LEU  36   4.475  -3.401   2.009
  315   2HB   LEU  36          HB1       LEU  36   3.739  -3.370   3.601
  316    HG   LEU  36           HG       LEU  36   2.923  -0.975   2.641
  317   1HD1  LEU  36          HD11      LEU  36   3.904  -1.265   0.479
  318   2HD1  LEU  36          HD12      LEU  36   2.149  -1.347   0.330
  319   3HD1  LEU  36          HD13      LEU  36   3.110  -2.826   0.279
  320   1HD2  LEU  36          HD21      LEU  36   1.211  -2.172   3.512
  321   2HD2  LEU  36          HD22      LEU  36   1.756  -3.684   2.787
  322   3HD2  LEU  36          HD23      LEU  36   0.878  -2.505   1.812
  323    H    GLU  37           HN       GLU  37   6.393  -1.831   1.018
  324    HA   GLU  37           HA       GLU  37   6.149   1.093   0.788
  325   1HB   GLU  37          HB2       GLU  37   8.448   0.237   0.706
  326   2HB   GLU  37          HB1       GLU  37   8.022  -0.789  -0.656
  327   1HG   GLU  37          HG2       GLU  37   8.041   0.924  -2.135
  328   2HG   GLU  37          HG1       GLU  37   7.491   2.103  -0.946
  329    H    GLY  38           HN       GLY  38   5.066   2.016  -0.869
  330   1HA   GLY  38          HA2       GLY  38   4.054   0.237  -2.994
  331   2HA   GLY  38          HA1       GLY  38   2.968   1.321  -2.138
  332    H    GLU  39           HN       GLU  39   3.608   1.190  -4.987
  333    HA   GLU  39           HA       GLU  39   4.170   4.014  -5.365
  334   1HB   GLU  39          HB2       GLU  39   6.142   1.989  -5.873
  335   2HB   GLU  39          HB1       GLU  39   5.662   2.723  -7.398
  336   1HG   GLU  39          HG2       GLU  39   6.203   4.922  -6.541
  337   2HG   GLU  39          HG1       GLU  39   6.610   4.230  -4.971
  338    H    HIS  40           HN       HIS  40   3.246   4.858  -7.233
  339    HA   HIS  40           HA       HIS  40   2.047   3.052  -9.167
  340   1HB   HIS  40          HB2       HIS  40   0.463   3.578  -7.112
  341   2HB   HIS  40          HB1       HIS  40   0.191   5.076  -7.996
  342    HD1  HIS  40           HD1      HIS  40  -1.834   2.577  -7.505
  343    HD2  HIS  40           HD2      HIS  40   0.113   3.633 -11.021
  344    HE1  HIS  40           HE1      HIS  40  -3.209   1.581  -9.360
  345    HE2  HIS  40           HE2      HIS  40  -2.048   2.288 -11.481
  346    H    HIS  41           HN       HIS  41   2.099   3.880 -11.148
  347    HA   HIS  41           HA       HIS  41   2.684   5.287 -12.837
  348   1HB   HIS  41          HB2       HIS  41   1.340   7.381 -12.927
  349   2HB   HIS  41          HB1       HIS  41   0.384   5.943 -12.591
  350    HD1  HIS  41           HD1      HIS  41   1.434   9.192 -11.132
  351    HD2  HIS  41           HD2      HIS  41  -0.711   5.823  -9.982
  352    HE1  HIS  41           HE1      HIS  41   0.230   9.848  -9.024
  353    HE2  HIS  41           HE2      HIS  41  -0.996   7.768  -8.302
  354    H    GLY  42           HN       GLY  42   4.633   5.250 -10.828
  355   1HA   GLY  42          HA2       GLY  42   6.656   6.396 -10.639
  356   2HA   GLY  42          HA1       GLY  42   5.905   7.799 -11.380
  357    H    ARG  43           HN       ARG  43   3.707   7.168  -9.162
  358    HA   ARG  43           HA       ARG  43   4.824   9.083  -7.299
  359   1HB   ARG  43          HB2       ARG  43   2.282   8.619  -8.225
  360   2HB   ARG  43          HB1       ARG  43   2.227   7.892  -6.625
  361   1HG   ARG  43          HG2       ARG  43   3.280  10.666  -7.044
  362   2HG   ARG  43          HG1       ARG  43   1.554  10.346  -6.860
  363   1HD   ARG  43          HD2       ARG  43   1.808   9.577  -4.674
  364   2HD   ARG  43          HD1       ARG  43   3.536   9.290  -4.874
  365    HE   ARG  43           HE       ARG  43   3.933  11.484  -4.342
  366   1HH1  ARG  43          HH11      ARG  43   0.535  11.075  -5.023
  367   2HH1  ARG  43          HH12      ARG  43   0.106  12.659  -4.473
  368   1HH2  ARG  43          HH21      ARG  43   3.371  13.569  -3.618
  369   2HH2  ARG  43          HH22      ARG  43   1.717  14.077  -3.679
  370    H    LEU  44           HN       LEU  44   5.429   8.702  -5.228
  371    HA   LEU  44           HA       LEU  44   5.684   5.894  -4.448
  372   1HB   LEU  44          HB2       LEU  44   7.746   7.107  -4.409
  373   2HB   LEU  44          HB1       LEU  44   7.029   8.411  -3.481
  374    HG   LEU  44           HG       LEU  44   6.735   6.792  -1.583
  375   1HD1  LEU  44          HD11      LEU  44   6.813   4.658  -2.403
  376   2HD1  LEU  44          HD12      LEU  44   8.474   4.840  -1.839
  377   3HD1  LEU  44          HD13      LEU  44   8.099   5.026  -3.553
  378   1HD2  LEU  44          HD21      LEU  44   8.802   8.373  -2.174
  379   2HD2  LEU  44          HD22      LEU  44   9.633   6.818  -2.183
  380   3HD2  LEU  44          HD23      LEU  44   8.767   7.346  -0.741
  381    H    GLY  45           HN       GLY  45   4.511   5.025  -2.863
  382   1HA   GLY  45          HA2       GLY  45   3.344   6.751  -0.809
  383   2HA   GLY  45          HA1       GLY  45   2.238   5.807  -1.794
  384    H    ILE  46           HN       ILE  46   3.559   5.857   1.122
  385    HA   ILE  46           HA       ILE  46   3.814   2.923   1.284
  386    HB   ILE  46           HB       ILE  46   5.113   5.012   3.041
  387   1HG1  ILE  46          HG12      ILE  46   6.288   3.140   0.976
  388   2HG1  ILE  46          HG11      ILE  46   6.112   4.884   0.808
  389   1HG2  ILE  46          HG21      ILE  46   5.560   3.433   4.534
  390   2HG2  ILE  46          HG22      ILE  46   6.228   2.379   3.288
  391   3HG2  ILE  46          HG23      ILE  46   4.504   2.343   3.641
  392   1HD1  ILE  46          HD11      ILE  46   8.390   4.306   1.352
  393   2HD1  ILE  46          HD12      ILE  46   7.852   3.454   2.800
  394   3HD1  ILE  46          HD13      ILE  46   7.656   5.203   2.681
  395    H    PHE  47           HN       PHE  47   2.818   1.860   3.009
  396    HA   PHE  47           HA       PHE  47   1.313   3.315   4.987
  397   1HB   PHE  47          HB2       PHE  47  -0.867   2.243   4.309
  398   2HB   PHE  47          HB1       PHE  47  -0.291   3.500   3.221
  399    HD1  PHE  47           HD2      PHE  47   0.765   2.857   1.060
  400    HD2  PHE  47           HD1      PHE  47  -1.177   0.027   3.575
  401    HE1  PHE  47           HE2      PHE  47   0.611   1.289  -0.831
  402    HE2  PHE  47           HE1      PHE  47  -1.334  -1.548   1.691
  403    HZ   PHE  47           HZ       PHE  47  -0.440  -0.917  -0.517
  404    HA   PRO  48           HA       PRO  48   1.940  -0.389   7.292
  405   1HB   PRO  48          HB2       PRO  48  -0.308  -0.535   8.819
  406   2HB   PRO  48          HB1       PRO  48   0.987   0.630   9.114
  407   1HG   PRO  48          HG2       PRO  48  -1.624   1.017   7.703
  408   2HG   PRO  48          HG1       PRO  48  -0.812   2.081   8.867
  409   1HD   PRO  48          HD2       PRO  48  -0.728   2.526   6.205
  410   2HD   PRO  48          HD1       PRO  48   0.626   2.934   7.277
  411    H    ALA  49           HN       ALA  49   1.690  -2.524   6.966
  412    HA   ALA  49           HA       ALA  49  -0.051  -3.481   4.955
  413   1HB   ALA  49          HB1       ALA  49   2.242  -4.393   5.962
  414   2HB   ALA  49          HB2       ALA  49   1.102  -5.427   5.099
  415   3HB   ALA  49          HB3       ALA  49   1.122  -5.415   6.863
  416    H    ASN  50           HN       ASN  50  -0.545  -2.927   8.285
  417    HA   ASN  50           HA       ASN  50  -2.437  -4.974   8.814
  418   1HB   ASN  50          HB2       ASN  50  -3.012  -3.656  10.799
  419   2HB   ASN  50          HB1       ASN  50  -1.266  -3.783  10.611
  420   1HD2  ASN  50          HD21      ASN  50  -1.302  -1.931  12.070
  421   2HD2  ASN  50          HD22      ASN  50  -1.477  -0.348  11.399
  422    H    TYR  51           HN       TYR  51  -2.627  -2.064   7.023
  423    HA   TYR  51           HA       TYR  51  -5.568  -2.138   7.136
  424   1HB   TYR  51          HB2       TYR  51  -3.630   0.055   7.045
  425   2HB   TYR  51          HB1       TYR  51  -4.926   0.223   5.865
  426    HD1  TYR  51           HD2      TYR  51  -7.328  -0.528   7.011
  427    HD2  TYR  51           HD1      TYR  51  -3.992   1.209   8.998
  428    HE1  TYR  51           HE2      TYR  51  -8.824   0.319   8.769
  429    HE2  TYR  51           HE1      TYR  51  -5.478   2.060  10.763
  430    HH   TYR  51           HH       TYR  51  -8.459   2.551  10.580
  431    H    VAL  52           HN       VAL  52  -3.886  -3.892   5.510
  432    HA   VAL  52           HA       VAL  52  -5.216  -3.438   2.985
  433    HB   VAL  52           HB       VAL  52  -3.145  -2.137   2.700
  434   1HG1  VAL  52          HG11      VAL  52  -1.935  -4.026   4.213
  435   2HG1  VAL  52          HG12      VAL  52  -1.078  -2.881   3.181
  436   3HG1  VAL  52          HG13      VAL  52  -1.416  -4.511   2.599
  437   1HG2  VAL  52          HG21      VAL  52  -2.801  -2.820   0.547
  438   2HG2  VAL  52          HG22      VAL  52  -4.286  -3.702   0.903
  439   3HG2  VAL  52          HG23      VAL  52  -2.730  -4.527   0.982
  440    H    GLU  53           HN       GLU  53  -5.259  -5.287   1.635
  441    HA   GLU  53           HA       GLU  53  -4.489  -7.768   3.024
  442   1HB   GLU  53          HB2       GLU  53  -6.995  -7.034   2.318
  443   2HB   GLU  53          HB1       GLU  53  -6.507  -7.894   0.865
  444   1HG   GLU  53          HG2       GLU  53  -5.902  -9.836   2.293
  445   2HG   GLU  53          HG1       GLU  53  -6.575  -8.970   3.672
  446    H    VAL  54           HN       VAL  54  -3.027  -9.034   2.089
  447    HA   VAL  54           HA       VAL  54  -1.837  -8.303  -0.403
  448    HB   VAL  54           HB       VAL  54  -0.519  -9.282   1.432
  449   1HG1  VAL  54          HG11      VAL  54  -2.321 -10.899   2.128
  450   2HG1  VAL  54          HG12      VAL  54  -0.686 -11.558   2.076
  451   3HG1  VAL  54          HG13      VAL  54  -1.822 -11.914   0.775
  452   1HG2  VAL  54          HG21      VAL  54   0.973 -10.191   0.007
  453   2HG2  VAL  54          HG22      VAL  54  -0.181  -9.666  -1.219
  454   3HG2  VAL  54          HG23      VAL  54  -0.195 -11.336  -0.653
  455    H    LEU  55           HN       LEU  55  -2.526  -8.837  -2.357
  456    HA   LEU  55           HA       LEU  55  -3.323 -11.465  -3.066
  457   1HB   LEU  55          HB2       LEU  55  -5.642 -10.976  -3.719
  458   2HB   LEU  55          HB1       LEU  55  -5.399 -10.872  -1.986
  459    HG   LEU  55           HG       LEU  55  -5.027  -8.277  -3.178
  460   1HD1  LEU  55          HD11      LEU  55  -6.705  -9.594  -4.767
  461   2HD1  LEU  55          HD12      LEU  55  -6.917  -7.889  -4.369
  462   3HD1  LEU  55          HD13      LEU  55  -7.846  -9.117  -3.509
  463   1HD2  LEU  55          HD21      LEU  55  -5.794  -9.225  -0.799
  464   2HD2  LEU  55          HD22      LEU  55  -7.379  -8.893  -1.497
  465   3HD2  LEU  55          HD23      LEU  55  -6.189  -7.599  -1.357
  466    HA   PRO  56           HA       PRO  56  -1.441  -8.744  -6.371
  467   1HB   PRO  56          HB2       PRO  56  -0.620 -11.505  -7.146
  468   2HB   PRO  56          HB1       PRO  56   0.319 -10.008  -7.154
  469   1HG   PRO  56          HG2       PRO  56   0.692 -11.827  -5.249
  470   2HG   PRO  56          HG1       PRO  56   0.723 -10.094  -4.870
  471   1HD   PRO  56          HD2       PRO  56  -1.409 -12.114  -4.341
  472   2HD   PRO  56          HD1       PRO  56  -0.909 -10.716  -3.367
  473    H    LEU  57           HN       LEU  57  -3.087  -8.154  -7.665
  474    HA   LEU  57           HA       LEU  57  -4.690 -10.215  -8.988
  475   1HB   LEU  57          HB2       LEU  57  -5.078  -7.223  -8.865
  476   2HB   LEU  57          HB1       LEU  57  -6.186  -8.364  -9.604
  477    HG   LEU  57           HG       LEU  57  -5.604  -9.011  -6.818
  478   1HD1  LEU  57          HD11      LEU  57  -6.405  -6.262  -7.544
  479   2HD1  LEU  57          HD12      LEU  57  -5.564  -6.864  -6.115
  480   3HD1  LEU  57          HD13      LEU  57  -7.314  -7.037  -6.246
  481   1HD2  LEU  57          HD21      LEU  57  -8.296  -8.330  -7.891
  482   2HD2  LEU  57          HD22      LEU  57  -7.814  -9.612  -6.781
  483   3HD2  LEU  57          HD23      LEU  57  -7.474  -9.764  -8.505
  484    H    GLU  58           HN       GLU  58  -5.371  -9.607 -11.301
  485    HA   GLU  58           HA       GLU  58  -4.788  -9.393 -13.489
  486   1HB   GLU  58          HB2       GLU  58  -3.296  -7.172 -12.173
  487   2HB   GLU  58          HB1       GLU  58  -2.900  -7.557 -13.843
  488   1HG   GLU  58          HG2       GLU  58  -4.798  -6.676 -14.627
  489   2HG   GLU  58          HG1       GLU  58  -5.768  -7.338 -13.312
  Start of MODEL   13
    1   1H    MET   0          HT1       MET   0   7.203  -7.647  -7.336
    2   2H    MET   0          HT2       MET   0   7.773  -7.868  -8.940
    3   3H    MET   0          HT3       MET   0   6.876  -9.110  -8.166
    4    HA   MET   0           HA       MET   0   5.814  -6.427  -8.715
    5   1HB   MET   0          HB2       MET   0   5.985  -8.905 -10.386
    6   2HB   MET   0          HB1       MET   0   4.567  -7.875 -10.528
    7   1HG   MET   0          HG2       MET   0   7.297  -6.691 -10.743
    8   2HG   MET   0          HG1       MET   0   6.586  -7.536 -12.117
    9   1HE   MET   0          HE1       MET   0   4.196  -5.829 -13.643
   10   2HE   MET   0          HE2       MET   0   3.168  -5.921 -12.213
   11   3HE   MET   0          HE3       MET   0   4.209  -7.279 -12.639
   12    H    LYS   1           HN       LYS   1   4.574  -6.331  -6.879
   13    HA   LYS   1           HA       LYS   1   2.499  -8.403  -6.634
   14   1HB   LYS   1          HB2       LYS   1   4.143  -7.124  -4.465
   15   2HB   LYS   1          HB1       LYS   1   2.566  -7.822  -4.123
   16   1HG   LYS   1          HG2       LYS   1   3.337  -9.918  -4.225
   17   2HG   LYS   1          HG1       LYS   1   4.342  -9.584  -5.636
   18   1HD   LYS   1          HD2       LYS   1   5.894  -8.350  -4.034
   19   2HD   LYS   1          HD1       LYS   1   4.977  -9.115  -2.734
   20   1HE   LYS   1          HE2       LYS   1   6.585 -10.698  -2.974
   21   2HE   LYS   1          HE1       LYS   1   5.471 -11.278  -4.212
   22   1HZ   LYS   1          HZ1       LYS   1   6.916  -9.566  -5.632
   23   2HZ   LYS   1          HZ2       LYS   1   7.323 -11.199  -5.466
   24   3HZ   LYS   1          HZ3       LYS   1   8.083 -10.037  -4.500
   25    H    ALA   2           HN       ALA   2   0.447  -7.695  -6.379
   26    HA   ALA   2           HA       ALA   2   0.055  -4.777  -6.273
   27   1HB   ALA   2          HB1       ALA   2  -1.789  -6.825  -7.496
   28   2HB   ALA   2          HB2       ALA   2  -0.615  -5.866  -8.397
   29   3HB   ALA   2          HB3       ALA   2  -1.953  -5.071  -7.568
   30    H    ALA   3           HN       ALA   3  -1.733  -3.962  -5.089
   31    HA   ALA   3           HA       ALA   3  -3.170  -5.782  -3.337
   32   1HB   ALA   3          HB1       ALA   3  -0.862  -4.835  -2.355
   33   2HB   ALA   3          HB2       ALA   3  -2.278  -5.160  -1.354
   34   3HB   ALA   3          HB3       ALA   3  -1.940  -3.516  -1.898
   35    H    ARG   4           HN       ARG   4  -5.190  -5.098  -2.956
   36    HA   ARG   4           HA       ARG   4  -5.910  -2.418  -3.907
   37   1HB   ARG   4          HB2       ARG   4  -7.054  -4.412  -4.893
   38   2HB   ARG   4          HB1       ARG   4  -7.735  -4.750  -3.308
   39   1HG   ARG   4          HG2       ARG   4  -8.263  -2.027  -4.014
   40   2HG   ARG   4          HG1       ARG   4  -8.774  -3.094  -5.324
   41   1HD   ARG   4          HD2       ARG   4  -9.598  -3.236  -2.427
   42   2HD   ARG   4          HD1       ARG   4 -10.610  -2.792  -3.801
   43    HE   ARG   4           HE       ARG   4  -9.525  -5.385  -4.152
   44   1HH1  ARG   4          HH11      ARG   4 -11.968  -3.650  -2.363
   45   2HH1  ARG   4          HH12      ARG   4 -12.996  -5.031  -2.184
   46   1HH2  ARG   4          HH21      ARG   4 -10.876  -7.203  -3.919
   47   2HH2  ARG   4          HH22      ARG   4 -12.377  -7.049  -3.068
   48    H    LEU   5           HN       LEU   5  -6.423  -0.874  -2.511
   49    HA   LEU   5           HA       LEU   5  -6.313  -1.236   0.274
   50   1HB   LEU   5          HB2       LEU   5  -5.928   0.900  -1.034
   51   2HB   LEU   5          HB1       LEU   5  -7.672   1.049  -1.143
   52    HG   LEU   5           HG       LEU   5  -7.640   0.921   1.436
   53   1HD1  LEU   5          HD11      LEU   5  -5.595   0.432   2.228
   54   2HD1  LEU   5          HD12      LEU   5  -5.311   2.161   2.027
   55   3HD1  LEU   5          HD13      LEU   5  -4.777   1.029   0.784
   56   1HD2  LEU   5          HD21      LEU   5  -8.313   2.973   0.771
   57   2HD2  LEU   5          HD22      LEU   5  -6.978   3.164  -0.365
   58   3HD2  LEU   5          HD23      LEU   5  -6.717   3.440   1.357
   59    H    LYS   6           HN       LYS   6  -7.856  -1.456   1.832
   60    HA   LYS   6           HA       LYS   6 -10.594  -1.976   0.881
   61   1HB   LYS   6          HB2       LYS   6  -8.825  -3.563   2.451
   62   2HB   LYS   6          HB1       LYS   6 -10.177  -3.092   3.472
   63   1HG   LYS   6          HG2       LYS   6 -11.444  -3.842   1.176
   64   2HG   LYS   6          HG1       LYS   6 -10.074  -4.953   1.223
   65   1HD   LYS   6          HD2       LYS   6 -10.717  -5.427   3.627
   66   2HD   LYS   6          HD1       LYS   6 -12.215  -4.553   3.300
   67   1HE   LYS   6          HE2       LYS   6 -11.239  -6.964   1.774
   68   2HE   LYS   6          HE1       LYS   6 -12.456  -6.997   3.049
   69   1HZ   LYS   6          HZ1       LYS   6 -13.496  -5.156   1.452
   70   2HZ   LYS   6          HZ2       LYS   6 -13.835  -6.805   1.295
   71   3HZ   LYS   6          HZ3       LYS   6 -12.676  -6.083   0.298
   72    H    PHE   7           HN       PHE   7  -8.662   0.011   2.875
   73    HA   PHE   7           HA       PHE   7 -11.058   1.344   3.870
   74   1HB   PHE   7          HB2       PHE   7  -8.774   0.727   5.742
   75   2HB   PHE   7          HB1       PHE   7 -10.354   1.391   6.144
   76    HD1  PHE   7           HD1      PHE   7 -12.331  -0.044   6.186
   77    HD2  PHE   7           HD2      PHE   7  -8.452  -1.623   5.434
   78    HE1  PHE   7           HE1      PHE   7 -13.168  -2.310   6.649
   79    HE2  PHE   7           HE2      PHE   7  -9.282  -3.893   5.894
   80    HZ   PHE   7           HZ       PHE   7 -11.643  -4.239   6.503
   81    H    ASP   8           HN       ASP   8 -10.892   3.408   3.321
   82    HA   ASP   8           HA       ASP   8  -8.590   4.618   2.309
   83   1HB   ASP   8          HB2       ASP   8  -9.824   6.732   2.485
   84   2HB   ASP   8          HB1       ASP   8 -10.853   5.451   1.852
   85    H    PHE   9           HN       PHE   9  -6.895   5.626   3.203
   86    HA   PHE   9           HA       PHE   9  -7.022   6.320   6.058
   87   1HB   PHE   9          HB2       PHE   9  -5.671   4.145   5.240
   88   2HB   PHE   9          HB1       PHE   9  -4.422   5.360   4.995
   89    HD1  PHE   9           HD2      PHE   9  -4.166   7.040   7.051
   90    HD2  PHE   9           HD1      PHE   9  -5.742   3.093   7.272
   91    HE1  PHE   9           HE2      PHE   9  -3.615   6.958   9.448
   92    HE2  PHE   9           HE1      PHE   9  -5.194   3.004   9.669
   93    HZ   PHE   9           HZ       PHE   9  -4.129   4.938  10.760
   94    H    GLN  10           HN       GLN  10  -6.068   8.213   6.633
   95    HA   GLN  10           HA       GLN  10  -5.134   9.906   4.444
   96   1HB   GLN  10          HB2       GLN  10  -5.292  11.718   6.225
   97   2HB   GLN  10          HB1       GLN  10  -6.804  10.975   5.723
   98   1HG   GLN  10          HG2       GLN  10  -6.908   9.665   7.708
   99   2HG   GLN  10          HG1       GLN  10  -5.274  10.138   8.172
  100   1HE2  GLN  10          HE21      GLN  10  -5.412  11.366   9.907
  101   2HE2  GLN  10          HE22      GLN  10  -6.504  12.685  10.135
  102    H    ALA  11           HN       ALA  11  -3.023   9.807   4.045
  103    HA   ALA  11           HA       ALA  11  -1.053   8.901   5.811
  104   1HB   ALA  11          HB1       ALA  11   0.541  10.016   4.194
  105   2HB   ALA  11          HB2       ALA  11  -0.885  10.564   3.312
  106   3HB   ALA  11          HB3       ALA  11  -0.574   8.838   3.501
  107    H    GLN  12           HN       GLN  12  -0.170   9.814   7.536
  108    HA   GLN  12           HA       GLN  12  -0.602  12.640   8.051
  109   1HB   GLN  12          HB2       GLN  12   0.576  11.970  10.262
  110   2HB   GLN  12          HB1       GLN  12  -1.065  11.418   9.969
  111   1HG   GLN  12          HG2       GLN  12  -0.451   9.250   9.814
  112   2HG   GLN  12          HG1       GLN  12   1.108   9.628   9.083
  113   1HE2  GLN  12          HE21      GLN  12  -0.364  10.697  12.120
  114   2HE2  GLN  12          HE22      GLN  12   0.893  10.099  13.143
  115    H    SER  13           HN       SER  13   2.045  10.385   7.499
  116    HA   SER  13           HA       SER  13   4.048  12.445   7.870
  117   1HB   SER  13          HB2       SER  13   4.219   9.535   7.075
  118   2HB   SER  13          HB1       SER  13   5.627  10.593   7.163
  119    HG   SER  13           HG       SER  13   5.636  10.033   9.188
  120    HA   PRO  14           HA       PRO  14   4.172  13.988   3.732
  121   1HB   PRO  14          HB2       PRO  14   7.128  13.945   4.052
  122   2HB   PRO  14          HB1       PRO  14   6.063  15.283   3.609
  123   1HG   PRO  14          HG2       PRO  14   7.141  15.147   6.042
  124   2HG   PRO  14          HG1       PRO  14   5.479  15.722   5.809
  125   1HD   PRO  14          HD2       PRO  14   6.452  13.079   6.807
  126   2HD   PRO  14          HD1       PRO  14   5.045  14.033   7.320
  127    H    LYS  15           HN       LYS  15   6.202  11.293   4.693
  128    HA   LYS  15           HA       LYS  15   6.842  10.515   1.999
  129   1HB   LYS  15          HB2       LYS  15   7.843   8.529   3.044
  130   2HB   LYS  15          HB1       LYS  15   8.389  10.012   3.814
  131   1HG   LYS  15          HG2       LYS  15   7.387   9.525   5.780
  132   2HG   LYS  15          HG1       LYS  15   6.030   8.700   5.010
  133   1HD   LYS  15          HD2       LYS  15   7.188   6.982   6.086
  134   2HD   LYS  15          HD1       LYS  15   7.741   6.877   4.413
  135   1HE   LYS  15          HE2       LYS  15   9.631   6.668   5.899
  136   2HE   LYS  15          HE1       LYS  15   9.736   8.195   5.024
  137   1HZ   LYS  15          HZ1       LYS  15   9.107   9.396   6.915
  138   2HZ   LYS  15          HZ2       LYS  15  10.214   8.254   7.492
  139   3HZ   LYS  15          HZ3       LYS  15   8.556   8.020   7.732
  140    H    GLU  16           HN       GLU  16   4.359   9.777   4.327
  141    HA   GLU  16           HA       GLU  16   3.429   7.394   3.065
  142   1HB   GLU  16          HB2       GLU  16   2.421   9.211   5.206
  143   2HB   GLU  16          HB1       GLU  16   1.283   8.105   4.449
  144   1HG   GLU  16          HG2       GLU  16   3.297   6.408   4.973
  145   2HG   GLU  16          HG1       GLU  16   3.520   7.565   6.284
  146    H    LEU  17           HN       LEU  17   1.243   7.190   2.107
  147    HA   LEU  17           HA       LEU  17   0.463   9.593   0.595
  148   1HB   LEU  17          HB2       LEU  17   1.767   8.106  -0.848
  149   2HB   LEU  17          HB1       LEU  17   0.679   6.781  -0.480
  150    HG   LEU  17           HG       LEU  17  -1.002   8.776  -1.447
  151   1HD1  LEU  17          HD11      LEU  17   1.256   9.817  -2.187
  152   2HD1  LEU  17          HD12      LEU  17  -0.082   9.737  -3.333
  153   3HD1  LEU  17          HD13      LEU  17   1.228   8.560  -3.423
  154   1HD2  LEU  17          HD21      LEU  17   0.058   6.763  -3.344
  155   2HD2  LEU  17          HD22      LEU  17  -1.608   7.180  -2.944
  156   3HD2  LEU  17          HD23      LEU  17  -0.666   6.166  -1.851
  157    H    THR  18           HN       THR  18  -1.674   9.989   0.455
  158    HA   THR  18           HA       THR  18  -3.453   8.285   1.996
  159    HB   THR  18           HB       THR  18  -3.948  10.950   0.652
  160    HG1  THR  18           HG1      THR  18  -3.215  11.814   2.413
  161   1HG2  THR  18          HG21      THR  18  -5.709  10.754   2.731
  162   2HG2  THR  18          HG22      THR  18  -5.739   9.130   2.045
  163   3HG2  THR  18          HG23      THR  18  -6.098  10.524   1.026
  164    H    LEU  19           HN       LEU  19  -4.949   6.952   1.165
  165    HA   LEU  19           HA       LEU  19  -5.821   7.279  -1.596
  166   1HB   LEU  19          HB2       LEU  19  -5.371   4.928  -2.141
  167   2HB   LEU  19          HB1       LEU  19  -3.901   5.830  -1.822
  168    HG   LEU  19           HG       LEU  19  -5.172   4.201   0.351
  169   1HD1  LEU  19          HD11      LEU  19  -4.992   2.615  -1.409
  170   2HD1  LEU  19          HD12      LEU  19  -3.617   2.359  -0.334
  171   3HD1  LEU  19          HD13      LEU  19  -3.394   3.207  -1.864
  172   1HD2  LEU  19          HD21      LEU  19  -2.274   4.295   0.111
  173   2HD2  LEU  19          HD22      LEU  19  -3.310   4.666   1.489
  174   3HD2  LEU  19          HD23      LEU  19  -3.000   5.895   0.264
  175    H    GLN  20           HN       GLN  20  -7.838   6.449  -2.019
  176    HA   GLN  20           HA       GLN  20  -9.400   5.727   0.331
  177   1HB   GLN  20          HB2       GLN  20 -10.163   7.500  -1.271
  178   2HB   GLN  20          HB1       GLN  20 -10.359   6.245  -2.487
  179   1HG   GLN  20          HG2       GLN  20 -12.204   5.357  -1.478
  180   2HG   GLN  20          HG1       GLN  20 -11.728   5.906   0.128
  181   1HE2  GLN  20          HE21      GLN  20 -13.191   7.260   0.868
  182   2HE2  GLN  20          HE22      GLN  20 -13.944   8.536  -0.021
  183    H    LYS  21           HN       LYS  21 -11.091   4.017   0.073
  184    HA   LYS  21           HA       LYS  21  -9.973   1.531  -0.384
  185   1HB   LYS  21          HB2       LYS  21 -12.199   2.263   0.801
  186   2HB   LYS  21          HB1       LYS  21 -12.914   1.923  -0.769
  187   1HG   LYS  21          HG2       LYS  21 -11.142  -0.156   0.351
  188   2HG   LYS  21          HG1       LYS  21 -12.688   0.098   1.164
  189   1HD   LYS  21          HD2       LYS  21 -12.510  -0.232  -1.815
  190   2HD   LYS  21          HD1       LYS  21 -12.598  -1.625  -0.734
  191   1HE   LYS  21          HE2       LYS  21 -14.644  -0.320   0.264
  192   2HE   LYS  21          HE1       LYS  21 -14.643   0.468  -1.314
  193   1HZ   LYS  21          HZ1       LYS  21 -16.004  -1.305  -1.709
  194   2HZ   LYS  21          HZ2       LYS  21 -15.196  -2.331  -0.635
  195   3HZ   LYS  21          HZ3       LYS  21 -14.519  -1.988  -2.146
  196    H    GLY  22           HN       GLY  22  -9.829   0.144  -2.081
  197   1HA   GLY  22          HA2       GLY  22 -10.458  -0.698  -4.217
  198   2HA   GLY  22          HA1       GLY  22 -11.139   0.880  -4.604
  199    H    ASP  23           HN       ASP  23  -8.416   1.856  -3.305
  200    HA   ASP  23           HA       ASP  23  -7.134   2.310  -5.808
  201   1HB   ASP  23          HB2       ASP  23  -7.108   3.626  -3.454
  202   2HB   ASP  23          HB1       ASP  23  -5.593   2.740  -3.312
  203    H    ILE  24           HN       ILE  24  -5.510   1.248  -6.776
  204    HA   ILE  24           HA       ILE  24  -4.317  -1.026  -5.327
  205    HB   ILE  24           HB       ILE  24  -5.723  -1.723  -7.218
  206   1HG1  ILE  24          HG12      ILE  24  -3.354  -2.539  -8.530
  207   2HG1  ILE  24          HG11      ILE  24  -2.946  -2.375  -6.825
  208   1HG2  ILE  24          HG21      ILE  24  -5.161  -1.164  -9.497
  209   2HG2  ILE  24          HG22      ILE  24  -3.781  -0.209  -8.956
  210   3HG2  ILE  24          HG23      ILE  24  -5.420   0.317  -8.575
  211   1HD1  ILE  24          HD11      ILE  24  -5.267  -3.721  -6.632
  212   2HD1  ILE  24          HD12      ILE  24  -3.683  -4.490  -6.734
  213   3HD1  ILE  24          HD13      ILE  24  -4.676  -4.321  -8.181
  214    H    VAL  25           HN       VAL  25  -2.151  -1.153  -5.173
  215    HA   VAL  25           HA       VAL  25  -0.504   0.602  -6.851
  216    HB   VAL  25           HB       VAL  25   0.888   1.202  -4.899
  217   1HG1  VAL  25          HG11      VAL  25  -0.756   2.777  -3.863
  218   2HG1  VAL  25          HG12      VAL  25  -2.023   1.966  -4.784
  219   3HG1  VAL  25          HG13      VAL  25  -0.722   2.808  -5.626
  220   1HG2  VAL  25          HG21      VAL  25  -1.200   0.506  -2.952
  221   2HG2  VAL  25          HG22      VAL  25   0.556   0.433  -2.810
  222   3HG2  VAL  25          HG23      VAL  25  -0.317  -0.865  -3.623
  223    H    TYR  26           HN       TYR  26   1.542  -0.162  -7.321
  224    HA   TYR  26           HA       TYR  26   1.911  -3.004  -6.990
  225   1HB   TYR  26          HB2       TYR  26   3.766  -1.003  -8.294
  226   2HB   TYR  26          HB1       TYR  26   3.790  -2.752  -8.495
  227    HD1  TYR  26           HD2      TYR  26   2.081   0.357  -9.399
  228    HD2  TYR  26           HD1      TYR  26   2.153  -3.866  -9.902
  229    HE1  TYR  26           HE2      TYR  26   0.562   0.567 -11.321
  230    HE2  TYR  26           HE1      TYR  26   0.635  -3.669 -11.826
  231    HH   TYR  26           HH       TYR  26  -0.068  -2.031 -13.458
  232    H    ILE  27           HN       ILE  27   2.685  -3.746  -5.129
  233    HA   ILE  27           HA       ILE  27   4.415  -2.149  -3.463
  234    HB   ILE  27           HB       ILE  27   3.775  -5.048  -2.996
  235   1HG1  ILE  27          HG12      ILE  27   1.627  -4.074  -3.414
  236   2HG1  ILE  27          HG11      ILE  27   1.801  -4.212  -1.668
  237   1HG2  ILE  27          HG21      ILE  27   5.406  -3.442  -1.635
  238   2HG2  ILE  27          HG22      ILE  27   4.443  -4.699  -0.859
  239   3HG2  ILE  27          HG23      ILE  27   3.888  -3.026  -0.840
  240   1HD1  ILE  27          HD11      ILE  27   0.863  -2.112  -1.993
  241   2HD1  ILE  27          HD12      ILE  27   1.898  -1.758  -3.376
  242   3HD1  ILE  27          HD13      ILE  27   2.577  -1.776  -1.748
  243    H    HIS  28           HN       HIS  28   6.563  -2.187  -3.413
  244    HA   HIS  28           HA       HIS  28   7.994  -4.000  -5.166
  245   1HB   HIS  28          HB2       HIS  28   8.470  -1.483  -4.854
  246   2HB   HIS  28          HB1       HIS  28   9.260  -1.955  -3.353
  247    HD1  HIS  28           HD1      HIS  28  10.992  -4.209  -3.984
  248    HD2  HIS  28           HD2      HIS  28  10.352  -1.178  -6.754
  249    HE1  HIS  28           HE1      HIS  28  12.946  -4.318  -5.564
  250    HE2  HIS  28           HE2      HIS  28  12.578  -2.424  -7.184
  251    H    LYS  29           HN       LYS  29   8.538  -2.974  -1.794
  252    HA   LYS  29           HA       LYS  29   9.498  -5.697  -1.215
  253   1HB   LYS  29          HB2       LYS  29  10.722  -4.666   0.682
  254   2HB   LYS  29          HB1       LYS  29  11.230  -4.042  -0.882
  255   1HG   LYS  29          HG2       LYS  29  10.520  -1.960  -0.431
  256   2HG   LYS  29          HG1       LYS  29   9.089  -2.522   0.435
  257   1HD   LYS  29          HD2       LYS  29  10.957  -3.299   2.176
  258   2HD   LYS  29          HD1       LYS  29  11.820  -1.949   1.436
  259   1HE   LYS  29          HE2       LYS  29   8.993  -1.555   2.295
  260   2HE   LYS  29          HE1       LYS  29  10.257  -1.592   3.524
  261   1HZ   LYS  29          HZ1       LYS  29   9.753   0.660   2.690
  262   2HZ   LYS  29          HZ2       LYS  29  10.288   0.195   1.155
  263   3HZ   LYS  29          HZ3       LYS  29  11.369   0.218   2.456
  264    H    GLU  30           HN       GLU  30   8.776  -6.759   0.644
  265    HA   GLU  30           HA       GLU  30   6.375  -5.576   1.873
  266   1HB   GLU  30          HB2       GLU  30   6.987  -8.514   1.579
  267   2HB   GLU  30          HB1       GLU  30   5.488  -7.795   2.152
  268   1HG   GLU  30          HG2       GLU  30   6.045  -6.729  -0.416
  269   2HG   GLU  30          HG1       GLU  30   6.231  -8.480  -0.494
  270    H    VAL  31           HN       VAL  31   7.043  -4.713   3.723
  271    HA   VAL  31           HA       VAL  31   8.858  -6.224   5.443
  272    HB   VAL  31           HB       VAL  31   7.798  -3.713   6.503
  273   1HG1  VAL  31          HG11      VAL  31   9.963  -3.428   7.307
  274   2HG1  VAL  31          HG12      VAL  31  10.668  -4.415   6.027
  275   3HG1  VAL  31          HG13      VAL  31   9.740  -5.178   7.318
  276   1HG2  VAL  31          HG21      VAL  31   9.495  -3.659   4.010
  277   2HG2  VAL  31          HG22      VAL  31   9.180  -2.270   5.049
  278   3HG2  VAL  31          HG23      VAL  31   7.854  -3.036   4.175
  279    H    ASP  32           HN       ASP  32   7.651  -7.823   6.242
  280    HA   ASP  32           HA       ASP  32   4.998  -7.664   7.127
  281   1HB   ASP  32          HB2       ASP  32   5.549  -9.801   8.359
  282   2HB   ASP  32          HB1       ASP  32   5.890  -9.812   6.631
  283    H    LYS  33           HN       LYS  33   7.847  -6.480   8.590
  284    HA   LYS  33           HA       LYS  33   7.448  -6.806  11.291
  285   1HB   LYS  33          HB2       LYS  33   8.757  -4.778   9.600
  286   2HB   LYS  33          HB1       LYS  33   8.306  -4.216  11.204
  287   1HG   LYS  33          HG2       LYS  33  10.493  -4.988  11.440
  288   2HG   LYS  33          HG1       LYS  33   9.493  -6.292  12.084
  289   1HD   LYS  33          HD2       LYS  33   9.878  -6.655   9.261
  290   2HD   LYS  33          HD1       LYS  33  11.439  -6.449  10.059
  291   1HE   LYS  33          HE2       LYS  33  10.186  -8.142  11.773
  292   2HE   LYS  33          HE1       LYS  33   9.496  -8.648  10.231
  293   1HZ   LYS  33          HZ1       LYS  33  11.363  -9.923  10.286
  294   2HZ   LYS  33          HZ2       LYS  33  12.266  -8.798  11.169
  295   3HZ   LYS  33          HZ3       LYS  33  12.003  -8.559   9.515
  296    H    ASN  34           HN       ASN  34   6.136  -4.191   9.267
  297    HA   ASN  34           HA       ASN  34   3.578  -4.109  10.138
  298   1HB   ASN  34          HB2       ASN  34   5.356  -3.148  12.245
  299   2HB   ASN  34          HB1       ASN  34   4.110  -1.977  11.825
  300   1HD2  ASN  34          HD21      ASN  34   4.591  -3.784  14.185
  301   2HD2  ASN  34          HD22      ASN  34   3.083  -4.594  14.415
  302    H    TRP  35           HN       TRP  35   5.481  -3.175   8.002
  303    HA   TRP  35           HA       TRP  35   4.006  -0.816   7.300
  304   1HB   TRP  35          HB2       TRP  35   6.438  -0.461   8.675
  305   2HB   TRP  35          HB1       TRP  35   6.776  -0.085   6.989
  306    HD1  TRP  35           HD1      TRP  35   3.793   1.179   6.440
  307    HE1  TRP  35           HE1      TRP  35   3.331   3.550   7.328
  308    HE3  TRP  35           HE3      TRP  35   7.462   1.445   9.990
  309    HZ2  TRP  35           HZ2      TRP  35   4.384   5.302   9.276
  310    HZ3  TRP  35           HZ3      TRP  35   7.668   3.504  11.323
  311    HH2  TRP  35           HH2      TRP  35   6.159   5.392  10.971
  312    H    LEU  36           HN       LEU  36   3.494  -1.216   5.243
  313    HA   LEU  36           HA       LEU  36   5.326  -2.727   3.559
  314   1HB   LEU  36          HB2       LEU  36   2.945  -3.374   3.787
  315   2HB   LEU  36          HB1       LEU  36   2.490  -1.834   3.082
  316    HG   LEU  36           HG       LEU  36   4.072  -2.668   1.127
  317   1HD1  LEU  36          HD11      LEU  36   4.119  -4.851   2.820
  318   2HD1  LEU  36          HD12      LEU  36   4.585  -4.838   1.117
  319   3HD1  LEU  36          HD13      LEU  36   2.948  -5.307   1.581
  320   1HD2  LEU  36          HD21      LEU  36   1.347  -2.445   1.591
  321   2HD2  LEU  36          HD22      LEU  36   1.542  -4.069   0.925
  322   3HD2  LEU  36          HD23      LEU  36   2.132  -2.671   0.027
  323    H    GLU  37           HN       GLU  37   6.080  -1.950   1.581
  324    HA   GLU  37           HA       GLU  37   5.839   0.962   1.219
  325   1HB   GLU  37          HB2       GLU  37   8.120   0.115   1.688
  326   2HB   GLU  37          HB1       GLU  37   8.028  -0.878   0.240
  327   1HG   GLU  37          HG2       GLU  37   7.408   1.855  -0.383
  328   2HG   GLU  37          HG1       GLU  37   8.953   1.748   0.458
  329    H    GLY  38           HN       GLY  38   5.142   1.793  -0.687
  330   1HA   GLY  38          HA2       GLY  38   4.973   0.116  -3.052
  331   2HA   GLY  38          HA1       GLY  38   3.429   0.581  -2.355
  332    H    GLU  39           HN       GLU  39   3.694   1.365  -4.824
  333    HA   GLU  39           HA       GLU  39   4.043   4.251  -4.598
  334   1HB   GLU  39          HB2       GLU  39   5.165   4.144  -6.940
  335   2HB   GLU  39          HB1       GLU  39   6.140   3.849  -5.508
  336   1HG   GLU  39          HG2       GLU  39   6.787   2.195  -7.008
  337   2HG   GLU  39          HG1       GLU  39   5.679   1.376  -5.909
  338    H    HIS  40           HN       HIS  40   3.155   5.395  -6.533
  339    HA   HIS  40           HA       HIS  40   1.193   3.872  -8.057
  340   1HB   HIS  40          HB2       HIS  40   0.192   4.782  -5.846
  341   2HB   HIS  40          HB1       HIS  40   0.284   6.357  -6.628
  342    HD1  HIS  40           HD1      HIS  40  -2.173   6.772  -6.979
  343    HD2  HIS  40           HD2      HIS  40  -0.937   3.093  -8.462
  344    HE1  HIS  40           HE1      HIS  40  -4.134   5.876  -8.273
  345    HE2  HIS  40           HE2      HIS  40  -3.323   3.701  -9.253
  346    H    HIS  41           HN       HIS  41   1.221   4.508 -10.100
  347    HA   HIS  41           HA       HIS  41   1.829   5.647 -11.977
  348   1HB   HIS  41          HB2       HIS  41   0.844   7.849 -12.191
  349   2HB   HIS  41          HB1       HIS  41  -0.256   6.801 -11.304
  350    HD1  HIS  41           HD1      HIS  41   2.035   9.742 -10.832
  351    HD2  HIS  41           HD2      HIS  41  -0.827   7.601  -8.711
  352    HE1  HIS  41           HE1      HIS  41   1.562  11.108  -8.774
  353    HE2  HIS  41           HE2      HIS  41  -0.219   9.824  -7.536
  354    H    GLY  42           HN       GLY  42   4.014   5.285 -10.318
  355   1HA   GLY  42          HA2       GLY  42   6.230   5.989 -10.506
  356   2HA   GLY  42          HA1       GLY  42   5.668   7.505 -11.188
  357    H    ARG  43           HN       ARG  43   3.779   7.382  -8.624
  358    HA   ARG  43           HA       ARG  43   5.622   8.966  -7.018
  359   1HB   ARG  43          HB2       ARG  43   3.018   9.372  -7.646
  360   2HB   ARG  43          HB1       ARG  43   2.843   8.577  -6.088
  361   1HG   ARG  43          HG2       ARG  43   4.713  10.888  -6.418
  362   2HG   ARG  43          HG1       ARG  43   2.984  11.146  -6.175
  363   1HD   ARG  43          HD2       ARG  43   3.613   9.298  -4.236
  364   2HD   ARG  43          HD1       ARG  43   5.045  10.325  -4.279
  365    HE   ARG  43           HE       ARG  43   2.405  11.053  -3.371
  366   1HH1  ARG  43          HH11      ARG  43   5.491  12.222  -4.513
  367   2HH1  ARG  43          HH12      ARG  43   5.309  13.782  -3.784
  368   1HH2  ARG  43          HH21      ARG  43   2.167  13.105  -2.412
  369   2HH2  ARG  43          HH22      ARG  43   3.425  14.283  -2.591
  370    H    LEU  44           HN       LEU  44   5.835   8.633  -4.723
  371    HA   LEU  44           HA       LEU  44   5.787   5.788  -4.050
  372   1HB   LEU  44          HB2       LEU  44   7.466   8.083  -3.332
  373   2HB   LEU  44          HB1       LEU  44   7.081   7.033  -1.981
  374    HG   LEU  44           HG       LEU  44   7.964   5.599  -4.381
  375   1HD1  LEU  44          HD11      LEU  44   9.327   7.719  -4.438
  376   2HD1  LEU  44          HD12      LEU  44  10.247   6.219  -4.315
  377   3HD1  LEU  44          HD13      LEU  44  10.006   7.226  -2.887
  378   1HD2  LEU  44          HD21      LEU  44   9.464   4.572  -2.599
  379   2HD2  LEU  44          HD22      LEU  44   7.725   4.353  -2.407
  380   3HD2  LEU  44          HD23      LEU  44   8.573   5.561  -1.441
  381    H    GLY  45           HN       GLY  45   4.425   4.957  -2.620
  382   1HA   GLY  45          HA2       GLY  45   3.169   6.713  -0.631
  383   2HA   GLY  45          HA1       GLY  45   2.134   5.780  -1.701
  384    H    ILE  46           HN       ILE  46   3.655   5.812   1.255
  385    HA   ILE  46           HA       ILE  46   3.547   2.875   1.461
  386    HB   ILE  46           HB       ILE  46   5.171   4.826   3.096
  387   1HG1  ILE  46          HG12      ILE  46   5.910   2.919   0.875
  388   2HG1  ILE  46          HG11      ILE  46   6.046   4.673   0.862
  389   1HG2  ILE  46          HG21      ILE  46   5.897   2.001   3.197
  390   2HG2  ILE  46          HG22      ILE  46   4.317   2.347   3.891
  391   3HG2  ILE  46          HG23      ILE  46   5.744   3.180   4.497
  392   1HD1  ILE  46          HD11      ILE  46   7.641   4.296   2.868
  393   2HD1  ILE  46          HD12      ILE  46   8.210   4.019   1.222
  394   3HD1  ILE  46          HD13      ILE  46   7.742   2.652   2.235
  395    H    PHE  47           HN       PHE  47   2.569   1.935   3.237
  396    HA   PHE  47           HA       PHE  47   1.390   3.488   5.343
  397   1HB   PHE  47          HB2       PHE  47  -0.953   2.537   4.747
  398   2HB   PHE  47          HB1       PHE  47  -0.385   3.975   3.905
  399    HD1  PHE  47           HD2      PHE  47  -0.438   0.264   3.568
  400    HD2  PHE  47           HD1      PHE  47  -0.486   4.040   1.606
  401    HE1  PHE  47           HE2      PHE  47  -0.791  -0.866   1.410
  402    HE2  PHE  47           HE1      PHE  47  -0.840   2.917  -0.555
  403    HZ   PHE  47           HZ       PHE  47  -0.993   0.461  -0.654
  404    HA   PRO  48           HA       PRO  48   1.900  -0.248   7.616
  405   1HB   PRO  48          HB2       PRO  48  -0.852   0.181   8.670
  406   2HB   PRO  48          HB1       PRO  48   0.664  -0.066   9.545
  407   1HG   PRO  48          HG2       PRO  48  -0.444   2.354   9.393
  408   2HG   PRO  48          HG1       PRO  48   1.315   2.146   9.309
  409   1HD   PRO  48          HD2       PRO  48  -0.634   2.723   7.123
  410   2HD   PRO  48          HD1       PRO  48   1.034   3.296   7.331
  411    H    ALA  49           HN       ALA  49   1.644  -2.326   7.079
  412    HA   ALA  49           HA       ALA  49  -0.152  -3.120   5.042
  413   1HB   ALA  49          HB1       ALA  49   0.961  -5.111   5.038
  414   2HB   ALA  49          HB2       ALA  49   1.106  -5.161   6.795
  415   3HB   ALA  49          HB3       ALA  49   2.160  -4.107   5.853
  416    H    ASN  50           HN       ASN  50  -0.440  -2.978   8.472
  417    HA   ASN  50           HA       ASN  50  -2.367  -4.994   8.874
  418   1HB   ASN  50          HB2       ASN  50  -1.220  -2.789  10.408
  419   2HB   ASN  50          HB1       ASN  50  -2.912  -3.084  10.800
  420   1HD2  ASN  50          HD21      ASN  50  -3.505  -5.014  11.750
  421   2HD2  ASN  50          HD22      ASN  50  -2.354  -6.104  12.436
  422    H    TYR  51           HN       TYR  51  -2.610  -1.980   7.300
  423    HA   TYR  51           HA       TYR  51  -5.535  -1.984   7.619
  424   1HB   TYR  51          HB2       TYR  51  -3.530   0.168   7.360
  425   2HB   TYR  51          HB1       TYR  51  -5.014   0.408   6.443
  426    HD1  TYR  51           HD2      TYR  51  -3.577   0.069   9.806
  427    HD2  TYR  51           HD1      TYR  51  -7.117   0.800   7.562
  428    HE1  TYR  51           HE2      TYR  51  -4.703   0.850  11.847
  429    HE2  TYR  51           HE1      TYR  51  -8.253   1.584   9.598
  430    HH   TYR  51           HH       TYR  51  -7.426   0.948  12.526
  431    H    VAL  52           HN       VAL  52  -3.908  -3.649   5.750
  432    HA   VAL  52           HA       VAL  52  -5.502  -3.123   3.398
  433    HB   VAL  52           HB       VAL  52  -2.787  -3.565   2.481
  434   1HG1  VAL  52          HG11      VAL  52  -3.779  -2.676   0.713
  435   2HG1  VAL  52          HG12      VAL  52  -3.818  -1.118   1.538
  436   3HG1  VAL  52          HG13      VAL  52  -5.181  -2.228   1.684
  437   1HG2  VAL  52          HG21      VAL  52  -3.250  -0.899   3.804
  438   2HG2  VAL  52          HG22      VAL  52  -1.786  -1.468   3.001
  439   3HG2  VAL  52          HG23      VAL  52  -2.297  -2.198   4.522
  440    H    GLU  53           HN       GLU  53  -5.136  -4.828   1.706
  441    HA   GLU  53           HA       GLU  53  -4.448  -7.385   3.000
  442   1HB   GLU  53          HB2       GLU  53  -6.683  -6.605   1.179
  443   2HB   GLU  53          HB1       GLU  53  -6.051  -8.242   1.072
  444   1HG   GLU  53          HG2       GLU  53  -6.644  -7.294   3.789
  445   2HG   GLU  53          HG1       GLU  53  -8.037  -7.484   2.725
  446    H    VAL  54           HN       VAL  54  -2.717  -8.350   2.179
  447    HA   VAL  54           HA       VAL  54  -1.624  -7.450  -0.351
  448    HB   VAL  54           HB       VAL  54  -0.508  -9.568   1.488
  449   1HG1  VAL  54          HG11      VAL  54   1.623  -8.988   0.410
  450   2HG1  VAL  54          HG12      VAL  54   0.770  -7.863  -0.646
  451   3HG1  VAL  54          HG13      VAL  54   0.437  -9.591  -0.747
  452   1HG2  VAL  54          HG21      VAL  54  -0.918  -7.314   2.573
  453   2HG2  VAL  54          HG22      VAL  54   0.284  -6.666   1.456
  454   3HG2  VAL  54          HG23      VAL  54   0.740  -7.913   2.618
  455    H    LEU  55           HN       LEU  55  -2.251  -8.361  -2.196
  456    HA   LEU  55           HA       LEU  55  -2.109 -11.153  -2.639
  457   1HB   LEU  55          HB2       LEU  55  -4.557 -11.432  -3.233
  458   2HB   LEU  55          HB1       LEU  55  -4.158 -11.404  -1.526
  459    HG   LEU  55           HG       LEU  55  -4.713  -8.759  -2.041
  460   1HD1  LEU  55          HD11      LEU  55  -6.115 -10.444  -3.999
  461   2HD1  LEU  55          HD12      LEU  55  -5.754  -8.718  -4.032
  462   3HD1  LEU  55          HD13      LEU  55  -7.134  -9.312  -3.109
  463   1HD2  LEU  55          HD21      LEU  55  -6.798  -9.189  -0.828
  464   2HD2  LEU  55          HD22      LEU  55  -5.432 -10.031  -0.096
  465   3HD2  LEU  55          HD23      LEU  55  -6.587 -10.921  -1.088
  466    HA   PRO  56           HA       PRO  56  -1.387  -8.502  -6.354
  467   1HB   PRO  56          HB2       PRO  56  -0.118 -11.099  -7.088
  468   2HB   PRO  56          HB1       PRO  56   0.489  -9.452  -7.294
  469   1HG   PRO  56          HG2       PRO  56   1.450 -11.018  -5.369
  470   2HG   PRO  56          HG1       PRO  56   1.180  -9.288  -5.085
  471   1HD   PRO  56          HD2       PRO  56  -0.424 -11.634  -4.175
  472   2HD   PRO  56          HD1       PRO  56  -0.097 -10.098  -3.347
  473    H    LEU  57           HN       LEU  57  -2.253  -8.632  -8.445
  474    HA   LEU  57           HA       LEU  57  -4.313 -10.702  -8.766
  475   1HB   LEU  57          HB2       LEU  57  -4.065  -8.002 -10.094
  476   2HB   LEU  57          HB1       LEU  57  -5.374  -9.141 -10.344
  477    HG   LEU  57           HG       LEU  57  -5.521  -8.867  -7.665
  478   1HD1  LEU  57          HD11      LEU  57  -4.486  -6.242  -8.721
  479   2HD1  LEU  57          HD12      LEU  57  -3.748  -7.258  -7.482
  480   3HD1  LEU  57          HD13      LEU  57  -5.283  -6.451  -7.162
  481   1HD2  LEU  57          HD21      LEU  57  -7.520  -8.552  -8.680
  482   2HD2  LEU  57          HD22      LEU  57  -6.834  -7.560  -9.968
  483   3HD2  LEU  57          HD23      LEU  57  -7.138  -6.856  -8.379
  484    H    GLU  58           HN       GLU  58  -2.618 -12.185  -9.512
  485    HA   GLU  58           HA       GLU  58  -1.489 -11.605 -12.136
  486   1HB   GLU  58          HB2       GLU  58  -0.212 -13.655 -11.841
  487   2HB   GLU  58          HB1       GLU  58  -0.056 -12.635 -10.418
  488   1HG   GLU  58          HG2       GLU  58  -2.043 -14.087  -9.532
  489   2HG   GLU  58          HG1       GLU  58  -1.471 -15.231 -10.746
  Start of MODEL   14
    1   1H    MET   0          HT1       MET   0   2.132  -7.199 -10.815
    2   2H    MET   0          HT2       MET   0   3.007  -7.777 -12.174
    3   3H    MET   0          HT3       MET   0   3.577  -6.414 -11.301
    4    HA   MET   0           HA       MET   0   3.539  -9.235 -10.523
    5   1HB   MET   0          HB2       MET   0   5.420  -7.591 -11.674
    6   2HB   MET   0          HB1       MET   0   5.834  -7.489  -9.968
    7   1HG   MET   0          HG2       MET   0   5.736 -10.051  -9.998
    8   2HG   MET   0          HG1       MET   0   5.803  -9.890 -11.752
    9   1HE   MET   0          HE1       MET   0   7.874  -7.975 -12.738
   10   2HE   MET   0          HE2       MET   0   7.785  -9.706 -13.064
   11   3HE   MET   0          HE3       MET   0   9.318  -8.976 -12.585
   12    H    LYS   1           HN       LYS   1   2.651  -9.577  -8.592
   13    HA   LYS   1           HA       LYS   1   2.144  -9.394  -6.384
   14   1HB   LYS   1          HB2       LYS   1   4.804  -8.184  -6.649
   15   2HB   LYS   1          HB1       LYS   1   3.913  -7.635  -5.236
   16   1HG   LYS   1          HG2       LYS   1   4.827  -9.443  -4.278
   17   2HG   LYS   1          HG1       LYS   1   3.494 -10.292  -5.065
   18   1HD   LYS   1          HD2       LYS   1   5.335 -11.556  -5.690
   19   2HD   LYS   1          HD1       LYS   1   5.125 -10.478  -7.071
   20   1HE   LYS   1          HE2       LYS   1   6.910  -9.648  -4.830
   21   2HE   LYS   1          HE1       LYS   1   7.490 -10.838  -5.995
   22   1HZ   LYS   1          HZ1       LYS   1   6.981  -7.999  -6.342
   23   2HZ   LYS   1          HZ2       LYS   1   6.518  -8.988  -7.633
   24   3HZ   LYS   1          HZ3       LYS   1   8.122  -8.996  -7.095
   25    H    ALA   2           HN       ALA   2   0.175  -8.370  -6.595
   26    HA   ALA   2           HA       ALA   2   0.205  -5.447  -6.207
   27   1HB   ALA   2          HB1       ALA   2  -0.690  -6.254  -8.419
   28   2HB   ALA   2          HB2       ALA   2  -1.787  -5.244  -7.477
   29   3HB   ALA   2          HB3       ALA   2  -2.016  -6.993  -7.522
   30    H    ALA   3           HN       ALA   3  -1.386  -4.554  -4.824
   31    HA   ALA   3           HA       ALA   3  -2.806  -6.479  -3.113
   32   1HB   ALA   3          HB1       ALA   3  -0.932  -5.955  -1.795
   33   2HB   ALA   3          HB2       ALA   3  -2.235  -4.946  -1.167
   34   3HB   ALA   3          HB3       ALA   3  -1.007  -4.245  -2.221
   35    H    ARG   4           HN       ARG   4  -4.822  -5.884  -2.479
   36    HA   ARG   4           HA       ARG   4  -5.821  -3.333  -3.545
   37   1HB   ARG   4          HB2       ARG   4  -6.795  -5.663  -4.205
   38   2HB   ARG   4          HB1       ARG   4  -7.595  -5.576  -2.642
   39   1HG   ARG   4          HG2       ARG   4  -8.829  -3.671  -3.261
   40   2HG   ARG   4          HG1       ARG   4  -7.822  -3.387  -4.682
   41   1HD   ARG   4          HD2       ARG   4  -9.032  -6.027  -4.699
   42   2HD   ARG   4          HD1       ARG   4 -10.237  -4.742  -4.613
   43    HE   ARG   4           HE       ARG   4  -8.404  -4.050  -6.592
   44   1HH1  ARG   4          HH11      ARG   4 -10.790  -6.524  -5.990
   45   2HH1  ARG   4          HH12      ARG   4 -11.133  -6.778  -7.668
   46   1HH2  ARG   4          HH21      ARG   4  -8.853  -4.382  -8.800
   47   2HH2  ARG   4          HH22      ARG   4 -10.032  -5.563  -9.264
   48    H    LEU   5           HN       LEU   5  -6.630  -1.813  -2.230
   49    HA   LEU   5           HA       LEU   5  -6.285  -2.085   0.597
   50   1HB   LEU   5          HB2       LEU   5  -6.221   0.020  -1.081
   51   2HB   LEU   5          HB1       LEU   5  -7.857   0.183  -0.474
   52    HG   LEU   5           HG       LEU   5  -6.766   0.019   1.872
   53   1HD1  LEU   5          HD11      LEU   5  -4.573  -0.492   1.677
   54   2HD1  LEU   5          HD12      LEU   5  -4.422   1.259   1.525
   55   3HD1  LEU   5          HD13      LEU   5  -4.428   0.245   0.081
   56   1HD2  LEU   5          HD21      LEU   5  -6.764   2.330  -0.013
   57   2HD2  LEU   5          HD22      LEU   5  -6.069   2.525   1.596
   58   3HD2  LEU   5          HD23      LEU   5  -7.756   2.043   1.417
   59    H    LYS   6           HN       LYS   6  -7.871  -1.991   2.215
   60    HA   LYS   6           HA       LYS   6 -10.613  -2.584   1.326
   61   1HB   LYS   6          HB2       LYS   6  -8.824  -4.152   3.053
   62   2HB   LYS   6          HB1       LYS   6 -10.439  -3.915   3.707
   63   1HG   LYS   6          HG2       LYS   6 -11.060  -5.654   2.479
   64   2HG   LYS   6          HG1       LYS   6 -10.899  -4.599   1.073
   65   1HD   LYS   6          HD2       LYS   6  -9.441  -6.143   0.343
   66   2HD   LYS   6          HD1       LYS   6  -8.318  -5.380   1.471
   67   1HE   LYS   6          HE2       LYS   6  -8.799  -7.004   3.156
   68   2HE   LYS   6          HE1       LYS   6 -10.128  -7.672   2.210
   69   1HZ   LYS   6          HZ1       LYS   6  -7.519  -7.662   0.927
   70   2HZ   LYS   6          HZ2       LYS   6  -8.731  -8.842   0.908
   71   3HZ   LYS   6          HZ3       LYS   6  -7.693  -8.717   2.238
   72    H    PHE   7           HN       PHE   7  -8.961  -0.234   2.591
   73    HA   PHE   7           HA       PHE   7 -11.103   1.003   3.883
   74   1HB   PHE   7          HB2       PHE   7  -9.993   1.095   6.215
   75   2HB   PHE   7          HB1       PHE   7 -10.908  -0.345   5.783
   76    HD1  PHE   7           HD2      PHE   7  -9.780  -2.452   5.348
   77    HD2  PHE   7           HD1      PHE   7  -7.596   1.021   6.473
   78    HE1  PHE   7           HE2      PHE   7  -7.821  -3.848   5.860
   79    HE2  PHE   7           HE1      PHE   7  -5.651  -0.356   6.990
   80    HZ   PHE   7           HZ       PHE   7  -5.749  -2.801   6.686
   81    H    ASP   8           HN       ASP   8 -10.731   3.013   3.286
   82    HA   ASP   8           HA       ASP   8  -8.450   4.124   2.313
   83   1HB   ASP   8          HB2       ASP   8 -10.678   5.195   2.242
   84   2HB   ASP   8          HB1       ASP   8 -10.526   5.594   3.950
   85    H    PHE   9           HN       PHE   9  -6.685   5.226   3.065
   86    HA   PHE   9           HA       PHE   9  -6.316   5.336   5.982
   87   1HB   PHE   9          HB2       PHE   9  -5.083   3.409   5.020
   88   2HB   PHE   9          HB1       PHE   9  -4.207   4.519   3.972
   89    HD1  PHE   9           HD1      PHE   9  -5.043   4.319   7.609
   90    HD2  PHE   9           HD2      PHE   9  -2.065   4.950   4.635
   91    HE1  PHE   9           HE1      PHE   9  -3.357   4.646   9.372
   92    HE2  PHE   9           HE2      PHE   9  -0.374   5.277   6.392
   93    HZ   PHE   9           HZ       PHE   9  -1.019   5.125   8.764
   94    H    GLN  10           HN       GLN  10  -5.583   7.222   6.745
   95    HA   GLN  10           HA       GLN  10  -4.991   9.337   4.825
   96   1HB   GLN  10          HB2       GLN  10  -6.542   9.364   7.030
   97   2HB   GLN  10          HB1       GLN  10  -5.028   9.920   7.730
   98   1HG   GLN  10          HG2       GLN  10  -5.404  11.362   5.338
   99   2HG   GLN  10          HG1       GLN  10  -6.944  11.368   6.196
  100   1HE2  GLN  10          HE21      GLN  10  -3.497  11.643   7.011
  101   2HE2  GLN  10          HE22      GLN  10  -3.677  13.010   8.051
  102    H    ALA  11           HN       ALA  11  -2.956   9.740   4.292
  103    HA   ALA  11           HA       ALA  11  -0.712   8.614   5.504
  104   1HB   ALA  11          HB1       ALA  11  -0.516   9.345   3.267
  105   2HB   ALA  11          HB2       ALA  11   0.564  10.370   4.212
  106   3HB   ALA  11          HB3       ALA  11  -1.001  10.989   3.683
  107    H    GLN  12           HN       GLN  12  -0.138   8.948   7.555
  108    HA   GLN  12           HA       GLN  12  -0.686  11.337   8.988
  109   1HB   GLN  12          HB2       GLN  12   1.404   9.385   9.872
  110   2HB   GLN  12          HB1       GLN  12   0.234  10.272  10.832
  111   1HG   GLN  12          HG2       GLN  12  -1.534   8.824   9.694
  112   2HG   GLN  12          HG1       GLN  12  -0.184   7.810   9.186
  113   1HE2  GLN  12          HE21      GLN  12  -1.024   9.521  12.182
  114   2HE2  GLN  12          HE22      GLN  12  -0.857   8.147  13.216
  115    H    SER  13           HN       SER  13   2.201   9.992   7.461
  116    HA   SER  13           HA       SER  13   3.667  12.457   8.088
  117   1HB   SER  13          HB2       SER  13   4.561  10.027   8.520
  118   2HB   SER  13          HB1       SER  13   4.941  10.069   6.799
  119    HG   SER  13           HG       SER  13   5.877  11.810   8.829
  120    HA   PRO  14           HA       PRO  14   3.466  14.138   4.027
  121   1HB   PRO  14          HB2       PRO  14   6.426  14.413   4.132
  122   2HB   PRO  14          HB1       PRO  14   5.191  15.640   3.830
  123   1HG   PRO  14          HG2       PRO  14   6.455  15.534   6.172
  124   2HG   PRO  14          HG1       PRO  14   4.725  15.917   6.086
  125   1HD   PRO  14          HD2       PRO  14   6.067  13.365   6.874
  126   2HD   PRO  14          HD1       PRO  14   4.608  14.126   7.541
  127    H    LYS  15           HN       LYS  15   5.848  11.651   4.700
  128    HA   LYS  15           HA       LYS  15   6.373  11.064   1.938
  129   1HB   LYS  15          HB2       LYS  15   7.669   9.189   2.780
  130   2HB   LYS  15          HB1       LYS  15   8.044  10.639   3.701
  131   1HG   LYS  15          HG2       LYS  15   6.168   9.690   5.294
  132   2HG   LYS  15          HG1       LYS  15   6.636   8.165   4.540
  133   1HD   LYS  15          HD2       LYS  15   8.702  10.029   5.654
  134   2HD   LYS  15          HD1       LYS  15   7.837   8.905   6.704
  135   1HE   LYS  15          HE2       LYS  15   9.079   7.875   4.199
  136   2HE   LYS  15          HE1       LYS  15  10.118   8.235   5.577
  137   1HZ   LYS  15          HZ1       LYS  15   8.049   6.177   5.296
  138   2HZ   LYS  15          HZ2       LYS  15   8.329   6.826   6.832
  139   3HZ   LYS  15          HZ3       LYS  15   9.588   6.070   5.993
  140    H    GLU  16           HN       GLU  16   4.120   9.977   4.360
  141    HA   GLU  16           HA       GLU  16   3.355   7.546   3.144
  142   1HB   GLU  16          HB2       GLU  16   2.155   9.368   5.185
  143   2HB   GLU  16          HB1       GLU  16   1.150   8.108   4.483
  144   1HG   GLU  16          HG2       GLU  16   3.099   6.533   5.116
  145   2HG   GLU  16          HG1       GLU  16   3.591   7.846   6.185
  146    H    LEU  17           HN       LEU  17   1.093   7.172   2.289
  147    HA   LEU  17           HA       LEU  17   0.203   9.412   0.604
  148   1HB   LEU  17          HB2       LEU  17   1.627   7.732  -0.636
  149   2HB   LEU  17          HB1       LEU  17   0.358   6.557  -0.347
  150    HG   LEU  17           HG       LEU  17  -1.158   8.382  -1.497
  151   1HD1  LEU  17          HD11      LEU  17   1.512   8.939  -2.772
  152   2HD1  LEU  17          HD12      LEU  17   0.727  10.013  -1.615
  153   3HD1  LEU  17          HD13      LEU  17  -0.043   9.674  -3.165
  154   1HD2  LEU  17          HD21      LEU  17  -1.118   7.082  -3.389
  155   2HD2  LEU  17          HD22      LEU  17  -0.364   5.994  -2.224
  156   3HD2  LEU  17          HD23      LEU  17   0.636   6.900  -3.360
  157    H    THR  18           HN       THR  18  -1.955   9.682   0.449
  158    HA   THR  18           HA       THR  18  -3.633   7.868   2.019
  159    HB   THR  18           HB       THR  18  -4.194  10.641   0.948
  160    HG1  THR  18           HG1      THR  18  -2.772  10.810   2.612
  161   1HG2  THR  18          HG21      THR  18  -6.219   9.163   1.303
  162   2HG2  THR  18          HG22      THR  18  -6.185  10.695   2.177
  163   3HG2  THR  18          HG23      THR  18  -5.805   9.191   3.017
  164    H    LEU  19           HN       LEU  19  -5.004   6.498   1.080
  165    HA   LEU  19           HA       LEU  19  -6.018   7.085  -1.600
  166   1HB   LEU  19          HB2       LEU  19  -5.533   4.816  -2.377
  167   2HB   LEU  19          HB1       LEU  19  -4.069   5.698  -1.989
  168    HG   LEU  19           HG       LEU  19  -5.341   3.727  -0.097
  169   1HD1  LEU  19          HD11      LEU  19  -3.185   2.418  -0.948
  170   2HD1  LEU  19          HD12      LEU  19  -3.560   3.307  -2.424
  171   3HD1  LEU  19          HD13      LEU  19  -4.767   2.238  -1.708
  172   1HD2  LEU  19          HD21      LEU  19  -2.718   3.781   0.489
  173   2HD2  LEU  19          HD22      LEU  19  -3.908   4.836   1.251
  174   3HD2  LEU  19          HD23      LEU  19  -2.934   5.433  -0.092
  175    H    GLN  20           HN       GLN  20  -7.906   5.857  -2.179
  176    HA   GLN  20           HA       GLN  20  -9.459   5.091   0.186
  177   1HB   GLN  20          HB2       GLN  20 -10.111   6.801  -1.801
  178   2HB   GLN  20          HB1       GLN  20 -10.790   5.314  -2.449
  179   1HG   GLN  20          HG2       GLN  20 -11.435   5.751   0.359
  180   2HG   GLN  20          HG1       GLN  20 -12.030   7.022  -0.709
  181   1HE2  GLN  20          HE21      GLN  20 -13.840   6.668  -1.807
  182   2HE2  GLN  20          HE22      GLN  20 -14.644   5.146  -1.952
  183    H    LYS  21           HN       LYS  21 -11.062   3.309  -0.126
  184    HA   LYS  21           HA       LYS  21  -9.801   0.901  -0.692
  185   1HB   LYS  21          HB2       LYS  21 -12.116   1.572   0.510
  186   2HB   LYS  21          HB1       LYS  21 -12.746   0.973  -1.018
  187   1HG   LYS  21          HG2       LYS  21 -11.062  -1.018  -0.444
  188   2HG   LYS  21          HG1       LYS  21 -11.429  -0.469   1.193
  189   1HD   LYS  21          HD2       LYS  21 -13.602  -0.992  -0.810
  190   2HD   LYS  21          HD1       LYS  21 -12.921  -2.292   0.170
  191   1HE   LYS  21          HE2       LYS  21 -13.639   0.087   1.707
  192   2HE   LYS  21          HE1       LYS  21 -15.009  -0.669   0.894
  193   1HZ   LYS  21          HZ1       LYS  21 -13.277  -1.744   3.003
  194   2HZ   LYS  21          HZ2       LYS  21 -13.974  -2.822   1.902
  195   3HZ   LYS  21          HZ3       LYS  21 -14.960  -1.825   2.847
  196    H    GLY  22           HN       GLY  22 -10.063  -0.632  -2.375
  197   1HA   GLY  22          HA2       GLY  22 -10.639  -1.353  -4.526
  198   2HA   GLY  22          HA1       GLY  22 -11.348   0.229  -4.840
  199    H    ASP  23           HN       ASP  23  -8.473   1.008  -3.575
  200    HA   ASP  23           HA       ASP  23  -7.297   1.386  -6.210
  201   1HB   ASP  23          HB2       ASP  23  -6.681   2.502  -3.479
  202   2HB   ASP  23          HB1       ASP  23  -5.602   2.748  -4.849
  203    H    ILE  24           HN       ILE  24  -5.588   0.307  -6.971
  204    HA   ILE  24           HA       ILE  24  -4.203  -1.542  -5.139
  205    HB   ILE  24           HB       ILE  24  -3.713  -2.936  -7.117
  206   1HG1  ILE  24          HG12      ILE  24  -5.700  -2.025  -8.925
  207   2HG1  ILE  24          HG11      ILE  24  -4.713  -0.629  -8.505
  208   1HG2  ILE  24          HG21      ILE  24  -6.342  -3.360  -7.561
  209   2HG2  ILE  24          HG22      ILE  24  -6.414  -2.417  -6.073
  210   3HG2  ILE  24          HG23      ILE  24  -5.481  -3.913  -6.125
  211   1HD1  ILE  24          HD11      ILE  24  -3.989  -3.096  -9.974
  212   2HD1  ILE  24          HD12      ILE  24  -2.749  -2.325  -8.984
  213   3HD1  ILE  24          HD13      ILE  24  -3.537  -1.419 -10.276
  214    H    VAL  25           HN       VAL  25  -2.010  -1.516  -5.052
  215    HA   VAL  25           HA       VAL  25  -0.572   0.195  -6.962
  216    HB   VAL  25           HB       VAL  25   0.837   1.056  -5.117
  217   1HG1  VAL  25          HG11      VAL  25  -0.942   2.446  -5.942
  218   2HG1  VAL  25          HG12      VAL  25  -0.859   2.613  -4.188
  219   3HG1  VAL  25          HG13      VAL  25  -2.118   1.618  -4.921
  220   1HG2  VAL  25          HG21      VAL  25  -1.192   0.263  -3.104
  221   2HG2  VAL  25          HG22      VAL  25   0.539   0.543  -2.919
  222   3HG2  VAL  25          HG23      VAL  25  -0.040  -0.965  -3.626
  223    H    TYR  26           HN       TYR  26   1.842  -0.120  -6.780
  224    HA   TYR  26           HA       TYR  26   2.381  -2.983  -6.687
  225   1HB   TYR  26          HB2       TYR  26   3.061  -1.718  -8.686
  226   2HB   TYR  26          HB1       TYR  26   4.095  -0.700  -7.690
  227    HD1  TYR  26           HD1      TYR  26   6.167  -1.598  -6.726
  228    HD2  TYR  26           HD2      TYR  26   3.724  -3.951  -9.294
  229    HE1  TYR  26           HE1      TYR  26   8.024  -3.180  -7.034
  230    HE2  TYR  26           HE2      TYR  26   5.573  -5.541  -9.608
  231    HH   TYR  26           HH       TYR  26   8.398  -5.480  -7.676
  232    H    ILE  27           HN       ILE  27   3.190  -3.861  -4.915
  233    HA   ILE  27           HA       ILE  27   4.376  -2.234  -2.846
  234    HB   ILE  27           HB       ILE  27   4.063  -5.237  -2.935
  235   1HG1  ILE  27          HG12      ILE  27   2.151  -4.632  -1.288
  236   2HG1  ILE  27          HG11      ILE  27   2.242  -3.030  -2.015
  237   1HG2  ILE  27          HG21      ILE  27   4.194  -4.962  -0.428
  238   2HG2  ILE  27          HG22      ILE  27   4.756  -3.317  -0.726
  239   3HG2  ILE  27          HG23      ILE  27   5.695  -4.690  -1.313
  240   1HD1  ILE  27          HD11      ILE  27   0.701  -5.082  -2.907
  241   2HD1  ILE  27          HD12      ILE  27   2.113  -5.201  -3.956
  242   3HD1  ILE  27          HD13      ILE  27   1.204  -3.692  -3.869
  243    H    HIS  28           HN       HIS  28   6.475  -2.187  -2.209
  244    HA   HIS  28           HA       HIS  28   8.402  -3.504  -3.996
  245   1HB   HIS  28          HB2       HIS  28   8.197  -0.866  -3.464
  246   2HB   HIS  28          HB1       HIS  28   9.316  -1.345  -2.192
  247    HD1  HIS  28           HD1      HIS  28  11.674  -2.105  -2.908
  248    HD2  HIS  28           HD2      HIS  28   9.220  -1.002  -6.074
  249    HE1  HIS  28           HE1      HIS  28  13.197  -1.901  -4.899
  250    HE2  HIS  28           HE2      HIS  28  11.701  -1.162  -6.787
  251    H    LYS  29           HN       LYS  29   7.654  -2.811  -0.609
  252    HA   LYS  29           HA       LYS  29   9.178  -5.183   0.148
  253   1HB   LYS  29          HB2       LYS  29  10.237  -3.992   2.047
  254   2HB   LYS  29          HB1       LYS  29  10.791  -3.414   0.482
  255   1HG   LYS  29          HG2       LYS  29  10.147  -1.347   0.940
  256   2HG   LYS  29          HG1       LYS  29   8.525  -1.887   1.372
  257   1HD   LYS  29          HD2       LYS  29   9.321  -2.457   3.620
  258   2HD   LYS  29          HD1       LYS  29  10.938  -1.902   3.184
  259   1HE   LYS  29          HE2       LYS  29   9.924   0.341   2.687
  260   2HE   LYS  29          HE1       LYS  29   8.421  -0.259   3.388
  261   1HZ   LYS  29          HZ1       LYS  29  10.774  -0.620   5.036
  262   2HZ   LYS  29          HZ2       LYS  29   9.226  -0.089   5.460
  263   3HZ   LYS  29          HZ3       LYS  29  10.332   0.992   4.776
  264    H    GLU  30           HN       GLU  30   8.349  -6.252   1.910
  265    HA   GLU  30           HA       GLU  30   5.863  -5.122   3.012
  266   1HB   GLU  30          HB2       GLU  30   6.543  -8.048   2.826
  267   2HB   GLU  30          HB1       GLU  30   4.986  -7.327   3.210
  268   1HG   GLU  30          HG2       GLU  30   4.446  -7.041   1.061
  269   2HG   GLU  30          HG1       GLU  30   6.071  -6.519   0.619
  270    H    VAL  31           HN       VAL  31   6.400  -4.228   4.870
  271    HA   VAL  31           HA       VAL  31   8.083  -5.733   6.735
  272    HB   VAL  31           HB       VAL  31   7.043  -3.096   7.543
  273   1HG1  VAL  31          HG11      VAL  31   9.916  -3.760   7.607
  274   2HG1  VAL  31          HG12      VAL  31   8.848  -4.781   8.571
  275   3HG1  VAL  31          HG13      VAL  31   8.887  -3.039   8.845
  276   1HG2  VAL  31          HG21      VAL  31   8.679  -1.840   6.236
  277   2HG2  VAL  31          HG22      VAL  31   7.549  -2.677   5.174
  278   3HG2  VAL  31          HG23      VAL  31   9.172  -3.321   5.416
  279    H    ASP  32           HN       ASP  32   6.802  -7.221   7.573
  280    HA   ASP  32           HA       ASP  32   4.084  -6.977   8.189
  281   1HB   ASP  32          HB2       ASP  32   5.793  -9.057   8.101
  282   2HB   ASP  32          HB1       ASP  32   5.687  -8.840   9.845
  283    H    LYS  33           HN       LYS  33   6.829  -5.764   9.839
  284    HA   LYS  33           HA       LYS  33   5.900  -5.778  12.489
  285   1HB   LYS  33          HB2       LYS  33   8.126  -4.752  11.102
  286   2HB   LYS  33          HB1       LYS  33   7.386  -3.372  11.901
  287   1HG   LYS  33          HG2       LYS  33   8.293  -5.924  13.216
  288   2HG   LYS  33          HG1       LYS  33   9.081  -4.348  13.313
  289   1HD   LYS  33          HD2       LYS  33   7.641  -3.591  14.866
  290   2HD   LYS  33          HD1       LYS  33   6.250  -4.335  14.076
  291   1HE   LYS  33          HE2       LYS  33   7.151  -6.552  14.960
  292   2HE   LYS  33          HE1       LYS  33   8.206  -5.582  15.986
  293   1HZ   LYS  33          HZ1       LYS  33   5.341  -6.021  16.162
  294   2HZ   LYS  33          HZ2       LYS  33   5.859  -4.443  16.485
  295   3HZ   LYS  33          HZ3       LYS  33   6.472  -5.736  17.388
  296    H    ASN  34           HN       ASN  34   5.674  -3.266   9.977
  297    HA   ASN  34           HA       ASN  34   3.079  -2.516  10.316
  298   1HB   ASN  34          HB2       ASN  34   4.611  -1.710  12.606
  299   2HB   ASN  34          HB1       ASN  34   4.066  -0.273  11.749
  300   1HD2  ASN  34          HD21      ASN  34   1.894   0.188  11.637
  301   2HD2  ASN  34          HD22      ASN  34   0.714  -0.629  12.598
  302    H    TRP  35           HN       TRP  35   5.086  -2.574   8.300
  303    HA   TRP  35           HA       TRP  35   4.631   0.018   7.138
  304   1HB   TRP  35          HB2       TRP  35   7.049  -0.433   8.548
  305   2HB   TRP  35          HB1       TRP  35   7.443  -0.403   6.833
  306    HD1  TRP  35           HD1      TRP  35   5.325   1.838   5.948
  307    HE1  TRP  35           HE1      TRP  35   5.749   4.286   6.618
  308    HE3  TRP  35           HE3      TRP  35   8.511   1.067   9.871
  309    HZ2  TRP  35           HZ2      TRP  35   7.237   5.703   8.554
  310    HZ3  TRP  35           HZ3      TRP  35   9.390   3.022  11.079
  311    HH2  TRP  35           HH2      TRP  35   8.765   5.292  10.432
  312    H    LEU  36           HN       LEU  36   5.497   0.166   4.912
  313    HA   LEU  36           HA       LEU  36   6.441  -2.127   3.535
  314   1HB   LEU  36          HB2       LEU  36   4.571  -2.923   2.460
  315   2HB   LEU  36          HB1       LEU  36   3.899  -2.527   4.030
  316    HG   LEU  36           HG       LEU  36   3.398  -0.216   2.833
  317   1HD1  LEU  36          HD11      LEU  36   2.548  -1.132   0.461
  318   2HD1  LEU  36          HD12      LEU  36   4.018  -2.088   0.654
  319   3HD1  LEU  36          HD13      LEU  36   4.098  -0.327   0.708
  320   1HD2  LEU  36          HD21      LEU  36   1.248  -1.596   1.932
  321   2HD2  LEU  36          HD22      LEU  36   1.485  -1.110   3.611
  322   3HD2  LEU  36          HD23      LEU  36   1.918  -2.741   3.095
  323    H    GLU  37           HN       GLU  37   6.603  -1.672   1.160
  324    HA   GLU  37           HA       GLU  37   6.707   1.238   0.708
  325   1HB   GLU  37          HB2       GLU  37   8.913   0.189   0.722
  326   2HB   GLU  37          HB1       GLU  37   8.403  -0.934  -0.531
  327   1HG   GLU  37          HG2       GLU  37   9.442   0.565  -1.855
  328   2HG   GLU  37          HG1       GLU  37   7.870   1.359  -1.785
  329    H    GLY  38           HN       GLY  38   5.658   2.112  -0.961
  330   1HA   GLY  38          HA2       GLY  38   4.726   0.410  -3.149
  331   2HA   GLY  38          HA1       GLY  38   3.505   1.243  -2.199
  332    H    GLU  39           HN       GLU  39   3.881   1.611  -4.969
  333    HA   GLU  39           HA       GLU  39   4.326   4.481  -4.993
  334   1HB   GLU  39          HB2       GLU  39   6.148   2.530  -6.241
  335   2HB   GLU  39          HB1       GLU  39   5.647   3.848  -7.291
  336   1HG   GLU  39          HG2       GLU  39   6.893   5.349  -6.205
  337   2HG   GLU  39          HG1       GLU  39   6.468   4.701  -4.621
  338    H    HIS  40           HN       HIS  40   3.382   5.535  -6.816
  339    HA   HIS  40           HA       HIS  40   1.825   3.888  -8.649
  340   1HB   HIS  40          HB2       HIS  40  -0.266   5.033  -8.166
  341   2HB   HIS  40          HB1       HIS  40   0.351   4.275  -6.702
  342    HD1  HIS  40           HD1      HIS  40  -1.338   7.162  -7.541
  343    HD2  HIS  40           HD2      HIS  40   2.147   6.500  -5.377
  344    HE1  HIS  40           HE1      HIS  40  -1.037   9.208  -6.110
  345    HE2  HIS  40           HE2      HIS  40   1.120   8.819  -4.867
  346    H    HIS  41           HN       HIS  41   1.921   4.678 -10.637
  347    HA   HIS  41           HA       HIS  41   2.424   6.039 -12.391
  348   1HB   HIS  41          HB2       HIS  41   0.320   7.126 -11.088
  349   2HB   HIS  41          HB1       HIS  41   1.454   8.470 -11.009
  350    HD1  HIS  41           HD1      HIS  41   2.682   7.668 -13.921
  351    HD2  HIS  41           HD2      HIS  41  -1.272   8.502 -12.951
  352    HE1  HIS  41           HE1      HIS  41   1.600   8.394 -16.073
  353    HE2  HIS  41           HE2      HIS  41  -0.770   8.974 -15.444
  354    H    GLY  42           HN       GLY  42   4.551   5.678 -10.550
  355   1HA   GLY  42          HA2       GLY  42   6.730   6.490 -10.520
  356   2HA   GLY  42          HA1       GLY  42   6.164   7.961 -11.294
  357    H    ARG  43           HN       ARG  43   4.055   7.806  -8.912
  358    HA   ARG  43           HA       ARG  43   5.534   9.645  -7.260
  359   1HB   ARG  43          HB2       ARG  43   2.896   9.424  -7.927
  360   2HB   ARG  43          HB1       ARG  43   2.901   8.732  -6.311
  361   1HG   ARG  43          HG2       ARG  43   4.213  11.365  -6.851
  362   2HG   ARG  43          HG1       ARG  43   2.473  11.252  -6.585
  363   1HD   ARG  43          HD2       ARG  43   3.514   9.741  -4.535
  364   2HD   ARG  43          HD1       ARG  43   4.678  11.057  -4.686
  365    HE   ARG  43           HE       ARG  43   2.059  11.226  -3.612
  366   1HH1  ARG  43          HH11      ARG  43   4.383  13.016  -5.502
  367   2HH1  ARG  43          HH12      ARG  43   3.764  14.562  -5.029
  368   1HH2  ARG  43          HH21      ARG  43   1.242  13.259  -2.990
  369   2HH2  ARG  43          HH22      ARG  43   1.980  14.701  -3.604
  370    H    LEU  44           HN       LEU  44   5.767   9.421  -4.955
  371    HA   LEU  44           HA       LEU  44   6.304   6.646  -4.198
  372   1HB   LEU  44          HB2       LEU  44   8.158   8.178  -3.952
  373   2HB   LEU  44          HB1       LEU  44   7.179   9.268  -2.989
  374    HG   LEU  44           HG       LEU  44   7.118   6.765  -1.676
  375   1HD1  LEU  44          HD11      LEU  44   9.968   7.482  -1.786
  376   2HD1  LEU  44          HD12      LEU  44   9.327   6.685  -3.223
  377   3HD1  LEU  44          HD13      LEU  44   9.195   5.903  -1.648
  378   1HD2  LEU  44          HD21      LEU  44   8.531   9.360  -1.083
  379   2HD2  LEU  44          HD22      LEU  44   8.364   8.034   0.068
  380   3HD2  LEU  44          HD23      LEU  44   6.930   8.863  -0.536
  381    H    GLY  45           HN       GLY  45   5.101   5.589  -2.762
  382   1HA   GLY  45          HA2       GLY  45   3.501   7.096  -0.827
  383   2HA   GLY  45          HA1       GLY  45   2.654   6.018  -1.925
  384    H    ILE  46           HN       ILE  46   4.138   6.281   1.052
  385    HA   ILE  46           HA       ILE  46   4.395   3.352   1.284
  386    HB   ILE  46           HB       ILE  46   5.824   5.495   2.868
  387   1HG1  ILE  46          HG12      ILE  46   6.855   3.538   0.804
  388   2HG1  ILE  46          HG11      ILE  46   6.638   5.269   0.560
  389   1HG2  ILE  46          HG21      ILE  46   6.362   3.966   4.383
  390   2HG2  ILE  46          HG22      ILE  46   6.962   2.879   3.132
  391   3HG2  ILE  46          HG23      ILE  46   5.264   2.839   3.593
  392   1HD1  ILE  46          HD11      ILE  46   8.963   4.726   0.963
  393   2HD1  ILE  46          HD12      ILE  46   8.538   3.981   2.504
  394   3HD1  ILE  46          HD13      ILE  46   8.319   5.715   2.273
  395    H    PHE  47           HN       PHE  47   3.523   2.343   3.115
  396    HA   PHE  47           HA       PHE  47   2.195   3.863   5.162
  397   1HB   PHE  47          HB2       PHE  47  -0.050   2.689   4.610
  398   2HB   PHE  47          HB1       PHE  47   0.398   4.126   3.697
  399    HD1  PHE  47           HD2      PHE  47   1.393   3.840   1.405
  400    HD2  PHE  47           HD1      PHE  47  -0.429   0.641   3.540
  401    HE1  PHE  47           HE2      PHE  47   1.147   2.583  -0.696
  402    HE2  PHE  47           HE1      PHE  47  -0.677  -0.622   1.443
  403    HZ   PHE  47           HZ       PHE  47   0.111   0.349  -0.679
  404    HA   PRO  48           HA       PRO  48   2.803   0.306   7.671
  405   1HB   PRO  48          HB2       PRO  48  -0.070   0.414   8.428
  406   2HB   PRO  48          HB1       PRO  48   1.367   0.434   9.457
  407   1HG   PRO  48          HG2       PRO  48  -0.038   2.657   9.044
  408   2HG   PRO  48          HG1       PRO  48   1.734   2.701   9.127
  409   1HD   PRO  48          HD2       PRO  48  -0.058   2.837   6.738
  410   2HD   PRO  48          HD1       PRO  48   1.461   3.698   7.060
  411    H    ALA  49           HN       ALA  49   2.791  -1.847   7.341
  412    HA   ALA  49           HA       ALA  49   1.458  -2.969   5.130
  413   1HB   ALA  49          HB1       ALA  49   3.585  -3.710   6.593
  414   2HB   ALA  49          HB2       ALA  49   2.718  -4.803   5.514
  415   3HB   ALA  49          HB3       ALA  49   2.372  -4.814   7.243
  416    H    ASN  50           HN       ASN  50   0.594  -2.695   8.491
  417    HA   ASN  50           HA       ASN  50  -1.375  -4.715   8.583
  418   1HB   ASN  50          HB2       ASN  50  -0.270  -2.888  10.381
  419   2HB   ASN  50          HB1       ASN  50  -1.975  -2.455  10.305
  420   1HD2  ASN  50          HD21      ASN  50   0.338  -4.842  11.240
  421   2HD2  ASN  50          HD22      ASN  50  -0.752  -5.863  12.109
  422    H    TYR  51           HN       TYR  51  -1.365  -1.560   7.194
  423    HA   TYR  51           HA       TYR  51  -4.285  -1.492   7.038
  424   1HB   TYR  51          HB2       TYR  51  -2.149   0.546   6.430
  425   2HB   TYR  51          HB1       TYR  51  -3.833   0.786   5.978
  426    HD1  TYR  51           HD1      TYR  51  -1.872  -0.225   9.002
  427    HD2  TYR  51           HD2      TYR  51  -5.120   2.026   7.427
  428    HE1  TYR  51           HE1      TYR  51  -2.345   0.653  11.250
  429    HE2  TYR  51           HE2      TYR  51  -5.602   2.911   9.670
  430    HH   TYR  51           HH       TYR  51  -3.574   2.935  12.114
  431    H    VAL  52           HN       VAL  52  -2.684  -3.434   5.525
  432    HA   VAL  52           HA       VAL  52  -3.897  -2.963   2.945
  433    HB   VAL  52           HB       VAL  52  -1.742  -1.827   2.670
  434   1HG1  VAL  52          HG11      VAL  52  -0.119  -2.687   3.984
  435   2HG1  VAL  52          HG12      VAL  52   0.230  -3.638   2.541
  436   3HG1  VAL  52          HG13      VAL  52  -0.726  -4.337   3.847
  437   1HG2  VAL  52          HG21      VAL  52  -1.556  -4.386   1.122
  438   2HG2  VAL  52          HG22      VAL  52  -1.216  -2.738   0.593
  439   3HG2  VAL  52          HG23      VAL  52  -2.882  -3.255   0.853
  440    H    GLU  53           HN       GLU  53  -3.915  -4.851   1.595
  441    HA   GLU  53           HA       GLU  53  -3.263  -7.341   3.029
  442   1HB   GLU  53          HB2       GLU  53  -5.679  -6.874   1.272
  443   2HB   GLU  53          HB1       GLU  53  -5.286  -8.358   2.129
  444   1HG   GLU  53          HG2       GLU  53  -5.407  -6.049   3.886
  445   2HG   GLU  53          HG1       GLU  53  -6.919  -6.337   3.027
  446    H    VAL  54           HN       VAL  54  -1.850  -8.550   1.967
  447    HA   VAL  54           HA       VAL  54  -1.135  -7.968  -0.750
  448    HB   VAL  54           HB       VAL  54   0.563  -8.650   0.888
  449   1HG1  VAL  54          HG11      VAL  54   0.504 -10.542   2.106
  450   2HG1  VAL  54          HG12      VAL  54  -0.159 -11.499   0.781
  451   3HG1  VAL  54          HG13      VAL  54  -1.223 -10.484   1.754
  452   1HG2  VAL  54          HG21      VAL  54   0.449  -9.337  -1.724
  453   2HG2  VAL  54          HG22      VAL  54   0.683 -10.919  -0.982
  454   3HG2  VAL  54          HG23      VAL  54   1.845  -9.626  -0.687
  455    H    LEU  55           HN       LEU  55  -2.263  -8.669  -2.433
  456    HA   LEU  55           HA       LEU  55  -2.862 -11.426  -2.800
  457   1HB   LEU  55          HB2       LEU  55  -5.374 -10.967  -3.110
  458   2HB   LEU  55          HB1       LEU  55  -4.759 -11.198  -1.485
  459    HG   LEU  55           HG       LEU  55  -4.589  -8.455  -1.853
  460   1HD1  LEU  55          HD11      LEU  55  -6.206  -7.691  -3.177
  461   2HD1  LEU  55          HD12      LEU  55  -7.385  -8.832  -2.531
  462   3HD1  LEU  55          HD13      LEU  55  -6.304  -9.324  -3.834
  463   1HD2  LEU  55          HD21      LEU  55  -5.542 -10.128   0.009
  464   2HD2  LEU  55          HD22      LEU  55  -7.065  -9.525  -0.647
  465   3HD2  LEU  55          HD23      LEU  55  -5.877  -8.396   0.005
  466    HA   PRO  56           HA       PRO  56  -2.071  -8.915  -6.626
  467   1HB   PRO  56          HB2       PRO  56  -1.056 -11.597  -7.409
  468   2HB   PRO  56          HB1       PRO  56  -0.317 -10.006  -7.624
  469   1HG   PRO  56          HG2       PRO  56   0.596 -11.689  -5.772
  470   2HG   PRO  56          HG1       PRO  56   0.501  -9.947  -5.453
  471   1HD   PRO  56          HD2       PRO  56  -1.298 -12.145  -4.522
  472   2HD   PRO  56          HD1       PRO  56  -0.738 -10.701  -3.653
  473    H    LEU  57           HN       LEU  57  -3.563  -8.722  -8.174
  474    HA   LEU  57           HA       LEU  57  -5.432 -10.945  -8.592
  475   1HB   LEU  57          HB2       LEU  57  -5.680  -8.017  -9.283
  476   2HB   LEU  57          HB1       LEU  57  -6.902  -9.231  -9.610
  477    HG   LEU  57           HG       LEU  57  -6.691  -9.618  -6.985
  478   1HD1  LEU  57          HD11      LEU  57  -6.243  -6.664  -7.114
  479   2HD1  LEU  57          HD12      LEU  57  -4.879  -7.776  -6.998
  480   3HD1  LEU  57          HD13      LEU  57  -6.111  -7.757  -5.736
  481   1HD2  LEU  57          HD21      LEU  57  -8.333  -7.805  -8.645
  482   2HD2  LEU  57          HD22      LEU  57  -8.429  -7.588  -6.898
  483   3HD2  LEU  57          HD23      LEU  57  -8.815  -9.152  -7.614
  484    H    GLU  58           HN       GLU  58  -5.337 -12.099 -10.395
  485    HA   GLU  58           HA       GLU  58  -4.769 -10.955 -12.946
  486   1HB   GLU  58          HB2       GLU  58  -2.576 -12.110 -11.411
  487   2HB   GLU  58          HB1       GLU  58  -2.789 -12.903 -12.966
  488   1HG   GLU  58          HG2       GLU  58  -2.969 -10.217 -13.575
  489   2HG   GLU  58          HG1       GLU  58  -1.711 -10.287 -12.341
  Start of MODEL   15
    1   1H    MET   0          HT1       MET   0   5.411  -6.028 -10.904
    2   2H    MET   0          HT2       MET   0   5.260  -5.701  -9.226
    3   3H    MET   0          HT3       MET   0   3.857  -5.917 -10.190
    4    HA   MET   0           HA       MET   0   4.713  -8.186 -10.682
    5   1HB   MET   0          HB2       MET   0   6.676  -7.141  -8.722
    6   2HB   MET   0          HB1       MET   0   6.144  -8.798  -8.474
    7   1HG   MET   0          HG2       MET   0   7.496  -9.513 -10.064
    8   2HG   MET   0          HG1       MET   0   6.751  -8.426 -11.234
    9   1HE   MET   0          HE1       MET   0  10.780  -8.081  -9.225
   10   2HE   MET   0          HE2       MET   0   9.640  -9.426  -9.235
   11   3HE   MET   0          HE3       MET   0   9.415  -8.088  -8.109
   12    H    LYS   1           HN       LYS   1   4.321  -6.529  -7.557
   13    HA   LYS   1           HA       LYS   1   2.089  -8.363  -6.970
   14   1HB   LYS   1          HB2       LYS   1   4.413  -7.582  -5.345
   15   2HB   LYS   1          HB1       LYS   1   2.874  -7.476  -4.503
   16   1HG   LYS   1          HG2       LYS   1   3.289  -9.630  -4.032
   17   2HG   LYS   1          HG1       LYS   1   2.615  -9.899  -5.640
   18   1HD   LYS   1          HD2       LYS   1   5.347  -9.291  -5.995
   19   2HD   LYS   1          HD1       LYS   1   5.253 -10.451  -4.669
   20   1HE   LYS   1          HE2       LYS   1   3.849 -10.834  -7.304
   21   2HE   LYS   1          HE1       LYS   1   5.473 -11.439  -6.978
   22   1HZ   LYS   1          HZ1       LYS   1   3.338 -12.116  -5.090
   23   2HZ   LYS   1          HZ2       LYS   1   4.700 -13.011  -5.543
   24   3HZ   LYS   1          HZ3       LYS   1   3.366 -12.920  -6.579
   25    H    ALA   2           HN       ALA   2   0.199  -7.479  -6.309
   26    HA   ALA   2           HA       ALA   2   0.126  -4.583  -5.806
   27   1HB   ALA   2          HB1       ALA   2  -0.579  -5.255  -8.166
   28   2HB   ALA   2          HB2       ALA   2  -1.692  -4.240  -7.249
   29   3HB   ALA   2          HB3       ALA   2  -2.003  -5.968  -7.409
   30    H    ALA   3           HN       ALA   3  -1.616  -3.859  -4.498
   31    HA   ALA   3           HA       ALA   3  -3.154  -5.952  -3.132
   32   1HB   ALA   3          HB1       ALA   3  -1.627  -3.775  -1.709
   33   2HB   ALA   3          HB2       ALA   3  -1.187  -5.482  -1.751
   34   3HB   ALA   3          HB3       ALA   3  -2.676  -4.974  -0.954
   35    H    ARG   4           HN       ARG   4  -5.198  -5.378  -2.538
   36    HA   ARG   4           HA       ARG   4  -6.105  -2.743  -3.454
   37   1HB   ARG   4          HB2       ARG   4  -7.101  -5.083  -4.172
   38   2HB   ARG   4          HB1       ARG   4  -7.997  -4.917  -2.668
   39   1HG   ARG   4          HG2       ARG   4  -9.370  -3.380  -3.523
   40   2HG   ARG   4          HG1       ARG   4  -8.057  -2.516  -4.324
   41   1HD   ARG   4          HD2       ARG   4  -9.808  -3.546  -5.835
   42   2HD   ARG   4          HD1       ARG   4  -8.129  -3.939  -6.202
   43    HE   ARG   4           HE       ARG   4  -8.562  -6.132  -5.693
   44   1HH1  ARG   4          HH11      ARG   4 -11.191  -4.154  -4.531
   45   2HH1  ARG   4          HH12      ARG   4 -12.198  -5.505  -4.132
   46   1HH2  ARG   4          HH21      ARG   4  -9.885  -7.911  -5.171
   47   2HH2  ARG   4          HH22      ARG   4 -11.456  -7.638  -4.495
   48    H    LEU   5           HN       LEU   5  -6.405  -1.227  -1.975
   49    HA   LEU   5           HA       LEU   5  -6.319  -1.669   0.796
   50   1HB   LEU   5          HB2       LEU   5  -5.985   0.498  -0.671
   51   2HB   LEU   5          HB1       LEU   5  -7.687   0.737  -0.322
   52    HG   LEU   5           HG       LEU   5  -6.875   0.336   2.170
   53   1HD1  LEU   5          HD11      LEU   5  -4.466   0.131   0.954
   54   2HD1  LEU   5          HD12      LEU   5  -4.697   0.645   2.625
   55   3HD1  LEU   5          HD13      LEU   5  -4.493   1.849   1.353
   56   1HD2  LEU   5          HD21      LEU   5  -8.021   2.319   1.425
   57   2HD2  LEU   5          HD22      LEU   5  -6.565   2.902   0.619
   58   3HD2  LEU   5          HD23      LEU   5  -6.613   2.788   2.378
   59    H    LYS   6           HN       LYS   6  -7.958  -1.430   2.391
   60    HA   LYS   6           HA       LYS   6 -10.711  -1.792   1.433
   61   1HB   LYS   6          HB2       LYS   6  -9.099  -3.624   3.114
   62   2HB   LYS   6          HB1       LYS   6 -10.767  -3.373   3.610
   63   1HG   LYS   6          HG2       LYS   6 -11.259  -3.861   1.079
   64   2HG   LYS   6          HG1       LYS   6  -9.688  -4.662   1.157
   65   1HD   LYS   6          HD2       LYS   6 -10.425  -6.245   2.674
   66   2HD   LYS   6          HD1       LYS   6 -11.747  -5.227   3.248
   67   1HE   LYS   6          HE2       LYS   6 -12.369  -5.579   0.600
   68   2HE   LYS   6          HE1       LYS   6 -11.667  -7.136   1.038
   69   1HZ   LYS   6          HZ1       LYS   6 -13.755  -7.547   1.717
   70   2HZ   LYS   6          HZ2       LYS   6 -14.151  -5.913   1.908
   71   3HZ   LYS   6          HZ3       LYS   6 -13.277  -6.716   3.112
   72    H    PHE   7           HN       PHE   7  -8.854   0.255   2.976
   73    HA   PHE   7           HA       PHE   7 -11.003   1.229   4.648
   74   1HB   PHE   7          HB2       PHE   7  -8.299   0.767   5.911
   75   2HB   PHE   7          HB1       PHE   7  -9.775   1.311   6.701
   76    HD1  PHE   7           HD2      PHE   7  -8.070  -1.573   5.186
   77    HD2  PHE   7           HD1      PHE   7 -11.433  -0.234   7.422
   78    HE1  PHE   7           HE2      PHE   7  -8.620  -3.904   5.747
   79    HE2  PHE   7           HE1      PHE   7 -11.990  -2.563   7.988
   80    HZ   PHE   7           HZ       PHE   7 -10.583  -4.402   7.150
   81    H    ASP   8           HN       ASP   8 -11.160   3.215   3.813
   82    HA   ASP   8           HA       ASP   8  -9.144   4.673   2.570
   83   1HB   ASP   8          HB2       ASP   8 -10.633   6.663   2.971
   84   2HB   ASP   8          HB1       ASP   8 -11.432   5.288   2.213
   85    H    PHE   9           HN       PHE   9  -7.295   5.338   3.430
   86    HA   PHE   9           HA       PHE   9  -7.333   6.418   6.172
   87   1HB   PHE   9          HB2       PHE   9  -5.747   4.333   5.062
   88   2HB   PHE   9          HB1       PHE   9  -4.679   5.693   5.392
   89    HD1  PHE   9           HD1      PHE   9  -7.116   3.371   6.905
   90    HD2  PHE   9           HD2      PHE   9  -4.073   6.264   7.597
   91    HE1  PHE   9           HE1      PHE   9  -7.072   2.749   9.285
   92    HE2  PHE   9           HE2      PHE   9  -4.023   5.647   9.979
   93    HZ   PHE   9           HZ       PHE   9  -5.523   3.887  10.825
   94    H    GLN  10           HN       GLN  10  -6.321   8.347   6.568
   95    HA   GLN  10           HA       GLN  10  -5.547   9.878   4.187
   96   1HB   GLN  10          HB2       GLN  10  -7.362  10.572   5.994
   97   2HB   GLN  10          HB1       GLN  10  -5.945  11.170   6.847
   98   1HG   GLN  10          HG2       GLN  10  -5.484  12.762   5.240
   99   2HG   GLN  10          HG1       GLN  10  -6.393  11.912   3.991
  100   1HE2  GLN  10          HE21      GLN  10  -6.722  14.605   4.432
  101   2HE2  GLN  10          HE22      GLN  10  -8.298  14.894   5.077
  102    H    ALA  11           HN       ALA  11  -3.434   9.928   3.810
  103    HA   ALA  11           HA       ALA  11  -1.531   9.624   5.984
  104   1HB   ALA  11          HB1       ALA  11  -1.274   9.671   2.993
  105   2HB   ALA  11          HB2       ALA  11  -0.961   8.341   4.108
  106   3HB   ALA  11          HB3       ALA  11   0.136   9.720   4.052
  107    H    GLN  12           HN       GLN  12  -0.387  11.225   6.882
  108    HA   GLN  12           HA       GLN  12  -0.708  13.921   5.775
  109   1HB   GLN  12          HB2       GLN  12   0.265  14.469   8.164
  110   2HB   GLN  12          HB1       GLN  12  -1.440  14.117   7.939
  111   1HG   GLN  12          HG2       GLN  12  -1.275  12.041   8.923
  112   2HG   GLN  12          HG1       GLN  12   0.452  11.908   8.597
  113   1HE2  GLN  12          HE21      GLN  12  -1.736  14.112  10.324
  114   2HE2  GLN  12          HE22      GLN  12  -0.769  14.225  11.751
  115    H    SER  13           HN       SER  13   1.668  11.559   6.808
  116    HA   SER  13           HA       SER  13   3.912  13.313   6.538
  117   1HB   SER  13          HB2       SER  13   3.760  11.182   7.968
  118   2HB   SER  13          HB1       SER  13   4.048  10.303   6.466
  119    HG   SER  13           HG       SER  13   5.739  12.370   7.416
  120    HA   PRO  14           HA       PRO  14   4.342  13.296   2.120
  121   1HB   PRO  14          HB2       PRO  14   7.253  13.393   2.722
  122   2HB   PRO  14          HB1       PRO  14   6.275  14.466   1.714
  123   1HG   PRO  14          HG2       PRO  14   7.113  15.248   4.118
  124   2HG   PRO  14          HG1       PRO  14   5.495  15.678   3.531
  125   1HD   PRO  14          HD2       PRO  14   6.302  13.598   5.518
  126   2HD   PRO  14          HD1       PRO  14   4.879  14.660   5.508
  127    H    LYS  15           HN       LYS  15   6.207  11.160   4.187
  128    HA   LYS  15           HA       LYS  15   7.152   9.471   2.090
  129   1HB   LYS  15          HB2       LYS  15   7.353   9.602   4.988
  130   2HB   LYS  15          HB1       LYS  15   7.145   7.950   4.424
  131   1HG   LYS  15          HG2       LYS  15   9.131   9.574   2.971
  132   2HG   LYS  15          HG1       LYS  15   9.525   9.159   4.641
  133   1HD   LYS  15          HD2       LYS  15   8.613   6.777   3.686
  134   2HD   LYS  15          HD1       LYS  15   9.384   7.458   2.253
  135   1HE   LYS  15          HE2       LYS  15  11.256   8.000   4.120
  136   2HE   LYS  15          HE1       LYS  15  10.568   6.519   4.784
  137   1HZ   LYS  15          HZ1       LYS  15  12.127   6.918   2.361
  138   2HZ   LYS  15          HZ2       LYS  15  10.858   5.806   2.251
  139   3HZ   LYS  15          HZ3       LYS  15  12.073   5.590   3.408
  140    H    GLU  16           HN       GLU  16   4.264   9.628   4.019
  141    HA   GLU  16           HA       GLU  16   3.370   6.986   3.226
  142   1HB   GLU  16          HB2       GLU  16   2.437   9.095   5.090
  143   2HB   GLU  16          HB1       GLU  16   1.197   8.062   4.392
  144   1HG   GLU  16          HG2       GLU  16   3.102   6.258   5.181
  145   2HG   GLU  16          HG1       GLU  16   3.182   7.487   6.442
  146    H    LEU  17           HN       LEU  17   1.042   6.843   2.387
  147    HA   LEU  17           HA       LEU  17   0.518   8.953   0.407
  148   1HB   LEU  17          HB2       LEU  17   1.670   6.853  -0.511
  149   2HB   LEU  17          HB1       LEU  17   0.151   6.033  -0.208
  150    HG   LEU  17           HG       LEU  17  -0.867   7.957  -1.657
  151   1HD1  LEU  17          HD11      LEU  17   1.633   8.913  -1.664
  152   2HD1  LEU  17          HD12      LEU  17   0.494   9.181  -2.982
  153   3HD1  LEU  17          HD13      LEU  17   1.704   7.905  -3.109
  154   1HD2  LEU  17          HD21      LEU  17  -1.184   5.940  -2.633
  155   2HD2  LEU  17          HD22      LEU  17   0.496   5.447  -2.418
  156   3HD2  LEU  17          HD23      LEU  17   0.059   6.540  -3.731
  157    H    THR  18           HN       THR  18  -1.578   9.526   0.173
  158    HA   THR  18           HA       THR  18  -3.499   8.253   1.967
  159    HB   THR  18           HB       THR  18  -3.720  10.807   0.361
  160    HG1  THR  18           HG1      THR  18  -2.982  11.810   2.082
  161   1HG2  THR  18          HG21      THR  18  -5.408  10.987   2.529
  162   2HG2  THR  18          HG22      THR  18  -5.671   9.351   1.923
  163   3HG2  THR  18          HG23      THR  18  -5.879  10.734   0.849
  164    H    LEU  19           HN       LEU  19  -4.938   6.838   1.253
  165    HA   LEU  19           HA       LEU  19  -6.041   7.098  -1.430
  166   1HB   LEU  19          HB2       LEU  19  -5.696   4.631  -1.815
  167   2HB   LEU  19          HB1       LEU  19  -4.261   5.631  -1.923
  168    HG   LEU  19           HG       LEU  19  -4.957   4.151   0.600
  169   1HD1  LEU  19          HD11      LEU  19  -3.534   3.152  -1.847
  170   2HD1  LEU  19          HD12      LEU  19  -4.849   2.395  -0.948
  171   3HD1  LEU  19          HD13      LEU  19  -3.234   2.477  -0.246
  172   1HD2  LEU  19          HD21      LEU  19  -2.287   4.265   0.498
  173   2HD2  LEU  19          HD22      LEU  19  -3.275   5.542   1.205
  174   3HD2  LEU  19          HD23      LEU  19  -2.669   5.707  -0.442
  175    H    GLN  20           HN       GLN  20  -8.077   6.180  -1.677
  176    HA   GLN  20           HA       GLN  20  -9.456   5.634   0.824
  177   1HB   GLN  20          HB2       GLN  20 -10.198   7.110  -1.295
  178   2HB   GLN  20          HB1       GLN  20 -10.923   5.575  -1.753
  179   1HG   GLN  20          HG2       GLN  20 -12.147   5.512   0.351
  180   2HG   GLN  20          HG1       GLN  20 -11.403   7.036   0.835
  181   1HE2  GLN  20          HE21      GLN  20 -14.227   6.264   0.385
  182   2HE2  GLN  20          HE22      GLN  20 -14.837   7.414  -0.750
  183    H    LYS  21           HN       LYS  21 -11.120   3.882   0.844
  184    HA   LYS  21           HA       LYS  21  -9.981   1.380   0.565
  185   1HB   LYS  21          HB2       LYS  21 -11.933   1.836   1.978
  186   2HB   LYS  21          HB1       LYS  21 -12.922   2.085   0.546
  187   1HG   LYS  21          HG2       LYS  21 -11.679  -0.455   0.319
  188   2HG   LYS  21          HG1       LYS  21 -12.380  -0.326   1.933
  189   1HD   LYS  21          HD2       LYS  21 -13.964   0.492  -0.473
  190   2HD   LYS  21          HD1       LYS  21 -13.837  -1.212  -0.028
  191   1HE   LYS  21          HE2       LYS  21 -14.524   0.682   2.138
  192   2HE   LYS  21          HE1       LYS  21 -15.754   0.415   0.904
  193   1HZ   LYS  21          HZ1       LYS  21 -15.532  -1.118   3.029
  194   2HZ   LYS  21          HZ2       LYS  21 -14.456  -1.947   2.022
  195   3HZ   LYS  21          HZ3       LYS  21 -16.061  -1.722   1.539
  196    H    GLY  22           HN       GLY  22  -9.802  -0.095  -1.029
  197   1HA   GLY  22          HA2       GLY  22 -10.507  -1.184  -3.025
  198   2HA   GLY  22          HA1       GLY  22 -11.348   0.292  -3.495
  199    H    ASP  23           HN       ASP  23  -8.698   1.672  -2.550
  200    HA   ASP  23           HA       ASP  23  -7.627   2.011  -5.142
  201   1HB   ASP  23          HB2       ASP  23  -6.915   2.921  -2.401
  202   2HB   ASP  23          HB1       ASP  23  -5.655   3.001  -3.628
  203    H    ILE  24           HN       ILE  24  -5.910   1.112  -6.160
  204    HA   ILE  24           HA       ILE  24  -4.535  -1.085  -4.755
  205    HB   ILE  24           HB       ILE  24  -4.206  -2.157  -6.927
  206   1HG1  ILE  24          HG12      ILE  24  -5.925  -1.043  -8.711
  207   2HG1  ILE  24          HG11      ILE  24  -5.336   0.400  -7.892
  208   1HG2  ILE  24          HG21      ILE  24  -6.285  -2.480  -5.483
  209   2HG2  ILE  24          HG22      ILE  24  -6.368  -3.025  -7.158
  210   3HG2  ILE  24          HG23      ILE  24  -7.125  -1.503  -6.688
  211   1HD1  ILE  24          HD11      ILE  24  -3.391   0.307  -8.951
  212   2HD1  ILE  24          HD12      ILE  24  -4.126  -0.913  -9.990
  213   3HD1  ILE  24          HD13      ILE  24  -3.184  -1.405  -8.582
  214    H    VAL  25           HN       VAL  25  -2.363  -1.084  -4.667
  215    HA   VAL  25           HA       VAL  25  -0.882   0.790  -6.376
  216    HB   VAL  25           HB       VAL  25   0.544   1.435  -4.469
  217   1HG1  VAL  25          HG11      VAL  25  -1.452   2.640  -3.192
  218   2HG1  VAL  25          HG12      VAL  25  -2.350   2.067  -4.598
  219   3HG1  VAL  25          HG13      VAL  25  -0.949   3.116  -4.814
  220   1HG2  VAL  25          HG21      VAL  25  -0.884   0.949  -2.204
  221   2HG2  VAL  25          HG22      VAL  25   0.506   0.004  -2.738
  222   3HG2  VAL  25          HG23      VAL  25  -1.129  -0.549  -3.102
  223    H    TYR  26           HN       TYR  26   1.227   0.191  -6.877
  224    HA   TYR  26           HA       TYR  26   1.746  -2.632  -6.767
  225   1HB   TYR  26          HB2       TYR  26   3.164  -0.279  -7.987
  226   2HB   TYR  26          HB1       TYR  26   3.924  -1.866  -7.939
  227    HD1  TYR  26           HD2      TYR  26   3.006  -3.725  -9.245
  228    HD2  TYR  26           HD1      TYR  26   1.302   0.167  -9.455
  229    HE1  TYR  26           HE2      TYR  26   1.805  -4.368 -11.292
  230    HE2  TYR  26           HE1      TYR  26   0.096  -0.465 -11.503
  231    HH   TYR  26           HH       TYR  26  -0.723  -2.580 -12.579
  232    H    ILE  27           HN       ILE  27   2.443  -3.486  -4.914
  233    HA   ILE  27           HA       ILE  27   4.102  -1.997  -3.082
  234    HB   ILE  27           HB       ILE  27   3.530  -4.932  -2.825
  235   1HG1  ILE  27          HG12      ILE  27   1.364  -4.030  -3.313
  236   2HG1  ILE  27          HG11      ILE  27   1.448  -4.261  -1.570
  237   1HG2  ILE  27          HG21      ILE  27   5.079  -3.684  -1.273
  238   2HG2  ILE  27          HG22      ILE  27   3.753  -4.555  -0.504
  239   3HG2  ILE  27          HG23      ILE  27   3.660  -2.806  -0.704
  240   1HD1  ILE  27          HD11      ILE  27   1.686  -1.676  -3.083
  241   2HD1  ILE  27          HD12      ILE  27   1.997  -1.840  -1.355
  242   3HD1  ILE  27          HD13      ILE  27   0.389  -2.176  -1.997
  243    H    HIS  28           HN       HIS  28   6.251  -2.065  -2.909
  244    HA   HIS  28           HA       HIS  28   7.763  -3.645  -4.805
  245   1HB   HIS  28          HB2       HIS  28   8.325  -1.265  -4.316
  246   2HB   HIS  28          HB1       HIS  28   8.763  -1.739  -2.678
  247    HD1  HIS  28           HD1      HIS  28   9.820  -4.281  -5.026
  248    HD2  HIS  28           HD2      HIS  28  11.350  -0.679  -3.629
  249    HE1  HIS  28           HE1      HIS  28  12.268  -4.322  -5.601
  250    HE2  HIS  28           HE2      HIS  28  13.189  -2.169  -4.671
  251    H    LYS  29           HN       LYS  29   8.217  -3.083  -1.315
  252    HA   LYS  29           HA       LYS  29   8.962  -5.922  -1.052
  253   1HB   LYS  29          HB2       LYS  29  10.324  -5.142   0.936
  254   2HB   LYS  29          HB1       LYS  29  10.925  -4.656  -0.643
  255   1HG   LYS  29          HG2       LYS  29  10.828  -2.516  -0.085
  256   2HG   LYS  29          HG1       LYS  29   9.133  -2.663   0.380
  257   1HD   LYS  29          HD2       LYS  29  10.204  -3.818   2.512
  258   2HD   LYS  29          HD1       LYS  29  11.587  -2.825   2.049
  259   1HE   LYS  29          HE2       LYS  29   9.921  -0.888   1.933
  260   2HE   LYS  29          HE1       LYS  29   8.818  -1.947   2.812
  261   1HZ   LYS  29          HZ1       LYS  29  11.361  -0.763   3.708
  262   2HZ   LYS  29          HZ2       LYS  29  10.802  -2.191   4.421
  263   3HZ   LYS  29          HZ3       LYS  29   9.861  -0.788   4.490
  264    H    GLU  30           HN       GLU  30   8.390  -6.971   0.938
  265    HA   GLU  30           HA       GLU  30   6.067  -5.721   2.250
  266   1HB   GLU  30          HB2       GLU  30   6.580  -8.681   2.013
  267   2HB   GLU  30          HB1       GLU  30   5.103  -7.885   2.541
  268   1HG   GLU  30          HG2       GLU  30   5.492  -6.849   0.029
  269   2HG   GLU  30          HG1       GLU  30   6.034  -8.518  -0.140
  270    H    VAL  31           HN       VAL  31   6.827  -4.865   4.073
  271    HA   VAL  31           HA       VAL  31   8.683  -6.404   5.721
  272    HB   VAL  31           HB       VAL  31   7.717  -3.882   6.835
  273   1HG1  VAL  31          HG11      VAL  31  10.566  -4.431   6.211
  274   2HG1  VAL  31          HG12      VAL  31   9.754  -5.466   7.386
  275   3HG1  VAL  31          HG13      VAL  31   9.838  -3.725   7.654
  276   1HG2  VAL  31          HG21      VAL  31   9.278  -3.835   4.253
  277   2HG2  VAL  31          HG22      VAL  31   9.034  -2.448   5.314
  278   3HG2  VAL  31          HG23      VAL  31   7.656  -3.194   4.508
  279    H    ASP  32           HN       ASP  32   7.474  -7.987   6.561
  280    HA   ASP  32           HA       ASP  32   4.871  -7.769   7.577
  281   1HB   ASP  32          HB2       ASP  32   6.309  -9.870   6.978
  282   2HB   ASP  32          HB1       ASP  32   6.798  -9.786   8.668
  283    H    LYS  33           HN       LYS  33   7.811  -6.652   8.895
  284    HA   LYS  33           HA       LYS  33   7.547  -6.996  11.612
  285   1HB   LYS  33          HB2       LYS  33   8.802  -4.965   9.873
  286   2HB   LYS  33          HB1       LYS  33   8.485  -4.449  11.524
  287   1HG   LYS  33          HG2       LYS  33   9.626  -6.995  11.735
  288   2HG   LYS  33          HG1       LYS  33  10.566  -6.144  10.508
  289   1HD   LYS  33          HD2       LYS  33  11.635  -5.604  12.515
  290   2HD   LYS  33          HD1       LYS  33  10.621  -4.199  12.182
  291   1HE   LYS  33          HE2       LYS  33   9.298  -4.570  13.969
  292   2HE   LYS  33          HE1       LYS  33   9.339  -6.320  13.764
  293   1HZ   LYS  33          HZ1       LYS  33  10.560  -5.047  15.749
  294   2HZ   LYS  33          HZ2       LYS  33  11.823  -5.084  14.625
  295   3HZ   LYS  33          HZ3       LYS  33  11.098  -6.527  15.130
  296    H    ASN  34           HN       ASN  34   6.206  -4.321   9.684
  297    HA   ASN  34           HA       ASN  34   3.703  -4.171  10.700
  298   1HB   ASN  34          HB2       ASN  34   3.974  -2.270  12.432
  299   2HB   ASN  34          HB1       ASN  34   4.292  -3.923  12.947
  300   1HD2  ASN  34          HD21      ASN  34   5.741  -0.876  12.039
  301   2HD2  ASN  34          HD22      ASN  34   7.278  -1.167  12.772
  302    H    TRP  35           HN       TRP  35   5.506  -3.277   8.464
  303    HA   TRP  35           HA       TRP  35   4.068  -0.868   7.861
  304   1HB   TRP  35          HB2       TRP  35   6.576  -0.593   9.106
  305   2HB   TRP  35          HB1       TRP  35   6.847  -0.232   7.404
  306    HD1  TRP  35           HD1      TRP  35   3.734   1.049   7.202
  307    HE1  TRP  35           HE1      TRP  35   3.466   3.474   8.022
  308    HE3  TRP  35           HE3      TRP  35   7.950   1.407  10.072
  309    HZ2  TRP  35           HZ2      TRP  35   4.858   5.298   9.667
  310    HZ3  TRP  35           HZ3      TRP  35   8.410   3.526  11.234
  311    HH2  TRP  35           HH2      TRP  35   6.895   5.431  11.035
  312    H    LEU  36           HN       LEU  36   3.432  -1.233   5.825
  313    HA   LEU  36           HA       LEU  36   5.058  -2.861   4.061
  314   1HB   LEU  36          HB2       LEU  36   2.649  -3.270   4.305
  315   2HB   LEU  36          HB1       LEU  36   2.322  -1.651   3.712
  316    HG   LEU  36           HG       LEU  36   3.731  -2.502   1.641
  317   1HD1  LEU  36          HD11      LEU  36   2.394  -5.057   2.009
  318   2HD1  LEU  36          HD12      LEU  36   3.672  -4.777   3.193
  319   3HD1  LEU  36          HD13      LEU  36   4.035  -4.704   1.467
  320   1HD2  LEU  36          HD21      LEU  36   1.057  -3.658   1.532
  321   2HD2  LEU  36          HD22      LEU  36   1.758  -2.332   0.603
  322   3HD2  LEU  36          HD23      LEU  36   1.081  -2.027   2.205
  323    H    GLU  37           HN       GLU  37   5.765  -2.170   2.015
  324    HA   GLU  37           HA       GLU  37   5.731   0.746   1.587
  325   1HB   GLU  37          HB2       GLU  37   7.952   0.045   2.311
  326   2HB   GLU  37          HB1       GLU  37   7.998  -1.182   1.053
  327   1HG   GLU  37          HG2       GLU  37   8.407   0.326  -0.604
  328   2HG   GLU  37          HG1       GLU  37   7.576   1.637   0.232
  329    H    GLY  38           HN       GLY  38   5.121   1.439  -0.389
  330   1HA   GLY  38          HA2       GLY  38   5.203  -0.395  -2.657
  331   2HA   GLY  38          HA1       GLY  38   3.611   0.148  -2.150
  332    H    GLU  39           HN       GLU  39   4.120   0.734  -4.628
  333    HA   GLU  39           HA       GLU  39   4.492   3.623  -4.605
  334   1HB   GLU  39          HB2       GLU  39   5.883   3.346  -6.769
  335   2HB   GLU  39          HB1       GLU  39   6.682   3.110  -5.221
  336   1HG   GLU  39          HG2       GLU  39   6.961   0.879  -5.543
  337   2HG   GLU  39          HG1       GLU  39   5.513   0.727  -6.537
  338    H    HIS  40           HN       HIS  40   3.823   4.603  -6.720
  339    HA   HIS  40           HA       HIS  40   2.096   2.953  -8.372
  340   1HB   HIS  40          HB2       HIS  40   0.772   3.820  -6.342
  341   2HB   HIS  40          HB1       HIS  40   0.903   5.406  -7.097
  342    HD1  HIS  40           HD1      HIS  40  -1.650   3.307  -6.676
  343    HD2  HIS  40           HD2      HIS  40   0.205   4.550 -10.180
  344    HE1  HIS  40           HE1      HIS  40  -3.353   2.968  -8.495
  345    HE2  HIS  40           HE2      HIS  40  -2.240   3.815 -10.591
  346    H    HIS  41           HN       HIS  41   2.366   3.527 -10.416
  347    HA   HIS  41           HA       HIS  41   2.982   4.690 -12.271
  348   1HB   HIS  41          HB2       HIS  41   1.057   6.199 -10.919
  349   2HB   HIS  41          HB1       HIS  41   2.308   7.359 -11.353
  350    HD1  HIS  41           HD1      HIS  41   0.674   4.469 -13.233
  351    HD2  HIS  41           HD2      HIS  41   1.628   8.486 -13.703
  352    HE1  HIS  41           HE1      HIS  41  -0.085   5.073 -15.553
  353    HE2  HIS  41           HE2      HIS  41   0.418   7.531 -15.780
  354    H    GLY  42           HN       GLY  42   5.032   4.292 -10.354
  355   1HA   GLY  42          HA2       GLY  42   7.283   4.901 -10.373
  356   2HA   GLY  42          HA1       GLY  42   6.853   6.377 -11.220
  357    H    ARG  43           HN       ARG  43   4.723   6.519  -8.858
  358    HA   ARG  43           HA       ARG  43   6.412   8.228  -7.233
  359   1HB   ARG  43          HB2       ARG  43   3.883   8.547  -8.076
  360   2HB   ARG  43          HB1       ARG  43   3.563   7.791  -6.522
  361   1HG   ARG  43          HG2       ARG  43   5.513   9.992  -6.477
  362   2HG   ARG  43          HG1       ARG  43   3.856  10.443  -6.886
  363   1HD   ARG  43          HD2       ARG  43   4.280   8.632  -4.569
  364   2HD   ARG  43          HD1       ARG  43   4.707  10.331  -4.377
  365    HE   ARG  43           HE       ARG  43   2.064   9.217  -4.578
  366   1HH1  ARG  43          HH11      ARG  43   4.002  12.087  -5.012
  367   2HH1  ARG  43          HH12      ARG  43   2.663  13.170  -4.829
  368   1HH2  ARG  43          HH21      ARG  43   0.302  10.640  -4.338
  369   2HH2  ARG  43          HH22      ARG  43   0.563  12.349  -4.446
  370    H    LEU  44           HN       LEU  44   6.466   8.091  -4.912
  371    HA   LEU  44           HA       LEU  44   6.453   5.310  -4.001
  372   1HB   LEU  44          HB2       LEU  44   8.519   6.640  -3.751
  373   2HB   LEU  44          HB1       LEU  44   7.656   7.765  -2.719
  374    HG   LEU  44           HG       LEU  44   7.330   6.033  -1.042
  375   1HD1  LEU  44          HD11      LEU  44   8.875   3.916  -1.579
  376   2HD1  LEU  44          HD12      LEU  44   8.336   4.303  -3.214
  377   3HD1  LEU  44          HD13      LEU  44   7.152   3.971  -1.950
  378   1HD2  LEU  44          HD21      LEU  44   9.938   5.474  -0.822
  379   2HD2  LEU  44          HD22      LEU  44   9.259   7.059  -0.451
  380   3HD2  LEU  44          HD23      LEU  44  10.022   6.771  -2.015
  381    H    GLY  45           HN       GLY  45   5.005   4.558  -2.597
  382   1HA   GLY  45          HA2       GLY  45   3.588   6.433  -0.844
  383   2HA   GLY  45          HA1       GLY  45   2.634   5.433  -1.926
  384    H    ILE  46           HN       ILE  46   3.956   5.658   1.121
  385    HA   ILE  46           HA       ILE  46   3.805   2.744   1.522
  386    HB   ILE  46           HB       ILE  46   5.317   4.808   3.124
  387   1HG1  ILE  46          HG12      ILE  46   6.170   2.762   1.078
  388   2HG1  ILE  46          HG11      ILE  46   6.368   4.510   1.000
  389   1HG2  ILE  46          HG21      ILE  46   5.814   3.262   4.669
  390   2HG2  ILE  46          HG22      ILE  46   5.988   1.980   3.472
  391   3HG2  ILE  46          HG23      ILE  46   4.390   2.421   4.063
  392   1HD1  ILE  46          HD11      ILE  46   8.478   3.710   1.512
  393   2HD1  ILE  46          HD12      ILE  46   7.855   2.524   2.660
  394   3HD1  ILE  46          HD13      ILE  46   7.837   4.241   3.067
  395    H    PHE  47           HN       PHE  47   2.691   1.932   3.293
  396    HA   PHE  47           HA       PHE  47   1.365   3.650   5.172
  397   1HB   PHE  47          HB2       PHE  47  -0.935   2.723   4.502
  398   2HB   PHE  47          HB1       PHE  47  -0.256   4.003   3.502
  399    HD1  PHE  47           HD1      PHE  47   0.811   3.406   1.319
  400    HD2  PHE  47           HD2      PHE  47  -1.441   0.611   3.605
  401    HE1  PHE  47           HE1      PHE  47   0.559   1.985  -0.674
  402    HE2  PHE  47           HE2      PHE  47  -1.697  -0.816   1.616
  403    HZ   PHE  47           HZ       PHE  47  -0.696  -0.129  -0.527
  404    HA   PRO  48           HA       PRO  48   1.786   0.105   7.749
  405   1HB   PRO  48          HB2       PRO  48  -0.630   0.319   9.141
  406   2HB   PRO  48          HB1       PRO  48   0.894   1.094   9.581
  407   1HG   PRO  48          HG2       PRO  48  -1.453   2.213   8.129
  408   2HG   PRO  48          HG1       PRO  48  -0.371   2.998   9.292
  409   1HD   PRO  48          HD2       PRO  48  -0.177   3.475   6.662
  410   2HD   PRO  48          HD1       PRO  48   1.266   3.385   7.693
  411    H    ALA  49           HN       ALA  49   1.422  -1.972   7.446
  412    HA   ALA  49           HA       ALA  49  -0.423  -2.926   5.528
  413   1HB   ALA  49          HB1       ALA  49   0.819  -4.788   7.483
  414   2HB   ALA  49          HB2       ALA  49   1.870  -3.884   6.392
  415   3HB   ALA  49          HB3       ALA  49   0.622  -4.945   5.737
  416    H    ASN  50           HN       ASN  50  -0.898  -2.109   8.758
  417    HA   ASN  50           HA       ASN  50  -2.548  -4.104   9.736
  418   1HB   ASN  50          HB2       ASN  50  -1.652  -1.681  10.650
  419   2HB   ASN  50          HB1       ASN  50  -3.383  -1.398  10.494
  420   1HD2  ASN  50          HD21      ASN  50  -1.219  -3.982  11.617
  421   2HD2  ASN  50          HD22      ASN  50  -2.096  -4.316  13.067
  422    H    TYR  51           HN       TYR  51  -3.246  -1.916   7.163
  423    HA   TYR  51           HA       TYR  51  -6.016  -2.881   7.227
  424   1HB   TYR  51          HB2       TYR  51  -6.745  -0.624   6.336
  425   2HB   TYR  51          HB1       TYR  51  -6.290  -0.682   8.033
  426    HD1  TYR  51           HD1      TYR  51  -4.457  -0.179   4.793
  427    HD2  TYR  51           HD2      TYR  51  -5.218   1.209   8.743
  428    HE1  TYR  51           HE1      TYR  51  -2.904   1.688   4.429
  429    HE2  TYR  51           HE2      TYR  51  -3.664   3.079   8.388
  430    HH   TYR  51           HH       TYR  51  -2.483   3.931   5.321
  431    H    VAL  52           HN       VAL  52  -3.854  -3.905   5.695
  432    HA   VAL  52           HA       VAL  52  -4.872  -3.294   3.002
  433    HB   VAL  52           HB       VAL  52  -2.599  -2.305   3.346
  434   1HG1  VAL  52          HG11      VAL  52  -1.537  -5.109   3.282
  435   2HG1  VAL  52          HG12      VAL  52  -1.860  -4.281   4.804
  436   3HG1  VAL  52          HG13      VAL  52  -0.690  -3.612   3.667
  437   1HG2  VAL  52          HG21      VAL  52  -1.940  -2.761   1.191
  438   2HG2  VAL  52          HG22      VAL  52  -3.625  -3.281   1.147
  439   3HG2  VAL  52          HG23      VAL  52  -2.337  -4.475   1.317
  440    H    GLU  53           HN       GLU  53  -4.627  -5.042   1.450
  441    HA   GLU  53           HA       GLU  53  -4.396  -7.694   2.706
  442   1HB   GLU  53          HB2       GLU  53  -6.779  -6.646   1.934
  443   2HB   GLU  53          HB1       GLU  53  -6.287  -7.451   0.450
  444   1HG   GLU  53          HG2       GLU  53  -6.397  -9.541   1.380
  445   2HG   GLU  53          HG1       GLU  53  -6.124  -8.946   3.017
  446    H    VAL  54           HN       VAL  54  -3.142  -9.115   1.656
  447    HA   VAL  54           HA       VAL  54  -1.762  -8.237  -0.727
  448    HB   VAL  54           HB       VAL  54  -1.474 -10.874   0.716
  449   1HG1  VAL  54          HG11      VAL  54  -0.557 -10.401  -1.695
  450   2HG1  VAL  54          HG12      VAL  54   0.436 -11.241  -0.504
  451   3HG1  VAL  54          HG13      VAL  54   0.697  -9.525  -0.817
  452   1HG2  VAL  54          HG21      VAL  54  -0.183  -9.934   2.294
  453   2HG2  VAL  54          HG22      VAL  54  -1.007  -8.439   1.849
  454   3HG2  VAL  54          HG23      VAL  54   0.568  -8.818   1.153
  455    H    LEU  55           HN       LEU  55  -2.470  -8.625  -2.711
  456    HA   LEU  55           HA       LEU  55  -3.246 -11.142  -3.661
  457   1HB   LEU  55          HB2       LEU  55  -5.673 -10.399  -4.220
  458   2HB   LEU  55          HB1       LEU  55  -5.313 -11.091  -2.650
  459    HG   LEU  55           HG       LEU  55  -4.991  -8.239  -2.527
  460   1HD1  LEU  55          HD11      LEU  55  -6.958  -7.371  -3.280
  461   2HD1  LEU  55          HD12      LEU  55  -7.826  -8.897  -3.112
  462   3HD1  LEU  55          HD13      LEU  55  -6.731  -8.650  -4.473
  463   1HD2  LEU  55          HD21      LEU  55  -5.427  -9.139  -0.494
  464   2HD2  LEU  55          HD22      LEU  55  -6.477 -10.395  -1.151
  465   3HD2  LEU  55          HD23      LEU  55  -7.085  -8.751  -0.952
  466    HA   PRO  56           HA       PRO  56  -1.774  -7.916  -6.710
  467   1HB   PRO  56          HB2       PRO  56  -0.776 -10.489  -7.842
  468   2HB   PRO  56          HB1       PRO  56   0.037  -8.925  -7.716
  469   1HG   PRO  56          HG2       PRO  56   0.668 -10.903  -6.057
  470   2HG   PRO  56          HG1       PRO  56   0.563  -9.231  -5.473
  471   1HD   PRO  56          HD2       PRO  56  -1.360 -11.487  -5.121
  472   2HD   PRO  56          HD1       PRO  56  -0.921 -10.191  -3.990
  473    H    LEU  57           HN       LEU  57  -2.766  -7.389  -8.593
  474    HA   LEU  57           HA       LEU  57  -4.813  -9.254  -9.577
  475   1HB   LEU  57          HB2       LEU  57  -4.578  -6.267  -9.956
  476   2HB   LEU  57          HB1       LEU  57  -5.878  -7.271 -10.572
  477    HG   LEU  57           HG       LEU  57  -6.044  -7.883  -7.953
  478   1HD1  LEU  57          HD11      LEU  57  -4.275  -6.416  -7.246
  479   2HD1  LEU  57          HD12      LEU  57  -5.816  -5.772  -6.681
  480   3HD1  LEU  57          HD13      LEU  57  -5.020  -5.052  -8.080
  481   1HD2  LEU  57          HD21      LEU  57  -7.284  -5.477  -9.285
  482   2HD2  LEU  57          HD22      LEU  57  -7.891  -6.289  -7.842
  483   3HD2  LEU  57          HD23      LEU  57  -7.872  -7.136  -9.389
  484    H    GLU  58           HN       GLU  58  -2.003  -9.440 -10.298
  485    HA   GLU  58           HA       GLU  58  -2.263  -9.000 -13.198
  486   1HB   GLU  58          HB2       GLU  58  -0.646  -7.419 -12.114
  487   2HB   GLU  58          HB1       GLU  58   0.315  -8.811 -11.634
  488   1HG   GLU  58          HG2       GLU  58   1.038  -9.224 -13.760
  489   2HG   GLU  58          HG1       GLU  58  -0.386  -8.498 -14.504
  Start of MODEL   16
    1   1H    MET   0          HT1       MET   0   5.822  -9.152 -10.345
    2   2H    MET   0          HT2       MET   0   5.687  -9.020  -8.639
    3   3H    MET   0          HT3       MET   0   4.892  -7.888  -9.656
    4    HA   MET   0           HA       MET   0   3.357  -9.408 -10.375
    5   1HB   MET   0          HB2       MET   0   5.343 -11.156 -10.466
    6   2HB   MET   0          HB1       MET   0   4.673 -11.665  -8.922
    7   1HG   MET   0          HG2       MET   0   2.607 -12.246  -9.896
    8   2HG   MET   0          HG1       MET   0   3.004 -11.423 -11.404
    9   1HE   MET   0          HE1       MET   0   4.982 -12.334 -13.083
   10   2HE   MET   0          HE2       MET   0   3.299 -12.779 -13.367
   11   3HE   MET   0          HE3       MET   0   4.572 -13.989 -13.533
   12    H    LYS   1           HN       LYS   1   3.684  -7.733  -8.072
   13    HA   LYS   1           HA       LYS   1   1.909  -9.156  -6.210
   14   1HB   LYS   1          HB2       LYS   1   4.489  -7.836  -5.650
   15   2HB   LYS   1          HB1       LYS   1   3.188  -7.432  -4.539
   16   1HG   LYS   1          HG2       LYS   1   2.918 -10.108  -4.622
   17   2HG   LYS   1          HG1       LYS   1   4.653  -9.957  -4.907
   18   1HD   LYS   1          HD2       LYS   1   5.063  -9.230  -2.811
   19   2HD   LYS   1          HD1       LYS   1   3.586  -8.267  -2.748
   20   1HE   LYS   1          HE2       LYS   1   3.205 -11.188  -2.771
   21   2HE   LYS   1          HE1       LYS   1   3.982 -10.534  -1.330
   22   1HZ   LYS   1          HZ1       LYS   1   1.349  -9.727  -2.442
   23   2HZ   LYS   1          HZ2       LYS   1   2.107  -8.968  -1.134
   24   3HZ   LYS   1          HZ3       LYS   1   1.623 -10.584  -1.008
   25    H    ALA   2           HN       ALA   2   0.113  -8.072  -5.668
   26    HA   ALA   2           HA       ALA   2   0.021  -5.172  -5.852
   27   1HB   ALA   2          HB1       ALA   2  -1.596  -4.984  -7.493
   28   2HB   ALA   2          HB2       ALA   2  -2.104  -6.665  -7.331
   29   3HB   ALA   2          HB3       ALA   2  -0.577  -6.278  -8.124
   30    H    ALA   3           HN       ALA   3  -1.391  -4.277  -4.439
   31    HA   ALA   3           HA       ALA   3  -3.227  -6.095  -3.022
   32   1HB   ALA   3          HB1       ALA   3  -2.648  -5.229  -0.949
   33   2HB   ALA   3          HB2       ALA   3  -1.934  -3.774  -1.643
   34   3HB   ALA   3          HB3       ALA   3  -1.095  -5.320  -1.780
   35    H    ARG   4           HN       ARG   4  -5.181  -5.198  -2.273
   36    HA   ARG   4           HA       ARG   4  -5.882  -2.615  -3.507
   37   1HB   ARG   4          HB2       ARG   4  -6.963  -4.619  -4.551
   38   2HB   ARG   4          HB1       ARG   4  -7.747  -4.940  -3.010
   39   1HG   ARG   4          HG2       ARG   4  -8.699  -2.578  -3.206
   40   2HG   ARG   4          HG1       ARG   4  -8.187  -2.651  -4.893
   41   1HD   ARG   4          HD2       ARG   4  -9.606  -5.047  -4.122
   42   2HD   ARG   4          HD1       ARG   4 -10.573  -3.607  -3.810
   43    HE   ARG   4           HE       ARG   4  -9.631  -3.216  -6.326
   44   1HH1  ARG   4          HH11      ARG   4 -11.373  -5.812  -4.773
   45   2HH1  ARG   4          HH12      ARG   4 -12.188  -6.298  -6.221
   46   1HH2  ARG   4          HH21      ARG   4 -10.704  -3.855  -8.231
   47   2HH2  ARG   4          HH22      ARG   4 -11.809  -5.187  -8.184
   48    H    LEU   5           HN       LEU   5  -6.276  -1.075  -2.075
   49    HA   LEU   5           HA       LEU   5  -6.454  -1.472   0.689
   50   1HB   LEU   5          HB2       LEU   5  -6.216   0.697  -1.006
   51   2HB   LEU   5          HB1       LEU   5  -7.783   0.950  -0.261
   52    HG   LEU   5           HG       LEU   5  -6.251   0.359   1.919
   53   1HD1  LEU   5          HD11      LEU   5  -4.345   0.635   0.015
   54   2HD1  LEU   5          HD12      LEU   5  -4.101   0.973   1.728
   55   3HD1  LEU   5          HD13      LEU   5  -4.467   2.290   0.613
   56   1HD2  LEU   5          HD21      LEU   5  -6.717   3.071   0.684
   57   2HD2  LEU   5          HD22      LEU   5  -6.304   2.763   2.371
   58   3HD2  LEU   5          HD23      LEU   5  -7.841   2.193   1.722
   59    H    LYS   6           HN       LYS   6  -8.304  -0.885   2.097
   60    HA   LYS   6           HA       LYS   6 -10.909  -1.485   0.888
   61   1HB   LYS   6          HB2       LYS   6  -9.452  -3.086   2.862
   62   2HB   LYS   6          HB1       LYS   6 -11.102  -2.711   3.338
   63   1HG   LYS   6          HG2       LYS   6 -10.313  -3.979   0.724
   64   2HG   LYS   6          HG1       LYS   6 -10.900  -4.853   2.141
   65   1HD   LYS   6          HD2       LYS   6 -12.538  -2.599   1.097
   66   2HD   LYS   6          HD1       LYS   6 -12.528  -4.114   0.191
   67   1HE   LYS   6          HE2       LYS   6 -12.868  -5.002   2.743
   68   2HE   LYS   6          HE1       LYS   6 -13.737  -3.468   2.786
   69   1HZ   LYS   6          HZ1       LYS   6 -14.639  -4.487   0.500
   70   2HZ   LYS   6          HZ2       LYS   6 -15.400  -4.730   1.990
   71   3HZ   LYS   6          HZ3       LYS   6 -14.370  -5.917   1.364
   72    H    PHE   7           HN       PHE   7  -9.305   0.831   2.312
   73    HA   PHE   7           HA       PHE   7 -11.563   2.182   3.273
   74   1HB   PHE   7          HB2       PHE   7 -11.405   2.103   5.598
   75   2HB   PHE   7          HB1       PHE   7 -11.103   0.436   5.128
   76    HD1  PHE   7           HD2      PHE   7  -8.368   0.234   4.472
   77    HD2  PHE   7           HD1      PHE   7 -10.187   2.696   7.429
   78    HE1  PHE   7           HE2      PHE   7  -6.260   0.270   5.734
   79    HE2  PHE   7           HE1      PHE   7  -8.081   2.734   8.698
   80    HZ   PHE   7           HZ       PHE   7  -6.114   1.518   7.852
   81    H    ASP   8           HN       ASP   8 -11.142   4.238   2.897
   82    HA   ASP   8           HA       ASP   8  -8.754   5.278   2.046
   83   1HB   ASP   8          HB2       ASP   8  -9.696   7.500   2.494
   84   2HB   ASP   8          HB1       ASP   8 -10.901   6.431   1.782
   85    H    PHE   9           HN       PHE   9  -7.044   6.383   2.943
   86    HA   PHE   9           HA       PHE   9  -6.912   6.583   5.862
   87   1HB   PHE   9          HB2       PHE   9  -5.830   4.474   5.368
   88   2HB   PHE   9          HB1       PHE   9  -4.850   5.225   4.114
   89    HD1  PHE   9           HD2      PHE   9  -5.584   6.487   7.528
   90    HD2  PHE   9           HD1      PHE   9  -2.674   4.894   4.863
   91    HE1  PHE   9           HE2      PHE   9  -3.823   6.945   9.184
   92    HE2  PHE   9           HE1      PHE   9  -0.908   5.347   6.514
   93    HZ   PHE   9           HZ       PHE   9  -1.481   6.375   8.678
   94    H    GLN  10           HN       GLN  10  -6.251   8.537   6.453
   95    HA   GLN  10           HA       GLN  10  -5.107  10.320   4.465
   96   1HB   GLN  10          HB2       GLN  10  -5.384  12.044   6.264
   97   2HB   GLN  10          HB1       GLN  10  -6.876  11.249   5.781
   98   1HG   GLN  10          HG2       GLN  10  -7.227  10.430   7.818
   99   2HG   GLN  10          HG1       GLN  10  -5.552   9.911   7.995
  100   1HE2  GLN  10          HE21      GLN  10  -7.827  11.805   9.313
  101   2HE2  GLN  10          HE22      GLN  10  -6.838  13.014  10.052
  102    H    ALA  11           HN       ALA  11  -2.985  10.426   4.199
  103    HA   ALA  11           HA       ALA  11  -1.080   9.279   5.892
  104   1HB   ALA  11          HB1       ALA  11   0.518  10.835   4.568
  105   2HB   ALA  11          HB2       ALA  11  -0.924  11.235   3.635
  106   3HB   ALA  11          HB3       ALA  11  -0.358   9.566   3.712
  107    H    GLN  12           HN       GLN  12   0.110  10.015   7.571
  108    HA   GLN  12           HA       GLN  12  -0.567  12.673   8.606
  109   1HB   GLN  12          HB2       GLN  12   0.662  11.616  10.688
  110   2HB   GLN  12          HB1       GLN  12  -1.022  11.257  10.350
  111   1HG   GLN  12          HG2       GLN  12  -0.380   9.160   9.303
  112   2HG   GLN  12          HG1       GLN  12   1.321   9.529   9.583
  113   1HE2  GLN  12          HE21      GLN  12  -1.744   8.851  11.158
  114   2HE2  GLN  12          HE22      GLN  12  -1.069   8.253  12.631
  115    H    SER  13           HN       SER  13   2.114  10.623   7.658
  116    HA   SER  13           HA       SER  13   3.966  12.853   8.169
  117   1HB   SER  13          HB2       SER  13   4.464  10.684   9.320
  118   2HB   SER  13          HB1       SER  13   4.669   9.942   7.734
  119    HG   SER  13           HG       SER  13   6.554  10.870   7.544
  120    HA   PRO  14           HA       PRO  14   4.535  13.644   3.872
  121   1HB   PRO  14          HB2       PRO  14   7.451  13.688   4.459
  122   2HB   PRO  14          HB1       PRO  14   6.438  14.918   3.696
  123   1HG   PRO  14          HG2       PRO  14   7.286  15.220   6.202
  124   2HG   PRO  14          HG1       PRO  14   5.653  15.721   5.725
  125   1HD   PRO  14          HD2       PRO  14   6.529  13.303   7.247
  126   2HD   PRO  14          HD1       PRO  14   5.082  14.310   7.461
  127    H    LYS  15           HN       LYS  15   6.454  11.173   5.456
  128    HA   LYS  15           HA       LYS  15   7.423   9.965   3.059
  129   1HB   LYS  15          HB2       LYS  15   8.535   9.717   5.264
  130   2HB   LYS  15          HB1       LYS  15   7.166   8.765   5.822
  131   1HG   LYS  15          HG2       LYS  15   8.864   7.237   5.228
  132   2HG   LYS  15          HG1       LYS  15   7.650   7.161   3.950
  133   1HD   LYS  15          HD2       LYS  15   9.097   8.868   2.716
  134   2HD   LYS  15          HD1       LYS  15  10.354   8.472   3.891
  135   1HE   LYS  15          HE2       LYS  15  10.872   6.991   2.223
  136   2HE   LYS  15          HE1       LYS  15   9.775   6.006   3.190
  137   1HZ   LYS  15          HZ1       LYS  15   8.763   7.633   0.946
  138   2HZ   LYS  15          HZ2       LYS  15   8.068   6.270   1.665
  139   3HZ   LYS  15          HZ3       LYS  15   9.426   6.101   0.672
  140    H    GLU  16           HN       GLU  16   4.537   9.654   4.983
  141    HA   GLU  16           HA       GLU  16   3.713   7.166   3.799
  142   1HB   GLU  16          HB2       GLU  16   2.781   8.934   5.907
  143   2HB   GLU  16          HB1       GLU  16   1.453   8.368   4.903
  144   1HG   GLU  16          HG2       GLU  16   3.450   6.402   5.905
  145   2HG   GLU  16          HG1       GLU  16   2.218   7.021   7.004
  146    H    LEU  17           HN       LEU  17   1.501   7.049   2.736
  147    HA   LEU  17           HA       LEU  17   1.068   9.340   0.942
  148   1HB   LEU  17          HB2       LEU  17   2.384   7.424  -0.099
  149   2HB   LEU  17          HB1       LEU  17   0.914   6.476   0.026
  150    HG   LEU  17           HG       LEU  17   0.997   9.097  -1.450
  151   1HD1  LEU  17          HD11      LEU  17   2.646   7.759  -2.529
  152   2HD1  LEU  17          HD12      LEU  17   1.183   7.696  -3.513
  153   3HD1  LEU  17          HD13      LEU  17   1.608   6.334  -2.476
  154   1HD2  LEU  17          HD21      LEU  17  -0.837   7.360  -2.594
  155   2HD2  LEU  17          HD22      LEU  17  -1.195   8.712  -1.521
  156   3HD2  LEU  17          HD23      LEU  17  -1.006   7.089  -0.859
  157    H    THR  18           HN       THR  18  -1.017   9.873   0.578
  158    HA   THR  18           HA       THR  18  -3.036   8.488   2.130
  159    HB   THR  18           HB       THR  18  -3.253  10.967   0.410
  160    HG1  THR  18           HG1      THR  18  -2.962  12.087   2.278
  161   1HG2  THR  18          HG21      THR  18  -5.436  10.829   0.734
  162   2HG2  THR  18          HG22      THR  18  -5.124  11.086   2.451
  163   3HG2  THR  18          HG23      THR  18  -5.256   9.446   1.813
  164    H    LEU  19           HN       LEU  19  -4.328   6.971   1.342
  165    HA   LEU  19           HA       LEU  19  -4.976   7.000  -1.523
  166   1HB   LEU  19          HB2       LEU  19  -3.223   5.352  -1.229
  167   2HB   LEU  19          HB1       LEU  19  -4.105   4.602   0.088
  168    HG   LEU  19           HG       LEU  19  -5.872   3.921  -1.482
  169   1HD1  LEU  19          HD11      LEU  19  -4.507   4.258  -3.952
  170   2HD1  LEU  19          HD12      LEU  19  -4.635   5.832  -3.168
  171   3HD1  LEU  19          HD13      LEU  19  -6.086   4.876  -3.468
  172   1HD2  LEU  19          HD21      LEU  19  -3.448   2.924  -2.831
  173   2HD2  LEU  19          HD22      LEU  19  -4.772   2.042  -2.072
  174   3HD2  LEU  19          HD23      LEU  19  -3.491   2.735  -1.078
  175    H    GLN  20           HN       GLN  20  -6.974   6.033  -2.082
  176    HA   GLN  20           HA       GLN  20  -8.855   5.895   0.172
  177   1HB   GLN  20          HB2       GLN  20  -8.997   7.414  -2.087
  178   2HB   GLN  20          HB1       GLN  20  -9.942   6.010  -2.565
  179   1HG   GLN  20          HG2       GLN  20 -11.411   6.305  -0.674
  180   2HG   GLN  20          HG1       GLN  20 -10.424   7.640  -0.082
  181   1HE2  GLN  20          HE21      GLN  20 -12.771   8.477  -0.236
  182   2HE2  GLN  20          HE22      GLN  20 -13.156   9.327  -1.691
  183    H    LYS  21           HN       LYS  21 -10.507   4.269   0.171
  184    HA   LYS  21           HA       LYS  21  -9.586   1.692  -0.333
  185   1HB   LYS  21          HB2       LYS  21 -11.774   0.946   0.301
  186   2HB   LYS  21          HB1       LYS  21 -11.351   2.319   1.306
  187   1HG   LYS  21          HG2       LYS  21 -12.799   3.062  -1.112
  188   2HG   LYS  21          HG1       LYS  21 -13.704   1.985  -0.047
  189   1HD   LYS  21          HD2       LYS  21 -13.606   3.495   1.746
  190   2HD   LYS  21          HD1       LYS  21 -12.304   4.425   1.003
  191   1HE   LYS  21          HE2       LYS  21 -15.209   4.335   0.236
  192   2HE   LYS  21          HE1       LYS  21 -14.256   5.727   0.748
  193   1HZ   LYS  21          HZ1       LYS  21 -14.331   6.021  -1.508
  194   2HZ   LYS  21          HZ2       LYS  21 -14.303   4.365  -1.853
  195   3HZ   LYS  21          HZ3       LYS  21 -12.886   5.151  -1.367
  196    H    GLY  22           HN       GLY  22 -10.108   0.139  -1.884
  197   1HA   GLY  22          HA2       GLY  22 -11.078  -0.661  -3.870
  198   2HA   GLY  22          HA1       GLY  22 -11.679   0.962  -4.202
  199    H    ASP  23           HN       ASP  23  -8.607   1.544  -3.386
  200    HA   ASP  23           HA       ASP  23  -7.753   1.546  -6.180
  201   1HB   ASP  23          HB2       ASP  23  -7.066   3.125  -3.760
  202   2HB   ASP  23          HB1       ASP  23  -5.777   2.875  -4.933
  203    H    ILE  24           HN       ILE  24  -6.054   0.405  -6.945
  204    HA   ILE  24           HA       ILE  24  -4.756  -1.450  -5.066
  205    HB   ILE  24           HB       ILE  24  -4.236  -2.836  -7.039
  206   1HG1  ILE  24          HG12      ILE  24  -6.088  -1.804  -8.925
  207   2HG1  ILE  24          HG11      ILE  24  -5.052  -0.467  -8.438
  208   1HG2  ILE  24          HG21      ILE  24  -7.180  -2.229  -6.950
  209   2HG2  ILE  24          HG22      ILE  24  -6.333  -3.083  -5.661
  210   3HG2  ILE  24          HG23      ILE  24  -6.396  -3.773  -7.282
  211   1HD1  ILE  24          HD11      ILE  24  -3.084  -1.893  -8.961
  212   2HD1  ILE  24          HD12      ILE  24  -4.095  -1.505 -10.353
  213   3HD1  ILE  24          HD13      ILE  24  -4.197  -3.100  -9.606
  214    H    VAL  25           HN       VAL  25  -2.564  -1.571  -4.919
  215    HA   VAL  25           HA       VAL  25  -0.973   0.156  -6.690
  216    HB   VAL  25           HB       VAL  25   0.436   0.801  -4.755
  217   1HG1  VAL  25          HG11      VAL  25  -1.295   2.310  -5.569
  218   2HG1  VAL  25          HG12      VAL  25  -1.122   2.442  -3.818
  219   3HG1  VAL  25          HG13      VAL  25  -2.477   1.546  -4.506
  220   1HG2  VAL  25          HG21      VAL  25  -0.660   0.532  -2.476
  221   2HG2  VAL  25          HG22      VAL  25   0.072  -0.910  -3.179
  222   3HG2  VAL  25          HG23      VAL  25  -1.678  -0.696  -3.229
  223    H    TYR  26           HN       TYR  26   1.354  -0.372  -6.662
  224    HA   TYR  26           HA       TYR  26   1.707  -3.268  -6.561
  225   1HB   TYR  26          HB2       TYR  26   3.447  -1.094  -7.739
  226   2HB   TYR  26          HB1       TYR  26   3.792  -2.817  -7.832
  227    HD1  TYR  26           HD2      TYR  26   1.034  -0.422  -8.632
  228    HD2  TYR  26           HD1      TYR  26   3.145  -3.946  -9.739
  229    HE1  TYR  26           HE2      TYR  26  -0.308  -0.573 -10.687
  230    HE2  TYR  26           HE1      TYR  26   1.810  -4.106 -11.798
  231    HH   TYR  26           HH       TYR  26  -0.296  -3.355 -12.690
  232    H    ILE  27           HN       ILE  27   2.967  -4.292  -5.132
  233    HA   ILE  27           HA       ILE  27   4.067  -2.786  -2.931
  234    HB   ILE  27           HB       ILE  27   4.449  -5.739  -3.286
  235   1HG1  ILE  27          HG12      ILE  27   2.132  -5.555  -3.757
  236   2HG1  ILE  27          HG11      ILE  27   2.229  -5.974  -2.050
  237   1HG2  ILE  27          HG21      ILE  27   5.179  -3.997  -1.315
  238   2HG2  ILE  27          HG22      ILE  27   4.981  -5.738  -1.114
  239   3HG2  ILE  27          HG23      ILE  27   3.662  -4.646  -0.693
  240   1HD1  ILE  27          HD11      ILE  27   0.587  -4.318  -2.193
  241   2HD1  ILE  27          HD12      ILE  27   1.556  -3.329  -3.287
  242   3HD1  ILE  27          HD13      ILE  27   2.021  -3.484  -1.592
  243    H    HIS  28           HN       HIS  28   6.144  -2.276  -2.587
  244    HA   HIS  28           HA       HIS  28   8.121  -3.264  -4.527
  245   1HB   HIS  28          HB2       HIS  28   7.482  -0.657  -3.820
  246   2HB   HIS  28          HB1       HIS  28   8.968  -0.976  -2.932
  247    HD1  HIS  28           HD1      HIS  28  10.703   0.196  -4.275
  248    HD2  HIS  28           HD2      HIS  28   8.166  -2.088  -6.644
  249    HE1  HIS  28           HE1      HIS  28  11.669   0.306  -6.594
  250    HE2  HIS  28           HE2      HIS  28  10.066  -1.008  -8.027
  251    H    LYS  29           HN       LYS  29   7.327  -3.053  -1.149
  252    HA   LYS  29           HA       LYS  29   9.444  -4.913  -0.529
  253   1HB   LYS  29          HB2       LYS  29  10.513  -3.595   1.190
  254   2HB   LYS  29          HB1       LYS  29  10.589  -2.725  -0.335
  255   1HG   LYS  29          HG2       LYS  29   9.388  -1.010   0.446
  256   2HG   LYS  29          HG1       LYS  29   8.250  -2.064   1.287
  257   1HD   LYS  29          HD2       LYS  29  10.066  -2.429   3.011
  258   2HD   LYS  29          HD1       LYS  29  10.943  -1.110   2.233
  259   1HE   LYS  29          HE2       LYS  29   8.110  -0.795   3.180
  260   2HE   LYS  29          HE1       LYS  29   9.485  -0.534   4.253
  261   1HZ   LYS  29          HZ1       LYS  29  10.158   0.930   2.100
  262   2HZ   LYS  29          HZ2       LYS  29   9.390   1.545   3.475
  263   3HZ   LYS  29          HZ3       LYS  29   8.477   1.121   2.117
  264    H    GLU  30           HN       GLU  30   9.103  -6.034   1.390
  265    HA   GLU  30           HA       GLU  30   6.490  -5.526   2.651
  266   1HB   GLU  30          HB2       GLU  30   7.900  -8.086   1.982
  267   2HB   GLU  30          HB1       GLU  30   6.661  -8.031   3.228
  268   1HG   GLU  30          HG2       GLU  30   4.977  -7.536   1.714
  269   2HG   GLU  30          HG1       GLU  30   6.112  -6.965   0.491
  270    H    VAL  31           HN       VAL  31   6.924  -4.427   4.433
  271    HA   VAL  31           HA       VAL  31   9.120  -5.289   6.148
  272    HB   VAL  31           HB       VAL  31   7.291  -3.154   7.058
  273   1HG1  VAL  31          HG11      VAL  31   9.582  -4.120   8.011
  274   2HG1  VAL  31          HG12      VAL  31   9.082  -2.446   8.250
  275   3HG1  VAL  31          HG13      VAL  31  10.229  -2.849   6.973
  276   1HG2  VAL  31          HG21      VAL  31   8.432  -1.446   5.684
  277   2HG2  VAL  31          HG22      VAL  31   7.475  -2.562   4.712
  278   3HG2  VAL  31          HG23      VAL  31   9.227  -2.736   4.782
  279    H    ASP  32           HN       ASP  32   8.528  -7.098   7.090
  280    HA   ASP  32           HA       ASP  32   5.962  -7.820   7.941
  281   1HB   ASP  32          HB2       ASP  32   8.199  -9.213   7.654
  282   2HB   ASP  32          HB1       ASP  32   8.341  -8.903   9.381
  283    H    LYS  33           HN       LYS  33   8.206  -5.643   9.328
  284    HA   LYS  33           HA       LYS  33   7.588  -5.900  12.055
  285   1HB   LYS  33          HB2       LYS  33   9.096  -4.130  10.419
  286   2HB   LYS  33          HB1       LYS  33   8.023  -3.144  11.402
  287   1HG   LYS  33          HG2       LYS  33   8.884  -4.597  13.364
  288   2HG   LYS  33          HG1       LYS  33  10.203  -4.995  12.262
  289   1HD   LYS  33          HD2       LYS  33  11.153  -2.979  12.500
  290   2HD   LYS  33          HD1       LYS  33   9.606  -2.139  12.369
  291   1HE   LYS  33          HE2       LYS  33  10.196  -1.638  14.532
  292   2HE   LYS  33          HE1       LYS  33   9.226  -3.089  14.776
  293   1HZ   LYS  33          HZ1       LYS  33  11.255  -3.209  16.048
  294   2HZ   LYS  33          HZ2       LYS  33  12.191  -2.968  14.660
  295   3HZ   LYS  33          HZ3       LYS  33  11.284  -4.385  14.831
  296    H    ASN  34           HN       ASN  34   6.228  -3.740   9.571
  297    HA   ASN  34           HA       ASN  34   3.580  -3.990  10.150
  298   1HB   ASN  34          HB2       ASN  34   3.174  -1.868  11.533
  299   2HB   ASN  34          HB1       ASN  34   3.770  -3.284  12.391
  300   1HD2  ASN  34          HD21      ASN  34   4.448  -0.076  11.342
  301   2HD2  ASN  34          HD22      ASN  34   5.943   0.117  12.187
  302    H    TRP  35           HN       TRP  35   5.385  -3.278   7.985
  303    HA   TRP  35           HA       TRP  35   3.816  -1.151   6.853
  304   1HB   TRP  35          HB2       TRP  35   6.282  -0.519   8.123
  305   2HB   TRP  35          HB1       TRP  35   6.502  -0.321   6.390
  306    HD1  TRP  35           HD1      TRP  35   3.389   0.678   5.930
  307    HE1  TRP  35           HE1      TRP  35   2.828   3.109   6.564
  308    HE3  TRP  35           HE3      TRP  35   7.292   1.613   9.096
  309    HZ2  TRP  35           HZ2      TRP  35   3.899   5.152   8.191
  310    HZ3  TRP  35           HZ3      TRP  35   7.451   3.830  10.150
  311    HH2  TRP  35           HH2      TRP  35   5.789   5.563   9.705
  312    H    LEU  36           HN       LEU  36   4.653  -0.595   4.590
  313    HA   LEU  36           HA       LEU  36   6.231  -2.582   3.233
  314   1HB   LEU  36          HB2       LEU  36   4.536  -3.492   1.844
  315   2HB   LEU  36          HB1       LEU  36   3.963  -3.644   3.496
  316    HG   LEU  36           HG       LEU  36   2.981  -1.183   2.635
  317   1HD1  LEU  36          HD11      LEU  36   1.645  -2.403   0.607
  318   2HD1  LEU  36          HD12      LEU  36   3.284  -3.017   0.389
  319   3HD1  LEU  36          HD13      LEU  36   2.990  -1.279   0.416
  320   1HD2  LEU  36          HD21      LEU  36   0.854  -2.157   2.972
  321   2HD2  LEU  36          HD22      LEU  36   1.945  -2.976   4.090
  322   3HD2  LEU  36          HD23      LEU  36   1.452  -3.773   2.596
  323    H    GLU  37           HN       GLU  37   5.875  -2.112   0.688
  324    HA   GLU  37           HA       GLU  37   6.067   0.810   0.443
  325   1HB   GLU  37          HB2       GLU  37   7.676  -1.290  -0.545
  326   2HB   GLU  37          HB1       GLU  37   6.897  -0.558  -1.937
  327   1HG   GLU  37          HG2       GLU  37   8.283   1.102   0.133
  328   2HG   GLU  37          HG1       GLU  37   9.162   0.359  -1.202
  329    H    GLY  38           HN       GLY  38   4.745   1.958  -0.842
  330   1HA   GLY  38          HA2       GLY  38   2.986   0.531  -2.709
  331   2HA   GLY  38          HA1       GLY  38   2.252   1.532  -1.464
  332    H    GLU  39           HN       GLU  39   3.512   1.463  -4.587
  333    HA   GLU  39           HA       GLU  39   3.568   4.409  -4.682
  334   1HB   GLU  39          HB2       GLU  39   4.978   3.921  -6.837
  335   2HB   GLU  39          HB1       GLU  39   5.742   3.893  -5.254
  336   1HG   GLU  39          HG2       GLU  39   5.486   1.438  -5.217
  337   2HG   GLU  39          HG1       GLU  39   4.831   1.514  -6.853
  338    H    HIS  40           HN       HIS  40   2.600   5.431  -6.465
  339    HA   HIS  40           HA       HIS  40   1.047   3.743  -8.284
  340   1HB   HIS  40          HB2       HIS  40  -0.262   4.565  -6.173
  341   2HB   HIS  40          HB1       HIS  40  -0.292   6.108  -7.019
  342    HD1  HIS  40           HD1      HIS  40  -2.790   4.209  -6.388
  343    HD2  HIS  40           HD2      HIS  40  -0.846   4.634 -10.036
  344    HE1  HIS  40           HE1      HIS  40  -4.468   3.519  -8.128
  345    HE2  HIS  40           HE2      HIS  40  -3.299   3.870 -10.332
  346    H    HIS  41           HN       HIS  41   1.112   4.445 -10.313
  347    HA   HIS  41           HA       HIS  41   1.611   5.702 -12.139
  348   1HB   HIS  41          HB2       HIS  41   0.397   7.717 -10.276
  349   2HB   HIS  41          HB1       HIS  41   1.006   8.214 -11.851
  350    HD1  HIS  41           HD1      HIS  41   0.018   5.568 -13.335
  351    HD2  HIS  41           HD2      HIS  41  -2.274   8.058 -10.923
  352    HE1  HIS  41           HE1      HIS  41  -2.364   5.189 -14.048
  353    HE2  HIS  41           HE2      HIS  41  -3.724   6.770 -12.635
  354    H    GLY  42           HN       GLY  42   3.801   5.152 -10.424
  355   1HA   GLY  42          HA2       GLY  42   6.055   5.727 -10.614
  356   2HA   GLY  42          HA1       GLY  42   5.581   7.263 -11.320
  357    H    ARG  43           HN       ARG  43   3.681   7.283  -8.763
  358    HA   ARG  43           HA       ARG  43   5.491   8.922  -7.227
  359   1HB   ARG  43          HB2       ARG  43   2.919   9.239  -7.648
  360   2HB   ARG  43          HB1       ARG  43   2.755   8.149  -6.279
  361   1HG   ARG  43          HG2       ARG  43   4.527  10.530  -6.030
  362   2HG   ARG  43          HG1       ARG  43   2.777  10.736  -5.933
  363   1HD   ARG  43          HD2       ARG  43   2.797   8.901  -4.187
  364   2HD   ARG  43          HD1       ARG  43   4.551   9.065  -4.167
  365    HE   ARG  43           HE       ARG  43   4.329  11.029  -3.005
  366   1HH1  ARG  43          HH11      ARG  43   1.219  10.108  -4.294
  367   2HH1  ARG  43          HH12      ARG  43   0.354  11.317  -3.407
  368   1HH2  ARG  43          HH21      ARG  43   3.192  12.620  -1.837
  369   2HH2  ARG  43          HH22      ARG  43   1.473  12.742  -2.012
  370    H    LEU  44           HN       LEU  44   6.339   8.476  -5.223
  371    HA   LEU  44           HA       LEU  44   6.262   5.658  -4.445
  372   1HB   LEU  44          HB2       LEU  44   8.445   6.794  -4.822
  373   2HB   LEU  44          HB1       LEU  44   8.089   7.850  -3.467
  374    HG   LEU  44           HG       LEU  44   7.772   5.336  -2.378
  375   1HD1  LEU  44          HD11      LEU  44  10.063   4.327  -3.018
  376   2HD1  LEU  44          HD12      LEU  44   9.886   5.279  -4.493
  377   3HD1  LEU  44          HD13      LEU  44   8.682   4.058  -4.081
  378   1HD2  LEU  44          HD21      LEU  44  10.188   5.854  -1.526
  379   2HD2  LEU  44          HD22      LEU  44   8.840   6.896  -1.071
  380   3HD2  LEU  44          HD23      LEU  44   9.937   7.387  -2.362
  381    H    GLY  45           HN       GLY  45   5.261   4.954  -2.690
  382   1HA   GLY  45          HA2       GLY  45   4.780   6.731  -0.434
  383   2HA   GLY  45          HA1       GLY  45   3.350   6.126  -1.259
  384    H    ILE  46           HN       ILE  46   3.593   5.531   1.352
  385    HA   ILE  46           HA       ILE  46   4.098   2.646   1.275
  386    HB   ILE  46           HB       ILE  46   5.244   4.584   3.269
  387   1HG1  ILE  46          HG12      ILE  46   6.625   2.233   2.019
  388   2HG1  ILE  46          HG11      ILE  46   6.415   3.725   1.106
  389   1HG2  ILE  46          HG21      ILE  46   4.642   3.138   4.881
  390   2HG2  ILE  46          HG22      ILE  46   6.000   2.192   4.274
  391   3HG2  ILE  46          HG23      ILE  46   4.363   1.821   3.745
  392   1HD1  ILE  46          HD11      ILE  46   8.550   3.839   2.072
  393   2HD1  ILE  46          HD12      ILE  46   7.954   3.302   3.643
  394   3HD1  ILE  46          HD13      ILE  46   7.529   4.904   3.039
  395    H    PHE  47           HN       PHE  47   2.832   1.421   2.678
  396    HA   PHE  47           HA       PHE  47   0.840   2.816   4.300
  397   1HB   PHE  47          HB2       PHE  47   0.004   0.655   2.368
  398   2HB   PHE  47          HB1       PHE  47  -1.029   1.719   3.315
  399    HD1  PHE  47           HD1      PHE  47   1.496   1.758   0.589
  400    HD2  PHE  47           HD2      PHE  47  -1.858   3.670   2.380
  401    HE1  PHE  47           HE1      PHE  47   1.379   3.321  -1.308
  402    HE2  PHE  47           HE2      PHE  47  -1.982   5.236   0.485
  403    HZ   PHE  47           HZ       PHE  47  -0.362   5.062  -1.362
  404    HA   PRO  48           HA       PRO  48   1.653  -0.381   7.227
  405   1HB   PRO  48          HB2       PRO  48  -1.243  -0.361   7.853
  406   2HB   PRO  48          HB1       PRO  48   0.139  -0.057   8.911
  407   1HG   PRO  48          HG2       PRO  48  -1.441   1.937   8.100
  408   2HG   PRO  48          HG1       PRO  48   0.309   2.160   8.273
  409   1HD   PRO  48          HD2       PRO  48  -1.316   1.760   5.793
  410   2HD   PRO  48          HD1       PRO  48   0.076   2.827   6.071
  411    H    ALA  49           HN       ALA  49   1.390  -2.600   7.566
  412    HA   ALA  49           HA       ALA  49   0.541  -4.104   5.323
  413   1HB   ALA  49          HB1       ALA  49   1.514  -5.885   6.342
  414   2HB   ALA  49          HB2       ALA  49   0.871  -5.469   7.931
  415   3HB   ALA  49          HB3       ALA  49   2.267  -4.601   7.290
  416    H    ASN  50           HN       ASN  50  -1.020  -3.134   8.276
  417    HA   ASN  50           HA       ASN  50  -3.251  -4.964   7.828
  418   1HB   ASN  50          HB2       ASN  50  -2.083  -3.734  10.125
  419   2HB   ASN  50          HB1       ASN  50  -3.760  -3.210  10.014
  420   1HD2  ASN  50          HD21      ASN  50  -4.908  -4.392  11.358
  421   2HD2  ASN  50          HD22      ASN  50  -4.827  -6.109  11.526
  422    H    TYR  51           HN       TYR  51  -2.451  -2.255   6.382
  423    HA   TYR  51           HA       TYR  51  -5.112  -1.015   6.567
  424   1HB   TYR  51          HB2       TYR  51  -2.397   0.058   5.899
  425   2HB   TYR  51          HB1       TYR  51  -3.825   0.863   5.257
  426    HD1  TYR  51           HD1      TYR  51  -3.358  -0.748   8.582
  427    HD2  TYR  51           HD2      TYR  51  -3.907   2.880   6.429
  428    HE1  TYR  51           HE1      TYR  51  -3.624   0.464  10.704
  429    HE2  TYR  51           HE2      TYR  51  -4.173   4.102   8.545
  430    HH   TYR  51           HH       TYR  51  -3.444   2.695  11.587
  431    H    VAL  52           HN       VAL  52  -3.839  -3.337   4.826
  432    HA   VAL  52           HA       VAL  52  -5.419  -2.691   2.488
  433    HB   VAL  52           HB       VAL  52  -2.783  -3.707   1.675
  434   1HG1  VAL  52          HG11      VAL  52  -4.951  -2.750   0.400
  435   2HG1  VAL  52          HG12      VAL  52  -3.329  -2.755  -0.292
  436   3HG1  VAL  52          HG13      VAL  52  -3.960  -1.293   0.466
  437   1HG2  VAL  52          HG21      VAL  52  -2.016  -2.110   3.338
  438   2HG2  VAL  52          HG22      VAL  52  -3.041  -0.858   2.635
  439   3HG2  VAL  52          HG23      VAL  52  -1.687  -1.511   1.712
  440    H    GLU  53           HN       GLU  53  -5.558  -4.559   0.982
  441    HA   GLU  53           HA       GLU  53  -5.388  -7.075   2.496
  442   1HB   GLU  53          HB2       GLU  53  -7.205  -6.250   0.227
  443   2HB   GLU  53          HB1       GLU  53  -7.126  -7.884   0.870
  444   1HG   GLU  53          HG2       GLU  53  -7.691  -5.575   2.678
  445   2HG   GLU  53          HG1       GLU  53  -8.972  -6.278   1.692
  446    H    VAL  54           HN       VAL  54  -3.879  -8.468   1.884
  447    HA   VAL  54           HA       VAL  54  -2.343  -8.059  -0.493
  448    HB   VAL  54           HB       VAL  54  -1.317  -8.938   1.558
  449   1HG1  VAL  54          HG11      VAL  54  -1.986 -10.785   2.655
  450   2HG1  VAL  54          HG12      VAL  54  -2.350 -11.664   1.170
  451   3HG1  VAL  54          HG13      VAL  54  -3.508 -10.499   1.811
  452   1HG2  VAL  54          HG21      VAL  54   0.234 -10.100   0.409
  453   2HG2  VAL  54          HG22      VAL  54  -0.742  -9.648  -0.988
  454   3HG2  VAL  54          HG23      VAL  54  -0.948 -11.234  -0.245
  455    H    LEU  55           HN       LEU  55  -3.004  -8.631  -2.453
  456    HA   LEU  55           HA       LEU  55  -3.800 -11.282  -3.073
  457   1HB   LEU  55          HB2       LEU  55  -6.070 -10.671  -3.967
  458   2HB   LEU  55          HB1       LEU  55  -5.935 -10.739  -2.220
  459    HG   LEU  55           HG       LEU  55  -5.423  -8.058  -3.174
  460   1HD1  LEU  55          HD11      LEU  55  -7.227  -7.536  -4.421
  461   2HD1  LEU  55          HD12      LEU  55  -8.260  -8.722  -3.623
  462   3HD1  LEU  55          HD13      LEU  55  -7.131  -9.237  -4.876
  463   1HD2  LEU  55          HD21      LEU  55  -6.300  -9.185  -0.902
  464   2HD2  LEU  55          HD22      LEU  55  -7.842  -8.707  -1.612
  465   3HD2  LEU  55          HD23      LEU  55  -6.591  -7.498  -1.323
  466    HA   PRO  56           HA       PRO  56  -1.751  -8.684  -6.397
  467   1HB   PRO  56          HB2       PRO  56  -0.662 -11.411  -6.892
  468   2HB   PRO  56          HB1       PRO  56   0.166  -9.850  -6.900
  469   1HG   PRO  56          HG2       PRO  56   0.470 -11.533  -4.861
  470   2HG   PRO  56          HG1       PRO  56   0.349  -9.785  -4.588
  471   1HD   PRO  56          HD2       PRO  56  -1.697 -11.918  -4.159
  472   2HD   PRO  56          HD1       PRO  56  -1.374 -10.455  -3.207
  473    H    LEU  57           HN       LEU  57  -2.928  -8.351  -8.167
  474    HA   LEU  57           HA       LEU  57  -4.627 -10.488  -9.195
  475   1HB   LEU  57          HB2       LEU  57  -4.495  -7.561  -9.924
  476   2HB   LEU  57          HB1       LEU  57  -5.666  -8.708 -10.547
  477    HG   LEU  57           HG       LEU  57  -6.112  -9.022  -7.913
  478   1HD1  LEU  57          HD11      LEU  57  -6.202  -6.448  -7.224
  479   2HD1  LEU  57          HD12      LEU  57  -4.763  -6.410  -8.244
  480   3HD1  LEU  57          HD13      LEU  57  -4.828  -7.489  -6.850
  481   1HD2  LEU  57          HD21      LEU  57  -7.325  -6.724  -9.424
  482   2HD2  LEU  57          HD22      LEU  57  -8.081  -7.767  -8.220
  483   3HD2  LEU  57          HD23      LEU  57  -7.679  -8.407  -9.813
  484    H    GLU  58           HN       GLU  58  -2.032 -11.074  -9.678
  485    HA   GLU  58           HA       GLU  58  -1.922 -10.907 -12.587
  486   1HB   GLU  58          HB2       GLU  58   0.231  -9.927 -10.730
  487   2HB   GLU  58          HB1       GLU  58   0.616 -10.493 -12.349
  488   1HG   GLU  58          HG2       GLU  58   0.149  -8.484 -13.132
  489   2HG   GLU  58          HG1       GLU  58  -1.526  -8.697 -12.626
  Start of MODEL   17
    1   1H    MET   0          HT1       MET   0   4.736  -6.270  -8.522
    2   2H    MET   0          HT2       MET   0   6.230  -6.529  -9.326
    3   3H    MET   0          HT3       MET   0   6.178  -6.445  -7.612
    4    HA   MET   0           HA       MET   0   5.201  -8.551  -9.397
    5   1HB   MET   0          HB2       MET   0   7.559  -8.503  -8.559
    6   2HB   MET   0          HB1       MET   0   6.933  -8.580  -6.918
    7   1HG   MET   0          HG2       MET   0   5.712 -10.694  -8.263
    8   2HG   MET   0          HG1       MET   0   7.385 -10.694  -8.816
    9   1HE   MET   0          HE1       MET   0   8.827  -9.476  -6.019
   10   2HE   MET   0          HE2       MET   0   9.411 -10.608  -7.239
   11   3HE   MET   0          HE3       MET   0   9.403 -11.072  -5.537
   12    H    LYS   1           HN       LYS   1   4.747  -6.956  -6.316
   13    HA   LYS   1           HA       LYS   1   2.656  -8.907  -5.620
   14   1HB   LYS   1          HB2       LYS   1   4.592  -7.345  -4.031
   15   2HB   LYS   1          HB1       LYS   1   2.970  -7.431  -3.359
   16   1HG   LYS   1          HG2       LYS   1   3.204  -9.569  -2.762
   17   2HG   LYS   1          HG1       LYS   1   3.990 -10.006  -4.280
   18   1HD   LYS   1          HD2       LYS   1   5.993  -8.644  -3.246
   19   2HD   LYS   1          HD1       LYS   1   5.183  -9.034  -1.728
   20   1HE   LYS   1          HE2       LYS   1   5.199 -11.420  -3.169
   21   2HE   LYS   1          HE1       LYS   1   6.790 -10.711  -3.447
   22   1HZ   LYS   1          HZ1       LYS   1   7.101 -11.904  -1.521
   23   2HZ   LYS   1          HZ2       LYS   1   5.560 -11.564  -0.913
   24   3HZ   LYS   1          HZ3       LYS   1   6.755 -10.367  -0.902
   25    H    ALA   2           HN       ALA   2   0.612  -8.289  -5.813
   26    HA   ALA   2           HA       ALA   2   0.029  -5.408  -5.994
   27   1HB   ALA   2          HB1       ALA   2  -0.779  -6.122  -7.981
   28   2HB   ALA   2          HB2       ALA   2  -2.191  -6.531  -7.005
   29   3HB   ALA   2          HB3       ALA   2  -1.012  -7.777  -7.416
   30    H    ALA   3           HN       ALA   3  -1.238  -4.487  -4.504
   31    HA   ALA   3           HA       ALA   3  -2.874  -6.237  -2.790
   32   1HB   ALA   3          HB1       ALA   3  -0.612  -5.097  -1.886
   33   2HB   ALA   3          HB2       ALA   3  -2.012  -5.431  -0.867
   34   3HB   ALA   3          HB3       ALA   3  -1.767  -3.814  -1.528
   35    H    ARG   4           HN       ARG   4  -4.903  -5.558  -2.366
   36    HA   ARG   4           HA       ARG   4  -5.715  -2.986  -3.543
   37   1HB   ARG   4          HB2       ARG   4  -6.709  -5.201  -4.379
   38   2HB   ARG   4          HB1       ARG   4  -7.570  -5.254  -2.847
   39   1HG   ARG   4          HG2       ARG   4  -8.609  -3.091  -3.376
   40   2HG   ARG   4          HG1       ARG   4  -7.777  -3.091  -4.932
   41   1HD   ARG   4          HD2       ARG   4  -9.475  -5.424  -4.166
   42   2HD   ARG   4          HD1       ARG   4 -10.241  -3.946  -4.747
   43    HE   ARG   4           HE       ARG   4  -8.214  -4.615  -6.539
   44   1HH1  ARG   4          HH11      ARG   4 -11.264  -5.903  -5.434
   45   2HH1  ARG   4          HH12      ARG   4 -11.610  -6.703  -6.930
   46   1HH2  ARG   4          HH21      ARG   4  -8.669  -5.667  -8.508
   47   2HH2  ARG   4          HH22      ARG   4 -10.137  -6.571  -8.674
   48    H    LEU   5           HN       LEU   5  -6.000  -1.420  -2.109
   49    HA   LEU   5           HA       LEU   5  -6.144  -1.756   0.660
   50   1HB   LEU   5          HB2       LEU   5  -5.777   0.361  -0.959
   51   2HB   LEU   5          HB1       LEU   5  -7.446   0.638  -0.500
   52    HG   LEU   5           HG       LEU   5  -6.520   0.296   1.937
   53   1HD1  LEU   5          HD11      LEU   5  -4.273   0.901   2.280
   54   2HD1  LEU   5          HD12      LEU   5  -4.064   1.391   0.599
   55   3HD1  LEU   5          HD13      LEU   5  -4.244  -0.316   1.004
   56   1HD2  LEU   5          HD21      LEU   5  -6.500   2.677   0.161
   57   2HD2  LEU   5          HD22      LEU   5  -5.787   2.827   1.767
   58   3HD2  LEU   5          HD23      LEU   5  -7.473   2.340   1.592
   59    H    LYS   6           HN       LYS   6  -7.829  -1.666   2.139
   60    HA   LYS   6           HA       LYS   6 -10.524  -2.048   1.011
   61   1HB   LYS   6          HB2       LYS   6  -8.990  -3.846   2.566
   62   2HB   LYS   6          HB1       LYS   6 -10.291  -3.266   3.597
   63   1HG   LYS   6          HG2       LYS   6 -11.380  -3.872   1.043
   64   2HG   LYS   6          HG1       LYS   6 -10.390  -5.234   1.569
   65   1HD   LYS   6          HD2       LYS   6 -12.257  -5.846   2.671
   66   2HD   LYS   6          HD1       LYS   6 -11.715  -4.659   3.858
   67   1HE   LYS   6          HE2       LYS   6 -13.259  -3.510   1.657
   68   2HE   LYS   6          HE1       LYS   6 -14.161  -4.676   2.624
   69   1HZ   LYS   6          HZ1       LYS   6 -12.607  -2.730   4.116
   70   2HZ   LYS   6          HZ2       LYS   6 -14.162  -3.327   4.407
   71   3HZ   LYS   6          HZ3       LYS   6 -13.927  -2.107   3.260
   72    H    PHE   7           HN       PHE   7  -8.666   0.025   2.766
   73    HA   PHE   7           HA       PHE   7 -11.009   1.303   3.901
   74   1HB   PHE   7          HB2       PHE   7  -8.645   0.785   5.700
   75   2HB   PHE   7          HB1       PHE   7 -10.228   1.416   6.142
   76    HD1  PHE   7           HD1      PHE   7 -12.131  -0.059   6.391
   77    HD2  PHE   7           HD2      PHE   7  -8.294  -1.575   5.348
   78    HE1  PHE   7           HE1      PHE   7 -12.883  -2.335   6.947
   79    HE2  PHE   7           HE2      PHE   7  -9.039  -3.853   5.901
   80    HZ   PHE   7           HZ       PHE   7 -11.337  -4.236   6.702
   81    H    ASP   8           HN       ASP   8 -10.893   3.357   3.307
   82    HA   ASP   8           HA       ASP   8  -8.690   4.574   2.128
   83   1HB   ASP   8          HB2       ASP   8  -9.911   6.710   2.478
   84   2HB   ASP   8          HB1       ASP   8 -10.933   5.441   1.811
   85    H    PHE   9           HN       PHE   9  -6.845   5.331   2.918
   86    HA   PHE   9           HA       PHE   9  -6.732   6.047   5.775
   87   1HB   PHE   9          HB2       PHE   9  -5.459   3.962   5.024
   88   2HB   PHE   9          HB1       PHE   9  -4.384   5.058   4.163
   89    HD1  PHE   9           HD2      PHE   9  -5.980   5.394   7.507
   90    HD2  PHE   9           HD1      PHE   9  -2.369   4.992   5.291
   91    HE1  PHE   9           HE2      PHE   9  -4.681   5.733   9.570
   92    HE2  PHE   9           HE1      PHE   9  -1.063   5.330   7.349
   93    HZ   PHE   9           HZ       PHE   9  -2.219   5.702   9.492
   94    H    GLN  10           HN       GLN  10  -5.603   7.877   6.373
   95    HA   GLN  10           HA       GLN  10  -5.009   9.732   4.176
   96   1HB   GLN  10          HB2       GLN  10  -5.302  11.520   5.802
   97   2HB   GLN  10          HB1       GLN  10  -6.709  10.466   5.796
   98   1HG   GLN  10          HG2       GLN  10  -5.769   9.314   7.792
   99   2HG   GLN  10          HG1       GLN  10  -4.498  10.534   7.832
  100   1HE2  GLN  10          HE21      GLN  10  -7.678   9.749   8.705
  101   2HE2  GLN  10          HE22      GLN  10  -8.127  11.274   9.381
  102    H    ALA  11           HN       ALA  11  -3.013  10.531   3.865
  103    HA   ALA  11           HA       ALA  11  -0.768   9.295   4.972
  104   1HB   ALA  11          HB1       ALA  11  -0.509  10.307   2.866
  105   2HB   ALA  11          HB2       ALA  11   0.478  11.269   3.966
  106   3HB   ALA  11          HB3       ALA  11  -1.100  11.863   3.448
  107    H    GLN  12           HN       GLN  12  -0.410   9.345   7.114
  108    HA   GLN  12           HA       GLN  12  -0.951  11.612   8.753
  109   1HB   GLN  12          HB2       GLN  12   0.916   9.450   9.629
  110   2HB   GLN  12          HB1       GLN  12  -0.327  10.290  10.539
  111   1HG   GLN  12          HG2       GLN  12  -1.997   9.059   9.049
  112   2HG   GLN  12          HG1       GLN  12  -0.634   8.034   8.599
  113   1HE2  GLN  12          HE21      GLN  12  -2.729   9.046  11.198
  114   2HE2  GLN  12          HE22      GLN  12  -2.373   7.733  12.262
  115    H    SER  13           HN       SER  13   1.903  10.285   7.196
  116    HA   SER  13           HA       SER  13   3.425  12.640   8.105
  117   1HB   SER  13          HB2       SER  13   4.097  10.137   8.757
  118   2HB   SER  13          HB1       SER  13   4.875  10.210   7.176
  119    HG   SER  13           HG       SER  13   6.360  11.426   8.011
  120    HA   PRO  14           HA       PRO  14   4.038  14.040   3.986
  121   1HB   PRO  14          HB2       PRO  14   6.962  14.069   4.535
  122   2HB   PRO  14          HB1       PRO  14   5.909  15.373   3.975
  123   1HG   PRO  14          HG2       PRO  14   6.787  15.324   6.488
  124   2HG   PRO  14          HG1       PRO  14   5.133  15.842   6.111
  125   1HD   PRO  14          HD2       PRO  14   6.099  13.249   7.240
  126   2HD   PRO  14          HD1       PRO  14   4.632  14.172   7.627
  127    H    LYS  15           HN       LYS  15   6.032  11.402   5.154
  128    HA   LYS  15           HA       LYS  15   6.899  10.590   2.536
  129   1HB   LYS  15          HB2       LYS  15   8.071  10.183   4.808
  130   2HB   LYS  15          HB1       LYS  15   6.954   8.836   4.975
  131   1HG   LYS  15          HG2       LYS  15   9.041   8.042   4.094
  132   2HG   LYS  15          HG1       LYS  15   7.795   7.912   2.850
  133   1HD   LYS  15          HD2       LYS  15   9.009  10.476   2.630
  134   2HD   LYS  15          HD1       LYS  15  10.291   9.267   2.727
  135   1HE   LYS  15          HE2       LYS  15   9.290   8.030   0.890
  136   2HE   LYS  15          HE1       LYS  15   7.956   9.181   0.819
  137   1HZ   LYS  15          HZ1       LYS  15   9.496   9.747  -0.875
  138   2HZ   LYS  15          HZ2       LYS  15  10.808   9.701   0.193
  139   3HZ   LYS  15          HZ3       LYS  15   9.646  10.922   0.334
  140    H    GLU  16           HN       GLU  16   4.240   9.865   4.662
  141    HA   GLU  16           HA       GLU  16   3.435   7.471   3.302
  142   1HB   GLU  16          HB2       GLU  16   2.362   9.160   5.498
  143   2HB   GLU  16          HB1       GLU  16   1.206   8.170   4.618
  144   1HG   GLU  16          HG2       GLU  16   3.153   6.360   5.088
  145   2HG   GLU  16          HG1       GLU  16   3.315   7.394   6.506
  146    H    LEU  17           HN       LEU  17   1.358   7.249   2.180
  147    HA   LEU  17           HA       LEU  17   0.637   9.699   0.704
  148   1HB   LEU  17          HB2       LEU  17   1.962   7.918  -0.560
  149   2HB   LEU  17          HB1       LEU  17   0.517   6.930  -0.464
  150    HG   LEU  17           HG       LEU  17  -0.669   8.950  -1.571
  151   1HD1  LEU  17          HD11      LEU  17   1.035  10.073  -3.159
  152   2HD1  LEU  17          HD12      LEU  17   2.224   9.614  -1.940
  153   3HD1  LEU  17          HD13      LEU  17   0.880  10.670  -1.506
  154   1HD2  LEU  17          HD21      LEU  17   1.024   6.836  -2.730
  155   2HD2  LEU  17          HD22      LEU  17   0.559   8.135  -3.830
  156   3HD2  LEU  17          HD23      LEU  17  -0.682   7.201  -2.993
  157    H    THR  18           HN       THR  18  -1.479  10.166   0.483
  158    HA   THR  18           HA       THR  18  -3.357   8.592   2.029
  159    HB   THR  18           HB       THR  18  -3.819  11.148   0.481
  160    HG1  THR  18           HG1      THR  18  -2.614  11.956   1.991
  161   1HG2  THR  18          HG21      THR  18  -5.942  10.894   1.039
  162   2HG2  THR  18          HG22      THR  18  -5.452  11.086   2.722
  163   3HG2  THR  18          HG23      THR  18  -5.582   9.474   2.020
  164    H    LEU  19           HN       LEU  19  -4.642   7.089   1.203
  165    HA   LEU  19           HA       LEU  19  -5.594   7.340  -1.546
  166   1HB   LEU  19          HB2       LEU  19  -4.992   5.087  -2.138
  167   2HB   LEU  19          HB1       LEU  19  -3.553   5.957  -1.641
  168    HG   LEU  19           HG       LEU  19  -5.071   4.049   0.137
  169   1HD1  LEU  19          HD11      LEU  19  -2.938   3.624  -1.865
  170   2HD1  LEU  19          HD12      LEU  19  -4.200   2.531  -1.298
  171   3HD1  LEU  19          HD13      LEU  19  -2.758   2.798  -0.318
  172   1HD2  LEU  19          HD21      LEU  19  -2.604   4.187   1.161
  173   2HD2  LEU  19          HD22      LEU  19  -3.912   5.261   1.657
  174   3HD2  LEU  19          HD23      LEU  19  -2.721   5.808   0.477
  175    H    GLN  20           HN       GLN  20  -7.641   6.616  -1.833
  176    HA   GLN  20           HA       GLN  20  -9.103   5.830   0.536
  177   1HB   GLN  20          HB2       GLN  20  -9.751   7.389  -1.594
  178   2HB   GLN  20          HB1       GLN  20 -10.512   5.873  -2.056
  179   1HG   GLN  20          HG2       GLN  20 -11.910   5.871  -0.181
  180   2HG   GLN  20          HG1       GLN  20 -10.942   7.089   0.649
  181   1HE2  GLN  20          HE21      GLN  20 -11.112   9.253   0.018
  182   2HE2  GLN  20          HE22      GLN  20 -12.461   9.831  -0.893
  183    H    LYS  21           HN       LYS  21 -10.741   4.062   0.378
  184    HA   LYS  21           HA       LYS  21  -9.504   1.603  -0.104
  185   1HB   LYS  21          HB2       LYS  21 -11.387   1.928   1.460
  186   2HB   LYS  21          HB1       LYS  21 -12.464   2.190   0.095
  187   1HG   LYS  21          HG2       LYS  21 -10.913  -0.327   0.115
  188   2HG   LYS  21          HG1       LYS  21 -12.210  -0.164   1.301
  189   1HD   LYS  21          HD2       LYS  21 -13.433   0.737  -0.952
  190   2HD   LYS  21          HD1       LYS  21 -12.341  -0.479  -1.618
  191   1HE   LYS  21          HE2       LYS  21 -13.345  -1.803   0.523
  192   2HE   LYS  21          HE1       LYS  21 -14.721  -0.793   0.083
  193   1HZ   LYS  21          HZ1       LYS  21 -13.529  -3.024  -1.342
  194   2HZ   LYS  21          HZ2       LYS  21 -14.009  -1.718  -2.304
  195   3HZ   LYS  21          HZ3       LYS  21 -15.135  -2.493  -1.308
  196    H    GLY  22           HN       GLY  22  -9.694   0.071  -1.724
  197   1HA   GLY  22          HA2       GLY  22 -10.541  -0.802  -3.755
  198   2HA   GLY  22          HA1       GLY  22 -11.247   0.773  -4.107
  199    H    ASP  23           HN       ASP  23  -8.270   1.565  -3.108
  200    HA   ASP  23           HA       ASP  23  -7.307   1.822  -5.832
  201   1HB   ASP  23          HB2       ASP  23  -6.672   3.070  -3.215
  202   2HB   ASP  23          HB1       ASP  23  -5.356   2.968  -4.380
  203    H    ILE  24           HN       ILE  24  -5.712   0.675  -6.734
  204    HA   ILE  24           HA       ILE  24  -4.280  -1.251  -5.025
  205    HB   ILE  24           HB       ILE  24  -5.779  -2.290  -6.686
  206   1HG1  ILE  24          HG12      ILE  24  -3.563  -3.300  -5.913
  207   2HG1  ILE  24          HG11      ILE  24  -4.268  -3.966  -7.380
  208   1HG2  ILE  24          HG21      ILE  24  -4.372  -1.984  -9.088
  209   2HG2  ILE  24          HG22      ILE  24  -4.583  -0.360  -8.435
  210   3HG2  ILE  24          HG23      ILE  24  -5.987  -1.393  -8.698
  211   1HD1  ILE  24          HD11      ILE  24  -2.568  -1.885  -8.197
  212   2HD1  ILE  24          HD12      ILE  24  -2.339  -3.621  -8.397
  213   3HD1  ILE  24          HD13      ILE  24  -1.693  -2.806  -6.974
  214    H    VAL  25           HN       VAL  25  -2.078  -1.424  -5.177
  215    HA   VAL  25           HA       VAL  25  -0.684   0.249  -7.136
  216    HB   VAL  25           HB       VAL  25   0.849   1.102  -5.405
  217   1HG1  VAL  25          HG11      VAL  25  -2.077   1.724  -5.221
  218   2HG1  VAL  25          HG12      VAL  25  -0.793   2.643  -6.008
  219   3HG1  VAL  25          HG13      VAL  25  -0.893   2.596  -4.248
  220   1HG2  VAL  25          HG21      VAL  25  -0.765  -0.672  -3.709
  221   2HG2  VAL  25          HG22      VAL  25  -0.427   0.915  -3.018
  222   3HG2  VAL  25          HG23      VAL  25   0.902  -0.129  -3.522
  223    H    TYR  26           HN       TYR  26   1.613  -0.252  -7.320
  224    HA   TYR  26           HA       TYR  26   2.067  -3.111  -7.034
  225   1HB   TYR  26          HB2       TYR  26   3.842  -1.044  -8.345
  226   2HB   TYR  26          HB1       TYR  26   3.937  -2.792  -8.530
  227    HD1  TYR  26           HD1      TYR  26   1.301  -3.681  -9.101
  228    HD2  TYR  26           HD2      TYR  26   3.173  -0.060 -10.319
  229    HE1  TYR  26           HE1      TYR  26  -0.208  -3.560 -11.038
  230    HE2  TYR  26           HE2      TYR  26   1.668   0.072 -12.259
  231    HH   TYR  26           HH       TYR  26   0.293  -1.827 -13.655
  232    H    ILE  27           HN       ILE  27   2.904  -3.813  -5.192
  233    HA   ILE  27           HA       ILE  27   4.469  -2.096  -3.487
  234    HB   ILE  27           HB       ILE  27   3.996  -5.042  -3.093
  235   1HG1  ILE  27          HG12      ILE  27   1.806  -4.183  -3.403
  236   2HG1  ILE  27          HG11      ILE  27   2.039  -4.257  -1.660
  237   1HG2  ILE  27          HG21      ILE  27   5.675  -3.743  -1.699
  238   2HG2  ILE  27          HG22      ILE  27   4.439  -4.645  -0.823
  239   3HG2  ILE  27          HG23      ILE  27   4.288  -2.899  -1.013
  240   1HD1  ILE  27          HD11      ILE  27   1.856  -1.890  -3.453
  241   2HD1  ILE  27          HD12      ILE  27   2.779  -1.770  -1.954
  242   3HD1  ILE  27          HD13      ILE  27   1.069  -2.200  -1.905
  243    H    HIS  28           HN       HIS  28   6.613  -2.196  -3.046
  244    HA   HIS  28           HA       HIS  28   8.243  -3.852  -4.838
  245   1HB   HIS  28          HB2       HIS  28   8.416  -1.142  -3.987
  246   2HB   HIS  28          HB1       HIS  28   9.821  -1.987  -3.344
  247    HD1  HIS  28           HD1      HIS  28  10.598  -3.824  -5.580
  248    HD2  HIS  28           HD2      HIS  28   9.298   0.068  -6.235
  249    HE1  HIS  28           HE1      HIS  28  11.513  -3.181  -7.832
  250    HE2  HIS  28           HE2      HIS  28  10.789  -0.790  -8.166
  251    H    LYS  29           HN       LYS  29   7.897  -2.899  -1.451
  252    HA   LYS  29           HA       LYS  29   9.255  -5.387  -0.672
  253   1HB   LYS  29          HB2       LYS  29  10.333  -4.215   1.199
  254   2HB   LYS  29          HB1       LYS  29  10.849  -3.563  -0.350
  255   1HG   LYS  29          HG2       LYS  29  10.032  -1.537   0.100
  256   2HG   LYS  29          HG1       LYS  29   8.537  -2.188   0.773
  257   1HD   LYS  29          HD2       LYS  29  10.079  -2.863   2.774
  258   2HD   LYS  29          HD1       LYS  29  11.136  -1.607   2.125
  259   1HE   LYS  29          HE2       LYS  29   8.251  -0.977   2.501
  260   2HE   LYS  29          HE1       LYS  29   9.281  -1.065   3.929
  261   1HZ   LYS  29          HZ1       LYS  29  10.264   0.499   1.669
  262   2HZ   LYS  29          HZ2       LYS  29  10.431   0.776   3.329
  263   3HZ   LYS  29          HZ3       LYS  29   8.976   1.151   2.553
  264    H    GLU  30           HN       GLU  30   8.448  -6.375   1.193
  265    HA   GLU  30           HA       GLU  30   5.909  -5.243   2.169
  266   1HB   GLU  30          HB2       GLU  30   6.641  -7.916   1.248
  267   2HB   GLU  30          HB1       GLU  30   5.815  -7.920   2.800
  268   1HG   GLU  30          HG2       GLU  30   4.665  -6.291   0.602
  269   2HG   GLU  30          HG1       GLU  30   4.497  -8.044   0.527
  270    H    VAL  31           HN       VAL  31   5.965  -4.529   4.154
  271    HA   VAL  31           HA       VAL  31   7.810  -5.791   6.075
  272    HB   VAL  31           HB       VAL  31   6.603  -3.116   6.545
  273   1HG1  VAL  31          HG11      VAL  31   8.759  -4.760   7.656
  274   2HG1  VAL  31          HG12      VAL  31   7.742  -3.547   8.431
  275   3HG1  VAL  31          HG13      VAL  31   9.146  -3.048   7.489
  276   1HG2  VAL  31          HG21      VAL  31   8.422  -1.986   5.438
  277   2HG2  VAL  31          HG22      VAL  31   7.632  -3.053   4.279
  278   3HG2  VAL  31          HG23      VAL  31   9.165  -3.525   5.009
  279    H    ASP  32           HN       ASP  32   6.410  -7.340   6.730
  280    HA   ASP  32           HA       ASP  32   3.719  -6.991   7.452
  281   1HB   ASP  32          HB2       ASP  32   5.776  -9.095   7.911
  282   2HB   ASP  32          HB1       ASP  32   4.333  -9.132   8.919
  283    H    LYS  33           HN       LYS  33   6.705  -6.705   9.288
  284    HA   LYS  33           HA       LYS  33   5.393  -6.398  11.818
  285   1HB   LYS  33          HB2       LYS  33   8.036  -6.802  10.928
  286   2HB   LYS  33          HB1       LYS  33   8.043  -5.264  11.779
  287   1HG   LYS  33          HG2       LYS  33   6.693  -6.658  13.573
  288   2HG   LYS  33          HG1       LYS  33   7.540  -8.002  12.804
  289   1HD   LYS  33          HD2       LYS  33   9.041  -5.551  13.641
  290   2HD   LYS  33          HD1       LYS  33   8.632  -6.792  14.827
  291   1HE   LYS  33          HE2       LYS  33  10.556  -7.750  14.191
  292   2HE   LYS  33          HE1       LYS  33   9.638  -8.290  12.785
  293   1HZ   LYS  33          HZ1       LYS  33  10.383  -5.889  11.958
  294   2HZ   LYS  33          HZ2       LYS  33  11.322  -7.274  11.710
  295   3HZ   LYS  33          HZ3       LYS  33  11.682  -6.228  12.989
  296    H    ASN  34           HN       ASN  34   6.113  -4.335   9.179
  297    HA   ASN  34           HA       ASN  34   5.092  -2.046  10.681
  298   1HB   ASN  34          HB2       ASN  34   7.404  -1.610   8.836
  299   2HB   ASN  34          HB1       ASN  34   6.844  -0.609  10.168
  300   1HD2  ASN  34          HD21      ASN  34   8.089  -0.624  11.880
  301   2HD2  ASN  34          HD22      ASN  34   9.129  -1.910  12.380
  302    H    TRP  35           HN       TRP  35   6.028  -0.489   8.173
  303    HA   TRP  35           HA       TRP  35   3.635  -1.120   6.611
  304   1HB   TRP  35          HB2       TRP  35   4.358   1.227   5.588
  305   2HB   TRP  35          HB1       TRP  35   3.406   1.108   7.060
  306    HD1  TRP  35           HD1      TRP  35   6.703   2.350   5.746
  307    HE1  TRP  35           HE1      TRP  35   8.035   3.449   7.654
  308    HE3  TRP  35           HE3      TRP  35   3.815   0.883   9.701
  309    HZ2  TRP  35           HZ2      TRP  35   7.881   3.666  10.465
  310    HZ3  TRP  35           HZ3      TRP  35   4.477   1.578  11.967
  311    HH2  TRP  35           HH2      TRP  35   6.468   2.940  12.339
  312    H    LEU  36           HN       LEU  36   3.692  -1.701   4.544
  313    HA   LEU  36           HA       LEU  36   6.202  -2.485   3.373
  314   1HB   LEU  36          HB2       LEU  36   4.856  -3.414   1.594
  315   2HB   LEU  36          HB1       LEU  36   4.166  -3.851   3.147
  316    HG   LEU  36           HG       LEU  36   3.096  -1.415   1.846
  317   1HD1  LEU  36          HD11      LEU  36   3.150  -3.992   0.524
  318   2HD1  LEU  36          HD12      LEU  36   2.625  -2.421  -0.081
  319   3HD1  LEU  36          HD13      LEU  36   1.503  -3.436   0.823
  320   1HD2  LEU  36          HD21      LEU  36   2.242  -3.496   3.750
  321   2HD2  LEU  36          HD22      LEU  36   0.991  -2.882   2.670
  322   3HD2  LEU  36          HD23      LEU  36   1.879  -1.771   3.712
  323    H    GLU  37           HN       GLU  37   6.573  -1.930   0.979
  324    HA   GLU  37           HA       GLU  37   6.320   0.978   0.704
  325   1HB   GLU  37          HB2       GLU  37   8.594   0.002   0.631
  326   2HB   GLU  37          HB1       GLU  37   8.130  -0.929  -0.786
  327   1HG   GLU  37          HG2       GLU  37   7.828   1.074  -2.071
  328   2HG   GLU  37          HG1       GLU  37   8.105   2.075  -0.647
  329    H    GLY  38           HN       GLY  38   5.101   1.887  -0.833
  330   1HA   GLY  38          HA2       GLY  38   4.119   0.154  -3.016
  331   2HA   GLY  38          HA1       GLY  38   3.048   1.244  -2.148
  332    H    GLU  39           HN       GLU  39   3.290   1.345  -4.897
  333    HA   GLU  39           HA       GLU  39   4.246   4.065  -5.236
  334   1HB   GLU  39          HB2       GLU  39   5.744   1.801  -6.154
  335   2HB   GLU  39          HB1       GLU  39   5.148   2.692  -7.549
  336   1HG   GLU  39          HG2       GLU  39   6.256   4.662  -6.887
  337   2HG   GLU  39          HG1       GLU  39   6.583   4.025  -5.276
  338    H    HIS  40           HN       HIS  40   3.237   5.166  -6.941
  339    HA   HIS  40           HA       HIS  40   1.406   3.714  -8.668
  340   1HB   HIS  40          HB2       HIS  40   0.327   4.443  -6.359
  341   2HB   HIS  40          HB1       HIS  40   0.200   5.998  -7.174
  342    HD1  HIS  40           HD1      HIS  40  -0.389   4.562 -10.024
  343    HD2  HIS  40           HD2      HIS  40  -2.443   4.054  -6.448
  344    HE1  HIS  40           HE1      HIS  40  -2.680   3.754 -10.674
  345    HE2  HIS  40           HE2      HIS  40  -3.934   3.544  -8.499
  346    H    HIS  41           HN       HIS  41   1.490   4.555 -10.636
  347    HA   HIS  41           HA       HIS  41   1.995   5.944 -12.367
  348   1HB   HIS  41          HB2       HIS  41   0.418   7.541 -10.448
  349   2HB   HIS  41          HB1       HIS  41   1.295   8.471 -11.658
  350    HD1  HIS  41           HD1      HIS  41  -1.717   6.453 -11.174
  351    HD2  HIS  41           HD2      HIS  41   0.562   7.785 -14.384
  352    HE1  HIS  41           HE1      HIS  41  -3.175   6.160 -13.201
  353    HE2  HIS  41           HE2      HIS  41  -1.786   6.996 -15.130
  354    H    GLY  42           HN       GLY  42   4.167   5.415 -10.631
  355   1HA   GLY  42          HA2       GLY  42   6.389   6.120 -10.703
  356   2HA   GLY  42          HA1       GLY  42   5.853   7.670 -11.332
  357    H    ARG  43           HN       ARG  43   3.862   7.421  -8.866
  358    HA   ARG  43           HA       ARG  43   5.596   8.953  -7.108
  359   1HB   ARG  43          HB2       ARG  43   3.424   9.899  -7.526
  360   2HB   ARG  43          HB1       ARG  43   2.626   8.397  -7.082
  361   1HG   ARG  43          HG2       ARG  43   2.387  10.025  -5.317
  362   2HG   ARG  43          HG1       ARG  43   3.395   8.684  -4.769
  363   1HD   ARG  43          HD2       ARG  43   4.964  10.147  -4.202
  364   2HD   ARG  43          HD1       ARG  43   5.140  10.575  -5.903
  365    HE   ARG  43           HE       ARG  43   3.029  12.064  -5.127
  366   1HH1  ARG  43          HH11      ARG  43   6.231  11.629  -3.808
  367   2HH1  ARG  43          HH12      ARG  43   6.306  13.223  -3.136
  368   1HH2  ARG  43          HH21      ARG  43   3.127  14.161  -4.245
  369   2HH2  ARG  43          HH22      ARG  43   4.545  14.662  -3.386
  370    H    LEU  44           HN       LEU  44   5.806   8.482  -4.853
  371    HA   LEU  44           HA       LEU  44   5.798   5.605  -4.330
  372   1HB   LEU  44          HB2       LEU  44   7.917   6.665  -3.983
  373   2HB   LEU  44          HB1       LEU  44   7.192   7.921  -2.998
  374    HG   LEU  44           HG       LEU  44   6.610   6.136  -1.317
  375   1HD1  LEU  44          HD11      LEU  44   7.367   3.983  -1.491
  376   2HD1  LEU  44          HD12      LEU  44   8.685   4.417  -2.580
  377   3HD1  LEU  44          HD13      LEU  44   7.031   4.336  -3.186
  378   1HD2  LEU  44          HD21      LEU  44   8.464   7.608  -0.919
  379   2HD2  LEU  44          HD22      LEU  44   9.504   6.656  -1.979
  380   3HD2  LEU  44          HD23      LEU  44   8.934   5.973  -0.456
  381    H    GLY  45           HN       GLY  45   4.416   4.685  -2.966
  382   1HA   GLY  45          HA2       GLY  45   3.024   6.385  -1.004
  383   2HA   GLY  45          HA1       GLY  45   2.112   5.298  -2.041
  384    H    ILE  46           HN       ILE  46   3.558   5.636   0.935
  385    HA   ILE  46           HA       ILE  46   3.726   2.714   1.289
  386    HB   ILE  46           HB       ILE  46   5.173   4.858   2.849
  387   1HG1  ILE  46          HG12      ILE  46   6.151   2.926   0.737
  388   2HG1  ILE  46          HG11      ILE  46   6.033   4.675   0.578
  389   1HG2  ILE  46          HG21      ILE  46   6.318   2.267   3.139
  390   2HG2  ILE  46          HG22      ILE  46   4.602   2.172   3.520
  391   3HG2  ILE  46          HG23      ILE  46   5.629   3.317   4.375
  392   1HD1  ILE  46          HD11      ILE  46   8.306   4.150   0.957
  393   2HD1  ILE  46          HD12      ILE  46   7.907   3.109   2.324
  394   3HD1  ILE  46          HD13      ILE  46   7.687   4.855   2.451
  395    H    PHE  47           HN       PHE  47   2.840   1.788   3.116
  396    HA   PHE  47           HA       PHE  47   1.532   3.337   5.148
  397   1HB   PHE  47          HB2       PHE  47  -0.728   2.210   4.633
  398   2HB   PHE  47          HB1       PHE  47  -0.259   3.589   3.644
  399    HD1  PHE  47           HD2      PHE  47   0.198  -0.118   3.640
  400    HD2  PHE  47           HD1      PHE  47  -0.637   3.400   1.396
  401    HE1  PHE  47           HE2      PHE  47  -0.086  -1.484   1.613
  402    HE2  PHE  47           HE1      PHE  47  -0.924   2.041  -0.636
  403    HZ   PHE  47           HZ       PHE  47  -0.648  -0.404  -0.529
  404    HA   PRO  48           HA       PRO  48   2.241  -0.357   7.445
  405   1HB   PRO  48          HB2       PRO  48  -0.295  -0.073   8.881
  406   2HB   PRO  48          HB1       PRO  48   1.361   0.061   9.484
  407   1HG   PRO  48          HG2       PRO  48  -0.268   2.205   9.238
  408   2HG   PRO  48          HG1       PRO  48   1.488   2.309   9.024
  409   1HD   PRO  48          HD2       PRO  48  -0.674   2.220   6.957
  410   2HD   PRO  48          HD1       PRO  48   0.820   3.180   6.986
  411    H    ALA  49           HN       ALA  49   1.905  -2.485   7.201
  412    HA   ALA  49           HA       ALA  49   0.109  -3.464   5.289
  413   1HB   ALA  49          HB1       ALA  49   1.807  -4.930   5.468
  414   2HB   ALA  49          HB2       ALA  49   0.749  -5.702   6.648
  415   3HB   ALA  49          HB3       ALA  49   2.035  -4.622   7.189
  416    H    ASN  50           HN       ASN  50  -0.402  -2.724   8.592
  417    HA   ASN  50           HA       ASN  50  -2.463  -4.615   9.122
  418   1HB   ASN  50          HB2       ASN  50  -1.402  -2.176  10.465
  419   2HB   ASN  50          HB1       ASN  50  -2.998  -2.750  10.937
  420   1HD2  ASN  50          HD21      ASN  50  -2.825  -3.812  12.767
  421   2HD2  ASN  50          HD22      ASN  50  -1.619  -4.987  13.153
  422    H    TYR  51           HN       TYR  51  -2.421  -1.973   7.072
  423    HA   TYR  51           HA       TYR  51  -5.268  -1.396   7.468
  424   1HB   TYR  51          HB2       TYR  51  -3.015   0.212   6.765
  425   2HB   TYR  51          HB1       TYR  51  -4.159   0.249   5.429
  426    HD1  TYR  51           HD2      TYR  51  -3.699   1.002   9.008
  427    HD2  TYR  51           HD1      TYR  51  -6.258   1.382   5.629
  428    HE1  TYR  51           HE2      TYR  51  -5.055   2.653  10.226
  429    HE2  TYR  51           HE1      TYR  51  -7.619   3.034   6.838
  430    HH   TYR  51           HH       TYR  51  -7.362   4.616   8.712
  431    H    VAL  52           HN       VAL  52  -2.993  -2.733   5.173
  432    HA   VAL  52           HA       VAL  52  -5.258  -3.370   3.394
  433    HB   VAL  52           HB       VAL  52  -3.758  -1.741   2.337
  434   1HG1  VAL  52          HG11      VAL  52  -1.708  -3.638   3.259
  435   2HG1  VAL  52          HG12      VAL  52  -1.614  -1.895   3.003
  436   3HG1  VAL  52          HG13      VAL  52  -1.471  -2.997   1.633
  437   1HG2  VAL  52          HG21      VAL  52  -3.327  -4.380   0.973
  438   2HG2  VAL  52          HG22      VAL  52  -3.610  -2.796   0.251
  439   3HG2  VAL  52          HG23      VAL  52  -4.923  -3.636   1.077
  440    H    GLU  53           HN       GLU  53  -5.007  -5.352   2.129
  441    HA   GLU  53           HA       GLU  53  -3.553  -7.396   3.660
  442   1HB   GLU  53          HB2       GLU  53  -6.175  -7.310   2.351
  443   2HB   GLU  53          HB1       GLU  53  -5.257  -8.765   1.988
  444   1HG   GLU  53          HG2       GLU  53  -5.016  -9.226   4.361
  445   2HG   GLU  53          HG1       GLU  53  -5.892  -7.746   4.748
  446    H    VAL  54           HN       VAL  54  -2.417  -9.049   2.549
  447    HA   VAL  54           HA       VAL  54  -1.327  -8.143  -0.010
  448    HB   VAL  54           HB       VAL  54  -0.312 -10.397   1.721
  449   1HG1  VAL  54          HG11      VAL  54   1.346  -8.788  -0.166
  450   2HG1  VAL  54          HG12      VAL  54   0.307 -10.065  -0.799
  451   3HG1  VAL  54          HG13      VAL  54   1.558 -10.450   0.383
  452   1HG2  VAL  54          HG21      VAL  54   0.202  -7.452   1.835
  453   2HG2  VAL  54          HG22      VAL  54   1.463  -8.594   2.298
  454   3HG2  VAL  54          HG23      VAL  54  -0.080  -8.590   3.152
  455    H    LEU  55           HN       LEU  55  -2.206  -8.941  -1.795
  456    HA   LEU  55           HA       LEU  55  -2.492 -11.764  -2.174
  457   1HB   LEU  55          HB2       LEU  55  -4.944 -11.568  -2.814
  458   2HB   LEU  55          HB1       LEU  55  -4.567 -11.586  -1.102
  459    HG   LEU  55           HG       LEU  55  -4.596  -8.869  -1.917
  460   1HD1  LEU  55          HD11      LEU  55  -6.667  -8.535  -2.945
  461   2HD1  LEU  55          HD12      LEU  55  -7.188 -10.192  -2.641
  462   3HD1  LEU  55          HD13      LEU  55  -5.943  -9.866  -3.846
  463   1HD2  LEU  55          HD21      LEU  55  -6.109  -8.625  -0.174
  464   2HD2  LEU  55          HD22      LEU  55  -5.206 -10.068   0.287
  465   3HD2  LEU  55          HD23      LEU  55  -6.811 -10.223  -0.426
  466    HA   PRO  56           HA       PRO  56  -1.329  -9.146  -5.886
  467   1HB   PRO  56          HB2       PRO  56   0.033 -11.751  -6.385
  468   2HB   PRO  56          HB1       PRO  56   0.630 -10.105  -6.625
  469   1HG   PRO  56          HG2       PRO  56   1.454 -11.554  -4.551
  470   2HG   PRO  56          HG1       PRO  56   1.133  -9.818  -4.378
  471   1HD   PRO  56          HD2       PRO  56  -0.501 -12.148  -3.482
  472   2HD   PRO  56          HD1       PRO  56  -0.269 -10.566  -2.711
  473    H    LEU  57           HN       LEU  57  -1.996  -9.402  -8.043
  474    HA   LEU  57           HA       LEU  57  -3.523 -11.807  -8.710
  475   1HB   LEU  57          HB2       LEU  57  -4.630  -9.028  -9.100
  476   2HB   LEU  57          HB1       LEU  57  -5.430 -10.542  -9.476
  477    HG   LEU  57           HG       LEU  57  -5.028 -10.929  -6.854
  478   1HD1  LEU  57          HD11      LEU  57  -5.359  -8.900  -5.609
  479   2HD1  LEU  57          HD12      LEU  57  -5.428  -7.952  -7.095
  480   3HD1  LEU  57          HD13      LEU  57  -3.919  -8.728  -6.613
  481   1HD2  LEU  57          HD21      LEU  57  -7.300  -9.256  -7.906
  482   2HD2  LEU  57          HD22      LEU  57  -7.321 -10.358  -6.530
  483   3HD2  LEU  57          HD23      LEU  57  -7.158 -10.994  -8.167
  484    H    GLU  58           HN       GLU  58  -4.107 -11.877 -11.042
  485    HA   GLU  58           HA       GLU  58  -2.423 -10.218 -12.759
  486   1HB   GLU  58          HB2       GLU  58  -2.140 -13.153 -12.345
  487   2HB   GLU  58          HB1       GLU  58  -1.949 -12.538 -13.981
  488   1HG   GLU  58          HG2       GLU  58  -0.452 -11.247 -11.753
  489   2HG   GLU  58          HG1       GLU  58   0.110 -12.787 -12.404
  Start of MODEL   18
    1   1H    MET   0          HT1       MET   0   5.187  -6.022  -9.225
    2   2H    MET   0          HT2       MET   0   6.733  -6.714  -9.502
    3   3H    MET   0          HT3       MET   0   6.296  -6.186  -7.928
    4    HA   MET   0           HA       MET   0   4.815  -8.268  -9.365
    5   1HB   MET   0          HB2       MET   0   7.260  -8.485  -7.604
    6   2HB   MET   0          HB1       MET   0   6.191  -9.842  -7.930
    7   1HG   MET   0          HG2       MET   0   7.522 -10.274  -9.653
    8   2HG   MET   0          HG1       MET   0   6.741  -8.906 -10.444
    9   1HE   MET   0          HE1       MET   0  10.265  -9.891  -8.451
   10   2HE   MET   0          HE2       MET   0  10.986  -9.497 -10.011
   11   3HE   MET   0          HE3       MET   0   9.624 -10.614  -9.927
   12    H    LYS   1           HN       LYS   1   3.586  -9.580  -7.870
   13    HA   LYS   1           HA       LYS   1   2.120  -9.870  -6.158
   14   1HB   LYS   1          HB2       LYS   1   4.584  -9.049  -4.953
   15   2HB   LYS   1          HB1       LYS   1   3.251  -8.344  -4.049
   16   1HG   LYS   1          HG2       LYS   1   3.100 -10.278  -2.977
   17   2HG   LYS   1          HG1       LYS   1   2.459 -10.963  -4.472
   18   1HD   LYS   1          HD2       LYS   1   4.358 -12.091  -4.914
   19   2HD   LYS   1          HD1       LYS   1   5.389 -10.769  -4.360
   20   1HE   LYS   1          HE2       LYS   1   5.628 -12.768  -2.959
   21   2HE   LYS   1          HE1       LYS   1   4.995 -11.397  -2.049
   22   1HZ   LYS   1          HZ1       LYS   1   3.038 -13.193  -3.247
   23   2HZ   LYS   1          HZ2       LYS   1   3.003 -12.392  -1.758
   24   3HZ   LYS   1          HZ3       LYS   1   3.920 -13.802  -1.937
   25    H    ALA   2           HN       ALA   2   0.222  -8.896  -6.331
   26    HA   ALA   2           HA       ALA   2   0.096  -5.971  -6.001
   27   1HB   ALA   2          HB1       ALA   2  -2.160  -6.300  -7.222
   28   2HB   ALA   2          HB2       ALA   2  -1.490  -7.862  -7.695
   29   3HB   ALA   2          HB3       ALA   2  -0.666  -6.372  -8.156
   30    H    ALA   3           HN       ALA   3  -1.553  -5.073  -4.733
   31    HA   ALA   3           HA       ALA   3  -3.072  -6.963  -3.066
   32   1HB   ALA   3          HB1       ALA   3  -0.913  -5.747  -2.070
   33   2HB   ALA   3          HB2       ALA   3  -2.341  -6.107  -1.099
   34   3HB   ALA   3          HB3       ALA   3  -2.109  -4.488  -1.761
   35    H    ARG   4           HN       ARG   4  -5.078  -6.254  -2.335
   36    HA   ARG   4           HA       ARG   4  -6.142  -3.938  -3.792
   37   1HB   ARG   4          HB2       ARG   4  -7.214  -6.166  -4.145
   38   2HB   ARG   4          HB1       ARG   4  -7.663  -6.176  -2.445
   39   1HG   ARG   4          HG2       ARG   4  -9.137  -4.351  -2.725
   40   2HG   ARG   4          HG1       ARG   4  -8.509  -4.002  -4.337
   41   1HD   ARG   4          HD2       ARG   4  -9.937  -6.547  -3.584
   42   2HD   ARG   4          HD1       ARG   4 -10.722  -5.152  -4.323
   43    HE   ARG   4           HE       ARG   4  -9.047  -7.093  -5.622
   44   1HH1  ARG   4          HH11      ARG   4 -10.274  -3.828  -5.755
   45   2HH1  ARG   4          HH12      ARG   4 -10.060  -3.685  -7.467
   46   1HH2  ARG   4          HH21      ARG   4  -8.764  -6.905  -7.874
   47   2HH2  ARG   4          HH22      ARG   4  -9.203  -5.431  -8.671
   48    H    LEU   5           HN       LEU   5  -6.865  -2.183  -2.755
   49    HA   LEU   5           HA       LEU   5  -6.254  -1.704  -0.072
   50   1HB   LEU   5          HB2       LEU   5  -7.648  -0.306  -2.231
   51   2HB   LEU   5          HB1       LEU   5  -8.238   0.116  -0.636
   52    HG   LEU   5           HG       LEU   5  -5.318   0.127  -0.822
   53   1HD1  LEU   5          HD11      LEU   5  -6.590   1.128  -3.065
   54   2HD1  LEU   5          HD12      LEU   5  -4.956   1.510  -2.525
   55   3HD1  LEU   5          HD13      LEU   5  -6.303   2.551  -2.067
   56   1HD2  LEU   5          HD21      LEU   5  -5.642   2.306   0.288
   57   2HD2  LEU   5          HD22      LEU   5  -6.491   0.993   1.102
   58   3HD2  LEU   5          HD23      LEU   5  -7.384   2.126   0.087
   59    H    LYS   6           HN       LYS   6  -8.072  -0.789   1.454
   60    HA   LYS   6           HA       LYS   6 -10.593  -2.107   1.417
   61   1HB   LYS   6          HB2       LYS   6  -8.383  -3.546   2.553
   62   2HB   LYS   6          HB1       LYS   6  -9.535  -3.151   3.821
   63   1HG   LYS   6          HG2       LYS   6 -11.064  -4.058   1.656
   64   2HG   LYS   6          HG1       LYS   6  -9.689  -5.157   1.779
   65   1HD   LYS   6          HD2       LYS   6 -10.398  -4.893   4.392
   66   2HD   LYS   6          HD1       LYS   6 -11.967  -4.765   3.593
   67   1HE   LYS   6          HE2       LYS   6 -10.202  -6.921   2.629
   68   2HE   LYS   6          HE1       LYS   6 -10.807  -7.104   4.274
   69   1HZ   LYS   6          HZ1       LYS   6 -12.909  -7.409   3.563
   70   2HZ   LYS   6          HZ2       LYS   6 -12.148  -7.910   2.138
   71   3HZ   LYS   6          HZ3       LYS   6 -12.762  -6.339   2.260
   72    H    PHE   7           HN       PHE   7  -8.117  -0.455   3.317
   73    HA   PHE   7           HA       PHE   7 -10.274   1.018   4.675
   74   1HB   PHE   7          HB2       PHE   7  -7.627   0.258   5.923
   75   2HB   PHE   7          HB1       PHE   7  -8.964   1.091   6.710
   76    HD1  PHE   7           HD1      PHE   7 -10.993  -0.113   7.321
   77    HD2  PHE   7           HD2      PHE   7  -7.667  -2.112   5.573
   78    HE1  PHE   7           HE1      PHE   7 -11.924  -2.277   8.033
   79    HE2  PHE   7           HE2      PHE   7  -8.592  -4.279   6.281
   80    HZ   PHE   7           HZ       PHE   7 -10.723  -4.363   7.513
   81    H    ASP   8           HN       ASP   8 -10.255   2.979   3.780
   82    HA   ASP   8           HA       ASP   8  -8.145   4.225   2.482
   83   1HB   ASP   8          HB2       ASP   8 -10.589   4.880   2.427
   84   2HB   ASP   8          HB1       ASP   8 -10.331   5.681   3.974
   85    H    PHE   9           HN       PHE   9  -6.352   5.233   3.131
   86    HA   PHE   9           HA       PHE   9  -6.157   6.061   5.951
   87   1HB   PHE   9          HB2       PHE   9  -4.834   3.942   5.143
   88   2HB   PHE   9          HB1       PHE   9  -3.741   5.132   4.444
   89    HD1  PHE   9           HD1      PHE   9  -5.542   4.619   7.676
   90    HD2  PHE   9           HD2      PHE   9  -1.912   5.650   5.711
   91    HE1  PHE   9           HE1      PHE   9  -4.438   4.879   9.860
   92    HE2  PHE   9           HE2      PHE   9  -0.801   5.912   7.890
   93    HZ   PHE   9           HZ       PHE   9  -2.065   5.526   9.969
   94    H    GLN  10           HN       GLN  10  -5.206   8.004   6.371
   95    HA   GLN  10           HA       GLN  10  -4.618   9.674   4.031
   96   1HB   GLN  10          HB2       GLN  10  -6.292  10.185   6.083
   97   2HB   GLN  10          HB1       GLN  10  -4.817  10.897   6.723
   98   1HG   GLN  10          HG2       GLN  10  -4.705  12.046   4.382
   99   2HG   GLN  10          HG1       GLN  10  -6.430  11.686   4.348
  100   1HE2  GLN  10          HE21      GLN  10  -6.911  13.899   4.374
  101   2HE2  GLN  10          HE22      GLN  10  -6.778  14.838   5.818
  102    H    ALA  11           HN       ALA  11  -2.552   9.944   3.534
  103    HA   ALA  11           HA       ALA  11  -0.406   9.186   5.186
  104   1HB   ALA  11          HB1       ALA  11   0.979  10.469   3.488
  105   2HB   ALA  11          HB2       ALA  11  -0.544  10.834   2.678
  106   3HB   ALA  11          HB3       ALA  11  -0.025   9.159   2.865
  107    H    GLN  12           HN       GLN  12  -0.277  10.176   7.140
  108    HA   GLN  12           HA       GLN  12  -0.727  12.921   7.603
  109   1HB   GLN  12          HB2       GLN  12   0.617  12.402   9.747
  110   2HB   GLN  12          HB1       GLN  12  -0.923  11.595   9.507
  111   1HG   GLN  12          HG2       GLN  12   1.319  10.106   8.408
  112   2HG   GLN  12          HG1       GLN  12   1.467  10.397  10.141
  113   1HE2  GLN  12          HE21      GLN  12  -1.079  10.284  11.011
  114   2HE2  GLN  12          HE22      GLN  12  -1.748   8.715  10.735
  115    H    SER  13           HN       SER  13   2.179  11.057   6.904
  116    HA   SER  13           HA       SER  13   3.769  13.524   6.962
  117   1HB   SER  13          HB2       SER  13   5.709  11.838   6.733
  118   2HB   SER  13          HB1       SER  13   4.852  11.898   8.273
  119    HG   SER  13           HG       SER  13   4.363  10.044   6.178
  120    HA   PRO  14           HA       PRO  14   3.990  13.908   2.578
  121   1HB   PRO  14          HB2       PRO  14   6.914  14.312   2.939
  122   2HB   PRO  14          HB1       PRO  14   5.724  15.346   2.142
  123   1HG   PRO  14          HG2       PRO  14   6.700  15.986   4.537
  124   2HG   PRO  14          HG1       PRO  14   4.997  16.274   4.137
  125   1HD   PRO  14          HD2       PRO  14   6.214  14.124   5.817
  126   2HD   PRO  14          HD1       PRO  14   4.686  15.001   6.037
  127    H    LYS  15           HN       LYS  15   6.267  11.833   4.254
  128    HA   LYS  15           HA       LYS  15   7.165  10.468   1.902
  129   1HB   LYS  15          HB2       LYS  15   7.593  10.230   4.824
  130   2HB   LYS  15          HB1       LYS  15   7.811   8.760   3.885
  131   1HG   LYS  15          HG2       LYS  15   9.333  10.162   2.384
  132   2HG   LYS  15          HG1       LYS  15   9.315  11.344   3.694
  133   1HD   LYS  15          HD2       LYS  15  11.156  10.127   4.294
  134   2HD   LYS  15          HD1       LYS  15   9.906   9.218   5.146
  135   1HE   LYS  15          HE2       LYS  15  11.361   7.679   4.000
  136   2HE   LYS  15          HE1       LYS  15   9.778   7.668   3.223
  137   1HZ   LYS  15          HZ1       LYS  15  12.004   9.341   2.223
  138   2HZ   LYS  15          HZ2       LYS  15  10.587   8.892   1.417
  139   3HZ   LYS  15          HZ3       LYS  15  11.789   7.740   1.718
  140    H    GLU  16           HN       GLU  16   4.526  10.102   4.130
  141    HA   GLU  16           HA       GLU  16   3.930   7.384   3.556
  142   1HB   GLU  16          HB2       GLU  16   2.638   9.612   4.997
  143   2HB   GLU  16          HB1       GLU  16   1.538   8.407   4.341
  144   1HG   GLU  16          HG2       GLU  16   3.764   7.145   5.659
  145   2HG   GLU  16          HG1       GLU  16   2.957   8.286   6.734
  146    H    LEU  17           HN       LEU  17   1.590   6.902   2.681
  147    HA   LEU  17           HA       LEU  17   1.137   8.481   0.242
  148   1HB   LEU  17          HB2       LEU  17   2.356   6.082   0.147
  149   2HB   LEU  17          HB1       LEU  17   0.684   5.561   0.079
  150    HG   LEU  17           HG       LEU  17   1.753   5.831  -2.152
  151   1HD1  LEU  17          HD11      LEU  17  -0.220   6.386  -3.080
  152   2HD1  LEU  17          HD12      LEU  17  -0.351   7.888  -2.165
  153   3HD1  LEU  17          HD13      LEU  17  -0.783   6.354  -1.409
  154   1HD2  LEU  17          HD21      LEU  17   2.854   7.672  -2.733
  155   2HD2  LEU  17          HD22      LEU  17   2.677   8.233  -1.071
  156   3HD2  LEU  17          HD23      LEU  17   1.490   8.698  -2.289
  157    H    THR  18           HN       THR  18  -0.946   8.875  -0.264
  158    HA   THR  18           HA       THR  18  -2.969   7.938   1.622
  159    HB   THR  18           HB       THR  18  -3.134  10.052  -0.537
  160    HG1  THR  18           HG1      THR  18  -2.518  11.426   0.937
  161   1HG2  THR  18          HG21      THR  18  -5.258   8.813   0.627
  162   2HG2  THR  18          HG22      THR  18  -5.264  10.450  -0.028
  163   3HG2  THR  18          HG23      THR  18  -5.002  10.192   1.697
  164    H    LEU  19           HN       LEU  19  -4.288   6.316   1.130
  165    HA   LEU  19           HA       LEU  19  -5.027   5.863  -1.666
  166   1HB   LEU  19          HB2       LEU  19  -4.734   3.374  -1.232
  167   2HB   LEU  19          HB1       LEU  19  -3.279   4.317  -1.483
  168    HG   LEU  19           HG       LEU  19  -4.278   3.690   1.282
  169   1HD1  LEU  19          HD11      LEU  19  -3.349   1.629   1.309
  170   2HD1  LEU  19          HD12      LEU  19  -2.110   2.050   0.126
  171   3HD1  LEU  19          HD13      LEU  19  -3.752   1.686  -0.407
  172   1HD2  LEU  19          HD21      LEU  19  -2.632   5.213   1.599
  173   2HD2  LEU  19          HD22      LEU  19  -1.851   4.855   0.059
  174   3HD2  LEU  19          HD23      LEU  19  -1.610   3.784   1.440
  175    H    GLN  20           HN       GLN  20  -7.086   5.162  -1.965
  176    HA   GLN  20           HA       GLN  20  -8.683   4.688   0.466
  177   1HB   GLN  20          HB2       GLN  20  -9.155   6.807  -0.832
  178   2HB   GLN  20          HB1       GLN  20  -9.710   5.787  -2.152
  179   1HG   GLN  20          HG2       GLN  20 -11.529   4.978  -0.903
  180   2HG   GLN  20          HG1       GLN  20 -10.868   5.600   0.608
  181   1HE2  GLN  20          HE21      GLN  20 -11.475   6.995  -2.601
  182   2HE2  GLN  20          HE22      GLN  20 -12.395   8.341  -2.030
  183    H    LYS  21           HN       LYS  21 -10.675   3.371   0.081
  184    HA   LYS  21           HA       LYS  21 -10.030   0.844  -0.895
  185   1HB   LYS  21          HB2       LYS  21 -12.162   2.000   0.490
  186   2HB   LYS  21          HB1       LYS  21 -12.889   1.323  -0.960
  187   1HG   LYS  21          HG2       LYS  21 -11.325  -0.735  -0.213
  188   2HG   LYS  21          HG1       LYS  21 -11.680  -0.019   1.359
  189   1HD   LYS  21          HD2       LYS  21 -13.480  -1.410   1.175
  190   2HD   LYS  21          HD1       LYS  21 -14.140   0.016   0.372
  191   1HE   LYS  21          HE2       LYS  21 -12.661  -1.685  -1.456
  192   2HE   LYS  21          HE1       LYS  21 -13.981  -2.549  -0.669
  193   1HZ   LYS  21          HZ1       LYS  21 -14.288  -1.066  -2.854
  194   2HZ   LYS  21          HZ2       LYS  21 -14.626   0.097  -1.674
  195   3HZ   LYS  21          HZ3       LYS  21 -15.527  -1.333  -1.732
  196    H    GLY  22           HN       GLY  22 -10.654  -0.321  -2.728
  197   1HA   GLY  22          HA2       GLY  22 -11.577  -0.612  -4.866
  198   2HA   GLY  22          HA1       GLY  22 -11.976   1.103  -4.902
  199    H    ASP  23           HN       ASP  23  -8.922   1.211  -3.900
  200    HA   ASP  23           HA       ASP  23  -7.919   1.537  -6.630
  201   1HB   ASP  23          HB2       ASP  23  -7.338   2.790  -4.021
  202   2HB   ASP  23          HB1       ASP  23  -5.937   2.521  -5.053
  203    H    ILE  24           HN       ILE  24  -5.942   0.663  -7.308
  204    HA   ILE  24           HA       ILE  24  -5.026  -1.647  -5.720
  205    HB   ILE  24           HB       ILE  24  -4.806  -1.346  -8.715
  206   1HG1  ILE  24          HG12      ILE  24  -7.172  -1.459  -8.009
  207   2HG1  ILE  24          HG11      ILE  24  -6.677  -2.901  -8.890
  208   1HG2  ILE  24          HG21      ILE  24  -3.270  -2.946  -8.316
  209   2HG2  ILE  24          HG22      ILE  24  -4.687  -3.989  -8.208
  210   3HG2  ILE  24          HG23      ILE  24  -3.947  -3.353  -6.739
  211   1HD1  ILE  24          HD11      ILE  24  -6.345  -3.126  -6.003
  212   2HD1  ILE  24          HD12      ILE  24  -7.094  -4.233  -7.154
  213   3HD1  ILE  24          HD13      ILE  24  -8.013  -2.870  -6.516
  214    H    VAL  25           HN       VAL  25  -2.978  -1.621  -5.043
  215    HA   VAL  25           HA       VAL  25  -1.071   0.156  -6.419
  216    HB   VAL  25           HB       VAL  25   0.006   0.574  -4.221
  217   1HG1  VAL  25          HG11      VAL  25  -2.716   1.487  -4.935
  218   2HG1  VAL  25          HG12      VAL  25  -1.225   2.407  -4.734
  219   3HG1  VAL  25          HG13      VAL  25  -2.138   1.885  -3.318
  220   1HG2  VAL  25          HG21      VAL  25  -1.396  -1.552  -3.319
  221   2HG2  VAL  25          HG22      VAL  25  -2.401  -0.229  -2.728
  222   3HG2  VAL  25          HG23      VAL  25  -0.699  -0.315  -2.273
  223    H    TYR  26           HN       TYR  26   1.203  -0.432  -6.110
  224    HA   TYR  26           HA       TYR  26   1.517  -3.351  -5.905
  225   1HB   TYR  26          HB2       TYR  26   3.291  -1.372  -7.347
  226   2HB   TYR  26          HB1       TYR  26   3.453  -3.125  -7.366
  227    HD1  TYR  26           HD2      TYR  26   1.922  -4.503  -8.666
  228    HD2  TYR  26           HD1      TYR  26   1.569  -0.263  -8.647
  229    HE1  TYR  26           HE2      TYR  26   0.457  -4.622 -10.636
  230    HE2  TYR  26           HE1      TYR  26   0.102  -0.371 -10.618
  231    HH   TYR  26           HH       TYR  26  -1.514  -2.276 -11.608
  232    H    ILE  27           HN       ILE  27   2.803  -4.183  -4.385
  233    HA   ILE  27           HA       ILE  27   4.005  -2.412  -2.452
  234    HB   ILE  27           HB       ILE  27   4.302  -5.400  -2.439
  235   1HG1  ILE  27          HG12      ILE  27   1.965  -5.175  -2.772
  236   2HG1  ILE  27          HG11      ILE  27   2.171  -5.381  -1.036
  237   1HG2  ILE  27          HG21      ILE  27   5.450  -4.766  -0.619
  238   2HG2  ILE  27          HG22      ILE  27   3.853  -4.604   0.111
  239   3HG2  ILE  27          HG23      ILE  27   4.668  -3.187  -0.549
  240   1HD1  ILE  27          HD11      ILE  27   0.543  -3.684  -1.412
  241   2HD1  ILE  27          HD12      ILE  27   1.618  -2.822  -2.513
  242   3HD1  ILE  27          HD13      ILE  27   2.004  -2.912  -0.794
  243    H    HIS  28           HN       HIS  28   6.129  -2.037  -2.099
  244    HA   HIS  28           HA       HIS  28   8.002  -3.084  -4.102
  245   1HB   HIS  28          HB2       HIS  28   7.559  -0.490  -3.110
  246   2HB   HIS  28          HB1       HIS  28   9.106  -0.993  -2.440
  247    HD1  HIS  28           HD1      HIS  28  10.922  -1.793  -4.271
  248    HD2  HIS  28           HD2      HIS  28   7.648   0.323  -5.710
  249    HE1  HIS  28           HE1      HIS  28  11.584  -1.009  -6.568
  250    HE2  HIS  28           HE2      HIS  28   9.607   0.314  -7.398
  251    H    LYS  29           HN       LYS  29   7.619  -2.557  -0.620
  252    HA   LYS  29           HA       LYS  29   9.465  -4.773  -0.142
  253   1HB   LYS  29          HB2       LYS  29  10.663  -3.570   1.603
  254   2HB   LYS  29          HB1       LYS  29  10.824  -2.730   0.067
  255   1HG   LYS  29          HG2       LYS  29   9.958  -0.878   0.911
  256   2HG   LYS  29          HG1       LYS  29   8.545  -1.745   1.515
  257   1HD   LYS  29          HD2       LYS  29   9.966  -2.480   3.459
  258   2HD   LYS  29          HD1       LYS  29  11.199  -1.354   2.887
  259   1HE   LYS  29          HE2       LYS  29   9.357   0.418   2.967
  260   2HE   LYS  29          HE1       LYS  29   8.442  -0.751   3.918
  261   1HZ   LYS  29          HZ1       LYS  29  10.690  -0.805   5.263
  262   2HZ   LYS  29          HZ2       LYS  29   9.499   0.355   5.576
  263   3HZ   LYS  29          HZ3       LYS  29  10.843   0.756   4.630
  264    H    GLU  30           HN       GLU  30   9.081  -5.892   1.794
  265    HA   GLU  30           HA       GLU  30   6.535  -5.188   3.095
  266   1HB   GLU  30          HB2       GLU  30   6.998  -7.423   1.673
  267   2HB   GLU  30          HB1       GLU  30   7.507  -7.968   3.265
  268   1HG   GLU  30          HG2       GLU  30   5.347  -7.418   4.188
  269   2HG   GLU  30          HG1       GLU  30   4.829  -6.745   2.643
  270    H    VAL  31           HN       VAL  31   7.055  -4.151   4.879
  271    HA   VAL  31           HA       VAL  31   9.207  -5.141   6.567
  272    HB   VAL  31           HB       VAL  31   7.405  -3.002   7.536
  273   1HG1  VAL  31          HG11      VAL  31   9.659  -4.061   8.495
  274   2HG1  VAL  31          HG12      VAL  31   9.173  -2.395   8.807
  275   3HG1  VAL  31          HG13      VAL  31  10.345  -2.749   7.537
  276   1HG2  VAL  31          HG21      VAL  31   9.435  -2.516   5.358
  277   2HG2  VAL  31          HG22      VAL  31   8.565  -1.269   6.250
  278   3HG2  VAL  31          HG23      VAL  31   7.687  -2.368   5.189
  279    H    ASP  32           HN       ASP  32   8.594  -6.963   7.462
  280    HA   ASP  32           HA       ASP  32   6.017  -7.686   8.272
  281   1HB   ASP  32          HB2       ASP  32   7.205  -9.445   9.650
  282   2HB   ASP  32          HB1       ASP  32   7.620  -9.419   7.939
  283    H    LYS  33           HN       LYS  33   8.265  -5.570   9.743
  284    HA   LYS  33           HA       LYS  33   7.594  -5.894  12.455
  285   1HB   LYS  33          HB2       LYS  33   8.950  -3.875  10.808
  286   2HB   LYS  33          HB1       LYS  33   8.130  -3.206  12.212
  287   1HG   LYS  33          HG2       LYS  33  10.035  -3.682  13.277
  288   2HG   LYS  33          HG1       LYS  33   9.407  -5.330  13.316
  289   1HD   LYS  33          HD2       LYS  33  11.161  -6.007  12.130
  290   2HD   LYS  33          HD1       LYS  33  10.651  -4.965  10.800
  291   1HE   LYS  33          HE2       LYS  33  12.205  -3.402  11.262
  292   2HE   LYS  33          HE1       LYS  33  12.020  -3.588  13.005
  293   1HZ   LYS  33          HZ1       LYS  33  13.228  -5.815  12.605
  294   2HZ   LYS  33          HZ2       LYS  33  14.132  -4.387  12.630
  295   3HZ   LYS  33          HZ3       LYS  33  13.732  -5.107  11.153
  296    H    ASN  34           HN       ASN  34   6.338  -3.643   9.998
  297    HA   ASN  34           HA       ASN  34   3.675  -3.845  10.501
  298   1HB   ASN  34          HB2       ASN  34   4.979  -2.515  12.706
  299   2HB   ASN  34          HB1       ASN  34   3.836  -1.421  11.933
  300   1HD2  ASN  34          HD21      ASN  34   4.184  -3.741  14.239
  301   2HD2  ASN  34          HD22      ASN  34   2.535  -4.228  14.406
  302    H    TRP  35           HN       TRP  35   5.516  -3.122   8.395
  303    HA   TRP  35           HA       TRP  35   4.050  -0.892   7.320
  304   1HB   TRP  35          HB2       TRP  35   6.544  -0.430   8.626
  305   2HB   TRP  35          HB1       TRP  35   6.762  -0.153   6.903
  306    HD1  TRP  35           HD1      TRP  35   4.333   1.363   5.968
  307    HE1  TRP  35           HE1      TRP  35   3.634   3.639   6.944
  308    HE3  TRP  35           HE3      TRP  35   6.757   1.098  10.461
  309    HZ2  TRP  35           HZ2      TRP  35   4.053   5.125   9.307
  310    HZ3  TRP  35           HZ3      TRP  35   6.556   2.990  12.023
  311    HH2  TRP  35           HH2      TRP  35   5.232   4.961  11.456
  312    H    LEU  36           HN       LEU  36   4.907  -0.303   5.088
  313    HA   LEU  36           HA       LEU  36   6.435  -2.283   3.665
  314   1HB   LEU  36          HB2       LEU  36   4.714  -3.082   2.231
  315   2HB   LEU  36          HB1       LEU  36   4.145  -3.298   3.877
  316    HG   LEU  36           HG       LEU  36   3.227  -0.769   3.120
  317   1HD1  LEU  36          HD11      LEU  36   3.313  -0.858   0.879
  318   2HD1  LEU  36          HD12      LEU  36   1.819  -1.772   1.083
  319   3HD1  LEU  36          HD13      LEU  36   3.346  -2.620   0.833
  320   1HD2  LEU  36          HD21      LEU  36   2.184  -2.653   4.512
  321   2HD2  LEU  36          HD22      LEU  36   1.575  -3.271   2.977
  322   3HD2  LEU  36          HD23      LEU  36   1.105  -1.664   3.528
  323    H    GLU  37           HN       GLU  37   6.022  -1.698   1.120
  324    HA   GLU  37           HA       GLU  37   6.313   1.227   1.005
  325   1HB   GLU  37          HB2       GLU  37   8.211  -0.270   0.227
  326   2HB   GLU  37          HB1       GLU  37   7.180  -0.727  -1.118
  327   1HG   GLU  37          HG2       GLU  37   7.438   1.252  -2.170
  328   2HG   GLU  37          HG1       GLU  37   7.535   2.164  -0.664
  329    H    GLY  38           HN       GLY  38   4.882   2.432  -0.054
  330   1HA   GLY  38          HA2       GLY  38   2.956   1.042  -1.812
  331   2HA   GLY  38          HA1       GLY  38   2.496   2.354  -0.736
  332    H    GLU  39           HN       GLU  39   3.255   1.583  -3.862
  333    HA   GLU  39           HA       GLU  39   4.012   4.366  -4.475
  334   1HB   GLU  39          HB2       GLU  39   5.461   2.111  -5.030
  335   2HB   GLU  39          HB1       GLU  39   4.560   2.328  -6.525
  336   1HG   GLU  39          HG2       GLU  39   5.965   4.661  -5.338
  337   2HG   GLU  39          HG1       GLU  39   6.905   3.429  -6.175
  338    H    HIS  40           HN       HIS  40   2.925   5.417  -6.132
  339    HA   HIS  40           HA       HIS  40   0.932   3.980  -7.678
  340   1HB   HIS  40          HB2       HIS  40  -0.077   4.728  -5.423
  341   2HB   HIS  40          HB1       HIS  40   0.000   6.356  -6.089
  342    HD1  HIS  40           HD1      HIS  40  -1.778   7.016  -7.761
  343    HD2  HIS  40           HD2      HIS  40  -1.878   2.976  -6.795
  344    HE1  HIS  40           HE1      HIS  40  -3.905   6.135  -8.774
  345    HE2  HIS  40           HE2      HIS  40  -3.888   3.667  -8.269
  346    H    HIS  41           HN       HIS  41   0.654   4.829  -9.650
  347    HA   HIS  41           HA       HIS  41   1.132   6.092 -11.490
  348   1HB   HIS  41          HB2       HIS  41  -0.329   7.655  -9.577
  349   2HB   HIS  41          HB1       HIS  41   0.740   8.712 -10.491
  350    HD1  HIS  41           HD1      HIS  41  -0.224   9.550 -12.604
  351    HD2  HIS  41           HD2      HIS  41  -1.933   5.941 -11.454
  352    HE1  HIS  41           HE1      HIS  41  -2.017   9.084 -14.303
  353    HE2  HIS  41           HE2      HIS  41  -3.084   6.930 -13.549
  354    H    GLY  42           HN       GLY  42   3.458   5.468  -9.989
  355   1HA   GLY  42          HA2       GLY  42   5.698   6.008 -10.316
  356   2HA   GLY  42          HA1       GLY  42   5.199   7.541 -11.011
  357    H    ARG  43           HN       ARG  43   3.501   7.593  -8.295
  358    HA   ARG  43           HA       ARG  43   5.426   9.261  -6.945
  359   1HB   ARG  43          HB2       ARG  43   2.802   9.511  -7.156
  360   2HB   ARG  43          HB1       ARG  43   2.810   8.510  -5.711
  361   1HG   ARG  43          HG2       ARG  43   4.545  10.928  -5.803
  362   2HG   ARG  43          HG1       ARG  43   2.811  11.117  -5.538
  363   1HD   ARG  43          HD2       ARG  43   2.938   9.598  -3.625
  364   2HD   ARG  43          HD1       ARG  43   4.668   9.398  -3.893
  365    HE   ARG  43           HE       ARG  43   3.392  11.550  -2.545
  366   1HH1  ARG  43          HH11      ARG  43   6.110  10.779  -4.594
  367   2HH1  ARG  43          HH12      ARG  43   7.071  12.105  -4.030
  368   1HH2  ARG  43          HH21      ARG  43   4.655  13.292  -1.801
  369   2HH2  ARG  43          HH22      ARG  43   6.245  13.532  -2.444
  370    H    LEU  44           HN       LEU  44   6.461   8.857  -5.034
  371    HA   LEU  44           HA       LEU  44   6.454   6.066  -4.161
  372   1HB   LEU  44          HB2       LEU  44   8.613   7.010  -4.740
  373   2HB   LEU  44          HB1       LEU  44   8.377   8.318  -3.597
  374    HG   LEU  44           HG       LEU  44   8.100   5.876  -2.169
  375   1HD1  LEU  44          HD11      LEU  44   9.571   5.260  -4.324
  376   2HD1  LEU  44          HD12      LEU  44   9.833   4.544  -2.733
  377   3HD1  LEU  44          HD13      LEU  44  10.837   5.891  -3.270
  378   1HD2  LEU  44          HD21      LEU  44   8.838   8.077  -1.311
  379   2HD2  LEU  44          HD22      LEU  44  10.366   7.862  -2.165
  380   3HD2  LEU  44          HD23      LEU  44   9.919   6.757  -0.865
  381    H    GLY  45           HN       GLY  45   5.749   5.416  -2.228
  382   1HA   GLY  45          HA2       GLY  45   5.514   7.215   0.008
  383   2HA   GLY  45          HA1       GLY  45   3.965   6.769  -0.690
  384    H    ILE  46           HN       ILE  46   4.273   6.098   1.852
  385    HA   ILE  46           HA       ILE  46   4.506   3.188   1.731
  386    HB   ILE  46           HB       ILE  46   6.097   4.990   3.506
  387   1HG1  ILE  46          HG12      ILE  46   6.969   2.322   2.498
  388   2HG1  ILE  46          HG11      ILE  46   6.818   3.644   1.344
  389   1HG2  ILE  46          HG21      ILE  46   4.999   2.318   4.272
  390   2HG2  ILE  46          HG22      ILE  46   5.131   3.789   5.231
  391   3HG2  ILE  46          HG23      ILE  46   6.573   2.842   4.867
  392   1HD1  ILE  46          HD11      ILE  46   8.684   3.338   3.644
  393   2HD1  ILE  46          HD12      ILE  46   8.257   4.947   3.061
  394   3HD1  ILE  46          HD13      ILE  46   9.020   3.787   1.972
  395    H    PHE  47           HN       PHE  47   3.337   2.077   3.352
  396    HA   PHE  47           HA       PHE  47   1.742   3.519   5.263
  397   1HB   PHE  47          HB2       PHE  47  -0.435   2.918   4.347
  398   2HB   PHE  47          HB1       PHE  47   0.460   3.879   3.176
  399    HD1  PHE  47           HD1      PHE  47   1.989   2.326   1.567
  400    HD2  PHE  47           HD2      PHE  47  -1.611   1.151   3.509
  401    HE1  PHE  47           HE1      PHE  47   1.652   0.572  -0.125
  402    HE2  PHE  47           HE2      PHE  47  -1.953  -0.604   1.820
  403    HZ   PHE  47           HZ       PHE  47  -0.320  -0.896   0.000
  404    HA   PRO  48           HA       PRO  48   1.862  -0.376   7.326
  405   1HB   PRO  48          HB2       PRO  48  -0.502  -0.414   8.671
  406   2HB   PRO  48          HB1       PRO  48   0.858   0.613   9.140
  407   1HG   PRO  48          HG2       PRO  48  -1.592   1.314   7.570
  408   2HG   PRO  48          HG1       PRO  48  -0.792   2.227   8.863
  409   1HD   PRO  48          HD2       PRO  48  -0.459   2.826   6.250
  410   2HD   PRO  48          HD1       PRO  48   0.830   3.055   7.447
  411    H    ALA  49           HN       ALA  49   1.471  -2.444   6.795
  412    HA   ALA  49           HA       ALA  49  -0.207  -3.093   4.611
  413   1HB   ALA  49          HB1       ALA  49   1.511  -4.625   6.490
  414   2HB   ALA  49          HB2       ALA  49   1.558  -4.536   4.730
  415   3HB   ALA  49          HB3       ALA  49   0.325  -5.509   5.531
  416    H    ASN  50           HN       ASN  50  -0.725  -3.019   8.035
  417    HA   ASN  50           HA       ASN  50  -2.822  -4.840   8.295
  418   1HB   ASN  50          HB2       ASN  50  -1.727  -2.613   9.848
  419   2HB   ASN  50          HB1       ASN  50  -3.454  -2.851  10.095
  420   1HD2  ASN  50          HD21      ASN  50  -2.687  -3.357  12.285
  421   2HD2  ASN  50          HD22      ASN  50  -2.213  -4.982  12.632
  422    H    TYR  51           HN       TYR  51  -2.751  -1.764   6.748
  423    HA   TYR  51           HA       TYR  51  -5.677  -1.586   6.770
  424   1HB   TYR  51          HB2       TYR  51  -3.472   0.363   6.298
  425   2HB   TYR  51          HB1       TYR  51  -5.011   0.646   5.492
  426    HD1  TYR  51           HD1      TYR  51  -3.871  -0.388   8.906
  427    HD2  TYR  51           HD2      TYR  51  -6.413   2.108   6.581
  428    HE1  TYR  51           HE1      TYR  51  -4.754   0.621  10.967
  429    HE2  TYR  51           HE2      TYR  51  -7.304   3.125   8.636
  430    HH   TYR  51           HH       TYR  51  -7.534   2.407  11.095
  431    H    VAL  52           HN       VAL  52  -4.025  -3.517   5.149
  432    HA   VAL  52           HA       VAL  52  -5.471  -3.134   2.675
  433    HB   VAL  52           HB       VAL  52  -3.437  -1.855   2.218
  434   1HG1  VAL  52          HG11      VAL  52  -2.162  -4.216   3.407
  435   2HG1  VAL  52          HG12      VAL  52  -1.625  -2.537   3.355
  436   3HG1  VAL  52          HG13      VAL  52  -1.368  -3.589   1.963
  437   1HG2  VAL  52          HG21      VAL  52  -2.974  -2.771   0.120
  438   2HG2  VAL  52          HG22      VAL  52  -4.590  -3.369   0.496
  439   3HG2  VAL  52          HG23      VAL  52  -3.191  -4.426   0.692
  440    H    GLU  53           HN       GLU  53  -5.397  -5.020   1.284
  441    HA   GLU  53           HA       GLU  53  -4.652  -7.462   2.759
  442   1HB   GLU  53          HB2       GLU  53  -7.106  -7.103   2.482
  443   2HB   GLU  53          HB1       GLU  53  -6.880  -7.158   0.739
  444   1HG   GLU  53          HG2       GLU  53  -6.920  -9.370   0.728
  445   2HG   GLU  53          HG1       GLU  53  -5.691  -9.459   1.989
  446    H    VAL  54           HN       VAL  54  -3.157  -8.702   1.847
  447    HA   VAL  54           HA       VAL  54  -2.144  -8.068  -0.774
  448    HB   VAL  54           HB       VAL  54  -0.614  -8.681   1.053
  449   1HG1  VAL  54          HG11      VAL  54  -2.402 -10.589   1.718
  450   2HG1  VAL  54          HG12      VAL  54  -0.719 -10.590   2.245
  451   3HG1  VAL  54          HG13      VAL  54  -1.208 -11.558   0.854
  452   1HG2  VAL  54          HG21      VAL  54  -0.683  -9.995  -1.564
  453   2HG2  VAL  54          HG22      VAL  54   0.360 -10.786  -0.382
  454   3HG2  VAL  54          HG23      VAL  54   0.611  -9.087  -0.782
  455    H    LEU  55           HN       LEU  55  -2.924  -8.877  -2.596
  456    HA   LEU  55           HA       LEU  55  -3.544 -11.666  -2.863
  457   1HB   LEU  55          HB2       LEU  55  -5.877 -11.245  -3.690
  458   2HB   LEU  55          HB1       LEU  55  -5.650 -11.068  -1.961
  459    HG   LEU  55           HG       LEU  55  -5.248  -8.501  -2.999
  460   1HD1  LEU  55          HD11      LEU  55  -6.684  -8.085  -4.667
  461   2HD1  LEU  55          HD12      LEU  55  -7.911  -9.173  -4.018
  462   3HD1  LEU  55          HD13      LEU  55  -6.575  -9.819  -4.971
  463   1HD2  LEU  55          HD21      LEU  55  -6.295  -8.514  -0.985
  464   2HD2  LEU  55          HD22      LEU  55  -7.290  -9.914  -1.384
  465   3HD2  LEU  55          HD23      LEU  55  -7.714  -8.322  -2.014
  466    HA   PRO  56           HA       PRO  56  -1.725  -9.504  -6.589
  467   1HB   PRO  56          HB2       PRO  56  -0.718 -12.295  -6.853
  468   2HB   PRO  56          HB1       PRO  56   0.134 -10.764  -7.086
  469   1HG   PRO  56          HG2       PRO  56   0.543 -12.226  -4.899
  470   2HG   PRO  56          HG1       PRO  56   0.475 -10.455  -4.813
  471   1HD   PRO  56          HD2       PRO  56  -1.574 -12.476  -4.015
  472   2HD   PRO  56          HD1       PRO  56  -1.163 -10.923  -3.258
  473    H    LEU  57           HN       LEU  57  -2.501  -9.590  -8.651
  474    HA   LEU  57           HA       LEU  57  -4.229 -11.859  -9.369
  475   1HB   LEU  57          HB2       LEU  57  -5.651 -10.101 -10.591
  476   2HB   LEU  57          HB1       LEU  57  -5.838 -10.270  -8.857
  477    HG   LEU  57           HG       LEU  57  -5.813  -7.911  -9.700
  478   1HD1  LEU  57          HD11      LEU  57  -5.042  -7.225  -7.715
  479   2HD1  LEU  57          HD12      LEU  57  -3.473  -7.997  -7.941
  480   3HD1  LEU  57          HD13      LEU  57  -4.850  -8.946  -7.382
  481   1HD2  LEU  57          HD21      LEU  57  -3.915  -8.486 -11.358
  482   2HD2  LEU  57          HD22      LEU  57  -2.848  -8.194  -9.985
  483   3HD2  LEU  57          HD23      LEU  57  -3.910  -6.911 -10.564
  484    H    GLU  58           HN       GLU  58  -4.482 -12.228 -11.642
  485    HA   GLU  58           HA       GLU  58  -2.348 -11.014 -13.273
  486   1HB   GLU  58          HB2       GLU  58  -1.977 -13.428 -12.542
  487   2HB   GLU  58          HB1       GLU  58  -3.327 -13.849 -13.587
  488   1HG   GLU  58          HG2       GLU  58  -1.772 -12.363 -15.259
  489   2HG   GLU  58          HG1       GLU  58  -0.566 -13.168 -14.256
  Start of MODEL   19
    1   1H    MET   0          HT1       MET   0   6.716  -9.149  -9.661
    2   2H    MET   0          HT2       MET   0   6.159 -10.167  -8.397
    3   3H    MET   0          HT3       MET   0   6.119  -8.461  -8.209
    4    HA   MET   0           HA       MET   0   4.474  -8.224  -9.821
    5   1HB   MET   0          HB2       MET   0   5.616 -10.363 -10.998
    6   2HB   MET   0          HB1       MET   0   4.218 -11.145 -10.275
    7   1HG   MET   0          HG2       MET   0   2.970 -10.455 -11.958
    8   2HG   MET   0          HG1       MET   0   3.297  -8.782 -11.510
    9   1HE   MET   0          HE1       MET   0   5.107 -11.829 -13.547
   10   2HE   MET   0          HE2       MET   0   4.786 -11.063 -15.102
   11   3HE   MET   0          HE3       MET   0   3.454 -11.419 -14.004
   12    H    LYS   1           HN       LYS   1   3.782  -7.770  -7.584
   13    HA   LYS   1           HA       LYS   1   1.668  -9.629  -6.802
   14   1HB   LYS   1          HB2       LYS   1   4.015  -8.859  -5.140
   15   2HB   LYS   1          HB1       LYS   1   2.453  -8.965  -4.340
   16   1HG   LYS   1          HG2       LYS   1   2.302 -11.229  -4.628
   17   2HG   LYS   1          HG1       LYS   1   3.321 -11.224  -6.069
   18   1HD   LYS   1          HD2       LYS   1   4.547 -10.420  -3.483
   19   2HD   LYS   1          HD1       LYS   1   4.199 -12.131  -3.740
   20   1HE   LYS   1          HE2       LYS   1   6.423 -11.781  -4.473
   21   2HE   LYS   1          HE1       LYS   1   5.436 -11.936  -5.926
   22   1HZ   LYS   1          HZ1       LYS   1   7.145 -10.056  -5.813
   23   2HZ   LYS   1          HZ2       LYS   1   6.046  -9.283  -4.786
   24   3HZ   LYS   1          HZ3       LYS   1   5.591  -9.679  -6.366
   25    H    ALA   2           HN       ALA   2  -0.069  -8.383  -7.086
   26    HA   ALA   2           HA       ALA   2   0.027  -5.573  -6.252
   27   1HB   ALA   2          HB1       ALA   2  -1.461  -5.102  -7.879
   28   2HB   ALA   2          HB2       ALA   2  -2.381  -6.583  -7.614
   29   3HB   ALA   2          HB3       ALA   2  -0.892  -6.628  -8.557
   30    H    ALA   3           HN       ALA   3  -1.644  -4.674  -4.959
   31    HA   ALA   3           HA       ALA   3  -3.236  -6.623  -3.435
   32   1HB   ALA   3          HB1       ALA   3  -2.713  -5.553  -1.361
   33   2HB   ALA   3          HB2       ALA   3  -1.809  -4.282  -2.184
   34   3HB   ALA   3          HB3       ALA   3  -1.196  -5.936  -2.174
   35    H    ARG   4           HN       ARG   4  -5.181  -5.827  -2.536
   36    HA   ARG   4           HA       ARG   4  -6.214  -3.468  -3.940
   37   1HB   ARG   4          HB2       ARG   4  -7.272  -5.952  -3.785
   38   2HB   ARG   4          HB1       ARG   4  -8.065  -5.197  -2.409
   39   1HG   ARG   4          HG2       ARG   4  -8.649  -3.311  -4.071
   40   2HG   ARG   4          HG1       ARG   4  -8.262  -4.506  -5.311
   41   1HD   ARG   4          HD2       ARG   4  -9.857  -6.029  -3.887
   42   2HD   ARG   4          HD1       ARG   4 -10.479  -4.481  -3.316
   43    HE   ARG   4           HE       ARG   4 -10.301  -4.674  -6.179
   44   1HH1  ARG   4          HH11      ARG   4 -12.285  -5.332  -3.384
   45   2HH1  ARG   4          HH12      ARG   4 -13.767  -5.323  -4.279
   46   1HH2  ARG   4          HH21      ARG   4 -12.251  -4.662  -7.358
   47   2HH2  ARG   4          HH22      ARG   4 -13.748  -4.944  -6.535
   48    H    LEU   5           HN       LEU   5  -6.291  -1.633  -2.841
   49    HA   LEU   5           HA       LEU   5  -5.993  -1.546   0.003
   50   1HB   LEU   5          HB2       LEU   5  -6.102   0.385  -2.214
   51   2HB   LEU   5          HB1       LEU   5  -6.719   0.988  -0.689
   52    HG   LEU   5           HG       LEU   5  -4.071  -0.377  -0.687
   53   1HD1  LEU   5          HD11      LEU   5  -4.432   2.487  -1.547
   54   2HD1  LEU   5          HD12      LEU   5  -4.028   1.158  -2.633
   55   3HD1  LEU   5          HD13      LEU   5  -2.911   1.617  -1.348
   56   1HD2  LEU   5          HD21      LEU   5  -3.947   1.907   0.826
   57   2HD2  LEU   5          HD22      LEU   5  -4.335   0.296   1.428
   58   3HD2  LEU   5          HD23      LEU   5  -5.631   1.416   1.007
   59    H    LYS   6           HN       LYS   6  -7.471  -0.587   1.504
   60    HA   LYS   6           HA       LYS   6 -10.188  -0.083   0.777
   61   1HB   LYS   6          HB2       LYS   6  -9.402  -2.768   1.650
   62   2HB   LYS   6          HB1       LYS   6 -10.719  -2.080   2.589
   63   1HG   LYS   6          HG2       LYS   6 -12.181  -2.199   0.881
   64   2HG   LYS   6          HG1       LYS   6 -10.960  -1.818  -0.334
   65   1HD   LYS   6          HD2       LYS   6 -10.921  -3.973  -0.884
   66   2HD   LYS   6          HD1       LYS   6 -10.242  -4.320   0.707
   67   1HE   LYS   6          HE2       LYS   6 -12.235  -5.025   1.557
   68   2HE   LYS   6          HE1       LYS   6 -13.179  -3.952   0.523
   69   1HZ   LYS   6          HZ1       LYS   6 -13.634  -5.861  -0.542
   70   2HZ   LYS   6          HZ2       LYS   6 -12.258  -6.659   0.033
   71   3HZ   LYS   6          HZ3       LYS   6 -12.135  -5.606  -1.284
   72    H    PHE   7           HN       PHE   7  -8.060   1.261   2.211
   73    HA   PHE   7           HA       PHE   7  -9.481   1.654   4.754
   74   1HB   PHE   7          HB2       PHE   7  -6.487   1.403   4.424
   75   2HB   PHE   7          HB1       PHE   7  -7.281   1.961   5.893
   76    HD1  PHE   7           HD2      PHE   7  -7.257  -0.922   3.538
   77    HD2  PHE   7           HD1      PHE   7  -7.822   0.433   7.532
   78    HE1  PHE   7           HE2      PHE   7  -7.488  -3.253   4.291
   79    HE2  PHE   7           HE1      PHE   7  -8.053  -1.896   8.294
   80    HZ   PHE   7           HZ       PHE   7  -7.887  -3.742   6.672
   81    H    ASP   8           HN       ASP   8 -10.409   3.571   4.166
   82    HA   ASP   8           HA       ASP   8  -9.030   5.654   2.817
   83   1HB   ASP   8          HB2       ASP   8 -10.994   7.026   3.357
   84   2HB   ASP   8          HB1       ASP   8 -11.474   5.449   2.737
   85    H    PHE   9           HN       PHE   9  -7.130   5.384   4.392
   86    HA   PHE   9           HA       PHE   9  -7.508   7.061   6.776
   87   1HB   PHE   9          HB2       PHE   9  -6.149   4.624   6.392
   88   2HB   PHE   9          HB1       PHE   9  -4.898   5.841   6.624
   89    HD1  PHE   9           HD2      PHE   9  -8.274   5.243   8.107
   90    HD2  PHE   9           HD1      PHE   9  -4.117   5.861   8.772
   91    HE1  PHE   9           HE2      PHE   9  -8.655   5.163  10.536
   92    HE2  PHE   9           HE1      PHE   9  -4.490   5.781  11.203
   93    HZ   PHE   9           HZ       PHE   9  -6.762   5.433  12.088
   94    H    GLN  10           HN       GLN  10  -6.351   8.910   7.081
   95    HA   GLN  10           HA       GLN  10  -5.037  10.003   4.725
   96   1HB   GLN  10          HB2       GLN  10  -6.781  11.242   6.123
   97   2HB   GLN  10          HB1       GLN  10  -5.521  11.426   7.336
   98   1HG   GLN  10          HG2       GLN  10  -4.513  13.063   6.210
   99   2HG   GLN  10          HG1       GLN  10  -4.680  12.231   4.665
  100   1HE2  GLN  10          HE21      GLN  10  -5.213  15.051   5.734
  101   2HE2  GLN  10          HE22      GLN  10  -6.782  15.425   5.114
  102    H    ALA  11           HN       ALA  11  -2.913  10.512   4.573
  103    HA   ALA  11           HA       ALA  11  -1.135   9.368   6.554
  104   1HB   ALA  11          HB1       ALA  11   0.594  10.309   4.816
  105   2HB   ALA  11          HB2       ALA  11  -0.830  10.414   3.781
  106   3HB   ALA  11          HB3       ALA  11  -0.347   8.861   4.462
  107    H    GLN  12           HN       GLN  12   0.200  10.460   7.913
  108    HA   GLN  12           HA       GLN  12  -0.247  13.337   8.146
  109   1HB   GLN  12          HB2       GLN  12   1.027  12.926  10.359
  110   2HB   GLN  12          HB1       GLN  12  -0.630  12.364  10.222
  111   1HG   GLN  12          HG2       GLN  12  -0.042  10.195  10.351
  112   2HG   GLN  12          HG1       GLN  12   1.450  10.432   9.444
  113   1HE2  GLN  12          HE21      GLN  12   3.250  10.208  10.550
  114   2HE2  GLN  12          HE22      GLN  12   3.431  10.400  12.257
  115    H    SER  13           HN       SER  13   2.331  10.963   7.769
  116    HA   SER  13           HA       SER  13   4.412  12.959   7.822
  117   1HB   SER  13          HB2       SER  13   4.697  10.568   8.604
  118   2HB   SER  13          HB1       SER  13   4.647  10.086   6.909
  119    HG   SER  13           HG       SER  13   6.675  10.582   6.832
  120    HA   PRO  14           HA       PRO  14   4.340  14.171   3.576
  121   1HB   PRO  14          HB2       PRO  14   7.050  14.474   3.153
  122   2HB   PRO  14          HB1       PRO  14   6.015  15.679   3.923
  123   1HG   PRO  14          HG2       PRO  14   7.819  13.651   5.177
  124   2HG   PRO  14          HG1       PRO  14   7.544  15.342   5.634
  125   1HD   PRO  14          HD2       PRO  14   6.410  13.327   6.989
  126   2HD   PRO  14          HD1       PRO  14   5.549  14.856   6.715
  127    H    LYS  15           HN       LYS  15   6.414  11.548   4.631
  128    HA   LYS  15           HA       LYS  15   6.878  10.566   1.960
  129   1HB   LYS  15          HB2       LYS  15   8.110  10.213   4.428
  130   2HB   LYS  15          HB1       LYS  15   7.366   8.653   4.101
  131   1HG   LYS  15          HG2       LYS  15   8.680   8.253   2.268
  132   2HG   LYS  15          HG1       LYS  15   8.949   9.968   1.950
  133   1HD   LYS  15          HD2       LYS  15  10.730  10.073   3.329
  134   2HD   LYS  15          HD1       LYS  15  10.000   8.993   4.518
  135   1HE   LYS  15          HE2       LYS  15  11.786   7.748   3.724
  136   2HE   LYS  15          HE1       LYS  15  10.435   7.148   2.764
  137   1HZ   LYS  15          HZ1       LYS  15  12.466   7.616   1.459
  138   2HZ   LYS  15          HZ2       LYS  15  12.317   9.254   1.851
  139   3HZ   LYS  15          HZ3       LYS  15  11.119   8.493   0.931
  140    H    GLU  16           HN       GLU  16   4.608  10.012   4.539
  141    HA   GLU  16           HA       GLU  16   3.613   7.513   3.654
  142   1HB   GLU  16          HB2       GLU  16   2.648   9.647   5.511
  143   2HB   GLU  16          HB1       GLU  16   1.526   8.394   5.001
  144   1HG   GLU  16          HG2       GLU  16   3.093   6.689   5.837
  145   2HG   GLU  16          HG1       GLU  16   4.150   7.978   6.412
  146    H    LEU  17           HN       LEU  17   1.397   7.166   2.822
  147    HA   LEU  17           HA       LEU  17   0.512   9.322   1.027
  148   1HB   LEU  17          HB2       LEU  17   1.890   7.496  -0.103
  149   2HB   LEU  17          HB1       LEU  17   0.536   6.427   0.208
  150    HG   LEU  17           HG       LEU  17  -0.909   8.027  -1.096
  151   1HD1  LEU  17          HD11      LEU  17   1.751   9.330  -1.440
  152   2HD1  LEU  17          HD12      LEU  17   0.166  10.056  -1.175
  153   3HD1  LEU  17          HD13      LEU  17   0.578   9.391  -2.755
  154   1HD2  LEU  17          HD21      LEU  17  -0.031   5.935  -2.040
  155   2HD2  LEU  17          HD22      LEU  17   1.409   6.797  -2.582
  156   3HD2  LEU  17          HD23      LEU  17  -0.169   7.207  -3.254
  157    H    THR  18           HN       THR  18  -1.649   9.614   0.875
  158    HA   THR  18           HA       THR  18  -3.318   8.124   2.718
  159    HB   THR  18           HB       THR  18  -3.860  10.514   0.947
  160    HG1  THR  18           HG1      THR  18  -3.779  11.639   2.858
  161   1HG2  THR  18          HG21      THR  18  -5.953   9.332   1.253
  162   2HG2  THR  18          HG22      THR  18  -5.935  10.828   2.188
  163   3HG2  THR  18          HG23      THR  18  -5.686   9.280   2.995
  164    H    LEU  19           HN       LEU  19  -4.490   6.423   2.158
  165    HA   LEU  19           HA       LEU  19  -5.146   6.045  -0.692
  166   1HB   LEU  19          HB2       LEU  19  -4.525   4.017   1.447
  167   2HB   LEU  19          HB1       LEU  19  -5.206   3.595  -0.112
  168    HG   LEU  19           HG       LEU  19  -2.838   3.186  -0.139
  169   1HD1  LEU  19          HD11      LEU  19  -2.874   5.678  -1.714
  170   2HD1  LEU  19          HD12      LEU  19  -4.170   4.528  -2.049
  171   3HD1  LEU  19          HD13      LEU  19  -2.485   4.028  -2.202
  172   1HD2  LEU  19          HD21      LEU  19  -2.089   6.027   0.151
  173   2HD2  LEU  19          HD22      LEU  19  -1.240   4.568   0.663
  174   3HD2  LEU  19          HD23      LEU  19  -2.581   5.191   1.624
  175    H    GLN  20           HN       GLN  20  -7.140   5.063  -1.210
  176    HA   GLN  20           HA       GLN  20  -9.140   5.054   0.944
  177   1HB   GLN  20          HB2       GLN  20  -9.083   7.056  -0.836
  178   2HB   GLN  20          HB1       GLN  20 -10.015   5.892  -1.768
  179   1HG   GLN  20          HG2       GLN  20 -11.080   5.934   0.852
  180   2HG   GLN  20          HG1       GLN  20 -10.877   7.605   0.326
  181   1HE2  GLN  20          HE21      GLN  20 -12.831   4.895   0.210
  182   2HE2  GLN  20          HE22      GLN  20 -13.890   5.387  -1.063
  183    H    LYS  21           HN       LYS  21 -11.139   3.840   0.307
  184    HA   LYS  21           HA       LYS  21 -10.465   1.245  -0.519
  185   1HB   LYS  21          HB2       LYS  21 -13.155   2.591  -0.258
  186   2HB   LYS  21          HB1       LYS  21 -12.947   0.872  -0.562
  187   1HG   LYS  21          HG2       LYS  21 -11.964   0.513   1.547
  188   2HG   LYS  21          HG1       LYS  21 -11.741   2.242   1.820
  189   1HD   LYS  21          HD2       LYS  21 -13.640   2.078   3.011
  190   2HD   LYS  21          HD1       LYS  21 -14.432   2.097   1.434
  191   1HE   LYS  21          HE2       LYS  21 -15.358   0.254   2.551
  192   2HE   LYS  21          HE1       LYS  21 -14.164  -0.435   1.453
  193   1HZ   LYS  21          HZ1       LYS  21 -13.459   0.201   4.247
  194   2HZ   LYS  21          HZ2       LYS  21 -12.712  -0.884   3.186
  195   3HZ   LYS  21          HZ3       LYS  21 -14.218  -1.260   3.857
  196    H    GLY  22           HN       GLY  22 -10.500   0.217  -2.434
  197   1HA   GLY  22          HA2       GLY  22 -11.298  -0.156  -4.644
  198   2HA   GLY  22          HA1       GLY  22 -11.787   1.535  -4.719
  199    H    ASP  23           HN       ASP  23  -8.832   1.730  -3.394
  200    HA   ASP  23           HA       ASP  23  -7.624   2.458  -5.914
  201   1HB   ASP  23          HB2       ASP  23  -7.420   3.515  -3.440
  202   2HB   ASP  23          HB1       ASP  23  -5.992   2.486  -3.441
  203    H    ILE  24           HN       ILE  24  -5.970   1.460  -6.953
  204    HA   ILE  24           HA       ILE  24  -5.080  -1.126  -5.850
  205    HB   ILE  24           HB       ILE  24  -5.205  -0.365  -8.770
  206   1HG1  ILE  24          HG12      ILE  24  -7.461  -0.503  -7.786
  207   2HG1  ILE  24          HG11      ILE  24  -7.164  -1.822  -8.914
  208   1HG2  ILE  24          HG21      ILE  24  -4.782  -3.042  -7.447
  209   2HG2  ILE  24          HG22      ILE  24  -3.517  -2.053  -8.176
  210   3HG2  ILE  24          HG23      ILE  24  -4.804  -2.719  -9.180
  211   1HD1  ILE  24          HD11      ILE  24  -6.411  -3.006  -6.634
  212   2HD1  ILE  24          HD12      ILE  24  -8.062  -3.042  -7.254
  213   3HD1  ILE  24          HD13      ILE  24  -7.613  -1.877  -6.007
  214    H    VAL  25           HN       VAL  25  -2.981  -1.306  -5.396
  215    HA   VAL  25           HA       VAL  25  -1.067   0.403  -6.832
  216    HB   VAL  25           HB       VAL  25   0.191   0.742  -4.722
  217   1HG1  VAL  25          HG11      VAL  25  -2.572   1.805  -5.098
  218   2HG1  VAL  25          HG12      VAL  25  -1.018   2.620  -5.283
  219   3HG1  VAL  25          HG13      VAL  25  -1.644   2.271  -3.672
  220   1HG2  VAL  25          HG21      VAL  25  -1.263  -1.285  -3.707
  221   2HG2  VAL  25          HG22      VAL  25  -2.159   0.092  -3.063
  222   3HG2  VAL  25          HG23      VAL  25  -0.438  -0.082  -2.715
  223    H    TYR  26           HN       TYR  26   1.080  -0.393  -6.930
  224    HA   TYR  26           HA       TYR  26   1.243  -3.308  -6.593
  225   1HB   TYR  26          HB2       TYR  26   2.895  -1.462  -8.331
  226   2HB   TYR  26          HB1       TYR  26   3.074  -3.211  -8.244
  227    HD1  TYR  26           HD2      TYR  26   0.926  -4.596  -8.805
  228    HD2  TYR  26           HD1      TYR  26   1.522  -0.544  -9.957
  229    HE1  TYR  26           HE2      TYR  26  -0.754  -4.860 -10.582
  230    HE2  TYR  26           HE1      TYR  26  -0.157  -0.796 -11.736
  231    HH   TYR  26           HH       TYR  26  -1.407  -3.855 -12.664
  232    H    ILE  27           HN       ILE  27   2.260  -3.937  -4.819
  233    HA   ILE  27           HA       ILE  27   4.091  -2.194  -3.432
  234    HB   ILE  27           HB       ILE  27   3.672  -5.063  -2.678
  235   1HG1  ILE  27          HG12      ILE  27   1.420  -4.339  -3.089
  236   2HG1  ILE  27          HG11      ILE  27   1.674  -4.300  -1.348
  237   1HG2  ILE  27          HG21      ILE  27   5.285  -3.621  -1.468
  238   2HG2  ILE  27          HG22      ILE  27   3.991  -4.248  -0.447
  239   3HG2  ILE  27          HG23      ILE  27   3.942  -2.576  -1.003
  240   1HD1  ILE  27          HD11      ILE  27   1.306  -2.063  -3.265
  241   2HD1  ILE  27          HD12      ILE  27   2.281  -1.792  -1.820
  242   3HD1  ILE  27          HD13      ILE  27   0.604  -2.314  -1.667
  243    H    HIS  28           HN       HIS  28   6.243  -2.207  -3.520
  244    HA   HIS  28           HA       HIS  28   7.568  -4.073  -5.304
  245   1HB   HIS  28          HB2       HIS  28   8.088  -1.619  -5.301
  246   2HB   HIS  28          HB1       HIS  28   8.776  -1.814  -3.693
  247    HD1  HIS  28           HD1      HIS  28   9.271  -3.818  -6.897
  248    HD2  HIS  28           HD2      HIS  28  11.455  -1.777  -4.011
  249    HE1  HIS  28           HE1      HIS  28  11.685  -4.150  -7.520
  250    HE2  HIS  28           HE2      HIS  28  12.984  -2.835  -5.809
  251    H    LYS  29           HN       LYS  29   7.848  -3.049  -1.917
  252    HA   LYS  29           HA       LYS  29   8.926  -5.706  -1.276
  253   1HB   LYS  29          HB2       LYS  29  10.243  -4.392   0.567
  254   2HB   LYS  29          HB1       LYS  29  10.887  -4.500  -1.065
  255   1HG   LYS  29          HG2       LYS  29  10.625  -2.296  -1.462
  256   2HG   LYS  29          HG1       LYS  29   9.141  -2.190  -0.514
  257   1HD   LYS  29          HD2       LYS  29  11.886  -2.501   0.692
  258   2HD   LYS  29          HD1       LYS  29  11.093  -0.944   0.445
  259   1HE   LYS  29          HE2       LYS  29   9.576  -1.297   2.108
  260   2HE   LYS  29          HE1       LYS  29   9.564  -3.044   1.875
  261   1HZ   LYS  29          HZ1       LYS  29  10.612  -2.666   3.926
  262   2HZ   LYS  29          HZ2       LYS  29  11.572  -1.414   3.316
  263   3HZ   LYS  29          HZ3       LYS  29  11.872  -3.012   2.851
  264    H    GLU  30           HN       GLU  30   8.203  -6.597   0.637
  265    HA   GLU  30           HA       GLU  30   5.964  -5.171   1.881
  266   1HB   GLU  30          HB2       GLU  30   6.620  -8.095   2.180
  267   2HB   GLU  30          HB1       GLU  30   5.100  -7.288   2.539
  268   1HG   GLU  30          HG2       GLU  30   5.083  -6.715   0.020
  269   2HG   GLU  30          HG1       GLU  30   6.274  -8.009  -0.111
  270    H    VAL  31           HN       VAL  31   6.405  -4.132   3.692
  271    HA   VAL  31           HA       VAL  31   8.504  -5.169   5.461
  272    HB   VAL  31           HB       VAL  31   7.283  -2.689   6.337
  273   1HG1  VAL  31          HG11      VAL  31   9.347  -3.326   7.262
  274   2HG1  VAL  31          HG12      VAL  31   9.716  -1.969   6.199
  275   3HG1  VAL  31          HG13      VAL  31  10.061  -3.618   5.676
  276   1HG2  VAL  31          HG21      VAL  31   8.407  -2.800   3.549
  277   2HG2  VAL  31          HG22      VAL  31   8.379  -1.316   4.500
  278   3HG2  VAL  31          HG23      VAL  31   6.869  -2.123   4.081
  279    H    ASP  32           HN       ASP  32   7.392  -6.826   6.405
  280    HA   ASP  32           HA       ASP  32   4.807  -6.606   7.539
  281   1HB   ASP  32          HB2       ASP  32   6.407  -8.699   6.924
  282   2HB   ASP  32          HB1       ASP  32   6.644  -8.632   8.668
  283    H    LYS  33           HN       LYS  33   8.055  -6.185   8.822
  284    HA   LYS  33           HA       LYS  33   7.464  -6.141  11.546
  285   1HB   LYS  33          HB2       LYS  33   9.503  -4.605  11.680
  286   2HB   LYS  33          HB1       LYS  33   9.742  -6.196  10.970
  287   1HG   LYS  33          HG2       LYS  33   9.032  -4.148   9.019
  288   2HG   LYS  33          HG1       LYS  33  10.540  -3.821   9.875
  289   1HD   LYS  33          HD2       LYS  33  10.850  -6.447   9.317
  290   2HD   LYS  33          HD1       LYS  33   9.877  -5.939   7.935
  291   1HE   LYS  33          HE2       LYS  33  11.881  -5.400   7.057
  292   2HE   LYS  33          HE1       LYS  33  11.675  -3.935   8.016
  293   1HZ   LYS  33          HZ1       LYS  33  13.151  -4.663   9.607
  294   2HZ   LYS  33          HZ2       LYS  33  13.859  -5.270   8.195
  295   3HZ   LYS  33          HZ3       LYS  33  12.970  -6.297   9.204
  296    H    ASN  34           HN       ASN  34   6.723  -3.847   9.078
  297    HA   ASN  34           HA       ASN  34   5.256  -2.237  10.947
  298   1HB   ASN  34          HB2       ASN  34   6.412  -0.131  10.432
  299   2HB   ASN  34          HB1       ASN  34   7.493  -1.285  11.205
  300   1HD2  ASN  34          HD21      ASN  34   7.328   0.934   8.845
  301   2HD2  ASN  34          HD22      ASN  34   8.546   0.339   7.776
  302    H    TRP  35           HN       TRP  35   5.543   0.014   8.877
  303    HA   TRP  35           HA       TRP  35   3.218  -0.587   7.410
  304   1HB   TRP  35          HB2       TRP  35   5.215   1.582   6.796
  305   2HB   TRP  35          HB1       TRP  35   3.498   1.567   6.423
  306    HD1  TRP  35           HD1      TRP  35   1.872   1.495   8.774
  307    HE1  TRP  35           HE1      TRP  35   2.178   2.904  10.905
  308    HE3  TRP  35           HE3      TRP  35   6.788   2.767   8.201
  309    HZ2  TRP  35           HZ2      TRP  35   4.234   4.365  12.174
  310    HZ3  TRP  35           HZ3      TRP  35   7.850   4.175   9.917
  311    HH2  TRP  35           HH2      TRP  35   6.598   4.957  11.861
  312    H    LEU  36           HN       LEU  36   2.894  -1.095   5.283
  313    HA   LEU  36           HA       LEU  36   4.970  -2.519   3.933
  314   1HB   LEU  36          HB2       LEU  36   2.613  -3.210   3.910
  315   2HB   LEU  36          HB1       LEU  36   2.191  -1.733   3.066
  316    HG   LEU  36           HG       LEU  36   4.074  -2.755   1.395
  317   1HD1  LEU  36          HD11      LEU  36   4.117  -5.028   1.353
  318   2HD1  LEU  36          HD12      LEU  36   2.487  -5.181   2.007
  319   3HD1  LEU  36          HD13      LEU  36   3.835  -4.801   3.080
  320   1HD2  LEU  36          HD21      LEU  36   1.230  -2.413   1.481
  321   2HD2  LEU  36          HD22      LEU  36   1.623  -3.890   0.598
  322   3HD2  LEU  36          HD23      LEU  36   2.317  -2.349   0.095
  323    H    GLU  37           HN       GLU  37   5.948  -1.972   1.950
  324    HA   GLU  37           HA       GLU  37   5.806   0.894   1.299
  325   1HB   GLU  37          HB2       GLU  37   8.007  -0.081   2.061
  326   2HB   GLU  37          HB1       GLU  37   8.026  -1.012   0.570
  327   1HG   GLU  37          HG2       GLU  37   8.154   0.953  -0.754
  328   2HG   GLU  37          HG1       GLU  37   7.834   1.985   0.639
  329    H    GLY  38           HN       GLY  38   4.856   1.461  -0.525
  330   1HA   GLY  38          HA2       GLY  38   5.057  -0.293  -2.864
  331   2HA   GLY  38          HA1       GLY  38   3.449   0.136  -2.298
  332    H    GLU  39           HN       GLU  39   4.182   0.772  -4.850
  333    HA   GLU  39           HA       GLU  39   4.035   3.668  -4.749
  334   1HB   GLU  39          HB2       GLU  39   5.798   3.665  -6.700
  335   2HB   GLU  39          HB1       GLU  39   6.319   3.711  -5.022
  336   1HG   GLU  39          HG2       GLU  39   7.584   2.141  -6.489
  337   2HG   GLU  39          HG1       GLU  39   6.888   1.415  -5.040
  338    H    HIS  40           HN       HIS  40   3.432   4.621  -6.813
  339    HA   HIS  40           HA       HIS  40   2.474   2.825  -8.879
  340   1HB   HIS  40          HB2       HIS  40   0.648   3.046  -7.110
  341   2HB   HIS  40          HB1       HIS  40   0.523   4.734  -7.593
  342    HD1  HIS  40           HD1      HIS  40  -0.556   5.239  -9.877
  343    HD2  HIS  40           HD2      HIS  40  -0.377   1.192  -8.952
  344    HE1  HIS  40           HE1      HIS  40  -2.044   4.099 -11.554
  345    HE2  HIS  40           HE2      HIS  40  -1.981   1.660 -10.925
  346    H    HIS  41           HN       HIS  41   2.899   3.711 -10.788
  347    HA   HIS  41           HA       HIS  41   3.481   5.223 -12.385
  348   1HB   HIS  41          HB2       HIS  41   1.389   6.675 -10.808
  349   2HB   HIS  41          HB1       HIS  41   2.244   7.519 -12.096
  350    HD1  HIS  41           HD1      HIS  41  -0.775   6.993 -12.306
  351    HD2  HIS  41           HD2      HIS  41   2.141   4.485 -13.879
  352    HE1  HIS  41           HE1      HIS  41  -1.915   5.703 -14.140
  353    HE2  HIS  41           HE2      HIS  41  -0.152   4.133 -15.021
  354    H    GLY  42           HN       GLY  42   5.267   5.001 -10.193
  355   1HA   GLY  42          HA2       GLY  42   7.301   6.067  -9.778
  356   2HA   GLY  42          HA1       GLY  42   6.660   7.527 -10.511
  357    H    ARG  43           HN       ARG  43   4.257   6.875  -8.524
  358    HA   ARG  43           HA       ARG  43   5.353   8.568  -6.416
  359   1HB   ARG  43          HB2       ARG  43   2.784   8.255  -7.645
  360   2HB   ARG  43          HB1       ARG  43   2.625   7.954  -5.920
  361   1HG   ARG  43          HG2       ARG  43   4.201  10.326  -6.673
  362   2HG   ARG  43          HG1       ARG  43   2.474  10.389  -7.031
  363   1HD   ARG  43          HD2       ARG  43   2.126   9.613  -4.624
  364   2HD   ARG  43          HD1       ARG  43   3.824  10.016  -4.372
  365    HE   ARG  43           HE       ARG  43   3.214  12.205  -4.268
  366   1HH1  ARG  43          HH11      ARG  43   0.747  10.478  -6.033
  367   2HH1  ARG  43          HH12      ARG  43  -0.286  11.859  -6.186
  368   1HH2  ARG  43          HH21      ARG  43   1.856  14.022  -4.469
  369   2HH2  ARG  43          HH22      ARG  43   0.343  13.871  -5.299
  370    H    LEU  44           HN       LEU  44   6.006   7.768  -4.526
  371    HA   LEU  44           HA       LEU  44   5.356   4.986  -3.904
  372   1HB   LEU  44          HB2       LEU  44   7.280   4.893  -2.597
  373   2HB   LEU  44          HB1       LEU  44   7.744   5.889  -3.961
  374    HG   LEU  44           HG       LEU  44   6.886   7.057  -1.319
  375   1HD1  LEU  44          HD11      LEU  44   9.530   6.011  -2.207
  376   2HD1  LEU  44          HD12      LEU  44   8.760   5.935  -0.622
  377   3HD1  LEU  44          HD13      LEU  44   9.468   7.448  -1.187
  378   1HD2  LEU  44          HD21      LEU  44   6.809   8.832  -2.725
  379   2HD2  LEU  44          HD22      LEU  44   7.915   8.100  -3.888
  380   3HD2  LEU  44          HD23      LEU  44   8.545   8.843  -2.417
  381    H    GLY  45           HN       GLY  45   4.121   4.382  -2.251
  382   1HA   GLY  45          HA2       GLY  45   3.466   6.353  -0.169
  383   2HA   GLY  45          HA1       GLY  45   2.163   5.557  -1.038
  384    H    ILE  46           HN       ILE  46   3.583   5.526   1.808
  385    HA   ILE  46           HA       ILE  46   3.532   2.594   2.074
  386    HB   ILE  46           HB       ILE  46   4.954   4.599   3.825
  387   1HG1  ILE  46          HG12      ILE  46   5.909   2.812   1.590
  388   2HG1  ILE  46          HG11      ILE  46   6.015   4.566   1.684
  389   1HG2  ILE  46          HG21      ILE  46   5.720   1.757   3.868
  390   2HG2  ILE  46          HG22      ILE  46   4.152   2.132   4.575
  391   3HG2  ILE  46          HG23      ILE  46   5.602   2.922   5.185
  392   1HD1  ILE  46          HD11      ILE  46   7.489   4.135   3.747
  393   2HD1  ILE  46          HD12      ILE  46   8.164   3.877   2.138
  394   3HD1  ILE  46          HD13      ILE  46   7.629   2.499   3.101
  395    H    PHE  47           HN       PHE  47   2.483   1.657   3.801
  396    HA   PHE  47           HA       PHE  47   1.079   3.198   5.774
  397   1HB   PHE  47          HB2       PHE  47  -1.152   2.031   4.993
  398   2HB   PHE  47          HB1       PHE  47  -0.652   3.563   4.287
  399    HD1  PHE  47           HD2      PHE  47   0.327   3.622   2.028
  400    HD2  PHE  47           HD1      PHE  47  -1.248   0.039   3.698
  401    HE1  PHE  47           HE2      PHE  47   0.246   2.616  -0.216
  402    HE2  PHE  47           HE1      PHE  47  -1.331  -0.974   1.457
  403    HZ   PHE  47           HZ       PHE  47  -0.583   0.315  -0.503
  404    HA   PRO  48           HA       PRO  48   1.435  -0.462   8.180
  405   1HB   PRO  48          HB2       PRO  48  -1.126  -0.747   9.211
  406   2HB   PRO  48          HB1       PRO  48   0.140   0.285   9.885
  407   1HG   PRO  48          HG2       PRO  48  -2.148   1.004   8.101
  408   2HG   PRO  48          HG1       PRO  48  -1.461   1.904   9.467
  409   1HD   PRO  48          HD2       PRO  48  -0.932   2.598   6.934
  410   2HD   PRO  48          HD1       PRO  48   0.308   2.718   8.201
  411    H    ALA  49           HN       ALA  49   1.452  -2.557   7.698
  412    HA   ALA  49           HA       ALA  49   0.308  -3.624   5.413
  413   1HB   ALA  49          HB1       ALA  49   1.456  -5.482   5.933
  414   2HB   ALA  49          HB2       ALA  49   0.781  -5.567   7.561
  415   3HB   ALA  49          HB3       ALA  49   2.134  -4.487   7.223
  416    H    ASN  50           HN       ASN  50  -1.088  -3.190   8.548
  417    HA   ASN  50           HA       ASN  50  -3.183  -5.125   8.204
  418   1HB   ASN  50          HB2       ASN  50  -2.481  -3.068  10.245
  419   2HB   ASN  50          HB1       ASN  50  -4.143  -3.650  10.194
  420   1HD2  ASN  50          HD21      ASN  50  -4.405  -6.030  10.225
  421   2HD2  ASN  50          HD22      ASN  50  -3.327  -6.946  11.217
  422    H    TYR  51           HN       TYR  51  -2.639  -2.224   6.721
  423    HA   TYR  51           HA       TYR  51  -5.512  -1.621   6.502
  424   1HB   TYR  51          HB2       TYR  51  -3.070   0.119   6.270
  425   2HB   TYR  51          HB1       TYR  51  -4.606   0.612   5.565
  426    HD1  TYR  51           HD1      TYR  51  -3.702  -1.020   8.808
  427    HD2  TYR  51           HD2      TYR  51  -5.559   2.271   6.853
  428    HE1  TYR  51           HE1      TYR  51  -4.409  -0.132  10.989
  429    HE2  TYR  51           HE2      TYR  51  -6.271   3.169   9.029
  430    HH   TYR  51           HH       TYR  51  -5.623   3.019  11.385
  431    H    VAL  52           HN       VAL  52  -4.134  -3.708   5.016
  432    HA   VAL  52           HA       VAL  52  -4.975  -2.914   2.366
  433    HB   VAL  52           HB       VAL  52  -2.626  -2.177   2.388
  434   1HG1  VAL  52          HG11      VAL  52  -2.154  -4.367   3.946
  435   2HG1  VAL  52          HG12      VAL  52  -0.913  -3.398   3.154
  436   3HG1  VAL  52          HG13      VAL  52  -1.499  -4.876   2.390
  437   1HG2  VAL  52          HG21      VAL  52  -2.765  -4.622   0.659
  438   2HG2  VAL  52          HG22      VAL  52  -2.066  -3.043   0.299
  439   3HG2  VAL  52          HG23      VAL  52  -3.818  -3.237   0.366
  440    H    GLU  53           HN       GLU  53  -5.061  -4.734   0.865
  441    HA   GLU  53           HA       GLU  53  -5.162  -7.330   2.256
  442   1HB   GLU  53          HB2       GLU  53  -7.340  -6.008   1.333
  443   2HB   GLU  53          HB1       GLU  53  -6.917  -6.946  -0.092
  444   1HG   GLU  53          HG2       GLU  53  -6.865  -8.967   1.447
  445   2HG   GLU  53          HG1       GLU  53  -7.660  -7.938   2.638
  446    H    VAL  54           HN       VAL  54  -3.800  -8.780   1.464
  447    HA   VAL  54           HA       VAL  54  -2.391  -8.310  -0.994
  448    HB   VAL  54           HB       VAL  54  -1.269  -9.315   0.957
  449   1HG1  VAL  54          HG11      VAL  54  -2.845 -11.815   0.380
  450   2HG1  VAL  54          HG12      VAL  54  -3.262 -10.678   1.662
  451   3HG1  VAL  54          HG13      VAL  54  -1.716 -11.525   1.704
  452   1HG2  VAL  54          HG21      VAL  54  -1.094 -11.512  -0.996
  453   2HG2  VAL  54          HG22      VAL  54   0.167 -10.463  -0.347
  454   3HG2  VAL  54          HG23      VAL  54  -0.871  -9.890  -1.652
  455    H    LEU  55           HN       LEU  55  -3.035  -8.906  -2.946
  456    HA   LEU  55           HA       LEU  55  -4.051 -11.453  -3.577
  457   1HB   LEU  55          HB2       LEU  55  -6.331 -10.864  -4.237
  458   2HB   LEU  55          HB1       LEU  55  -6.084 -10.669  -2.512
  459    HG   LEU  55           HG       LEU  55  -5.578  -8.194  -3.943
  460   1HD1  LEU  55          HD11      LEU  55  -8.065  -9.695  -4.534
  461   2HD1  LEU  55          HD12      LEU  55  -7.176  -8.536  -5.522
  462   3HD1  LEU  55          HD13      LEU  55  -8.208  -7.968  -4.209
  463   1HD2  LEU  55          HD21      LEU  55  -7.023  -7.287  -2.247
  464   2HD2  LEU  55          HD22      LEU  55  -5.933  -8.459  -1.505
  465   3HD2  LEU  55          HD23      LEU  55  -7.610  -8.897  -1.831
  466    HA   PRO  56           HA       PRO  56  -1.983  -8.912  -6.930
  467   1HB   PRO  56          HB2       PRO  56  -1.267 -11.733  -7.589
  468   2HB   PRO  56          HB1       PRO  56  -0.267 -10.277  -7.641
  469   1HG   PRO  56          HG2       PRO  56   0.002 -12.034  -5.661
  470   2HG   PRO  56          HG1       PRO  56   0.108 -10.291  -5.352
  471   1HD   PRO  56          HD2       PRO  56  -2.112 -12.191  -4.760
  472   2HD   PRO  56          HD1       PRO  56  -1.570 -10.767  -3.850
  473    H    LEU  57           HN       LEU  57  -2.576  -8.742  -9.091
  474    HA   LEU  57           HA       LEU  57  -4.894 -10.378  -9.879
  475   1HB   LEU  57          HB2       LEU  57  -4.109  -7.581 -10.700
  476   2HB   LEU  57          HB1       LEU  57  -5.454  -8.472 -11.388
  477    HG   LEU  57           HG       LEU  57  -6.177  -8.633  -8.833
  478   1HD1  LEU  57          HD11      LEU  57  -4.268  -6.345  -8.981
  479   2HD1  LEU  57          HD12      LEU  57  -4.506  -7.531  -7.697
  480   3HD1  LEU  57          HD13      LEU  57  -5.683  -6.239  -7.934
  481   1HD2  LEU  57          HD21      LEU  57  -7.701  -7.736 -10.333
  482   2HD2  LEU  57          HD22      LEU  57  -6.605  -6.448 -10.833
  483   3HD2  LEU  57          HD23      LEU  57  -7.377  -6.383  -9.249
  484    H    GLU  58           HN       GLU  58  -1.769  -9.165 -10.866
  485    HA   GLU  58           HA       GLU  58  -1.948 -10.103 -13.567
  486   1HB   GLU  58          HB2       GLU  58   0.091  -8.812 -11.862
  487   2HB   GLU  58          HB1       GLU  58   0.719  -9.841 -13.142
  488   1HG   GLU  58          HG2       GLU  58  -1.330  -8.213 -14.240
  489   2HG   GLU  58          HG1       GLU  58  -0.237  -7.185 -13.314
  Start of MODEL   20
    1   1H    MET   0          HT1       MET   0   3.718  -9.838 -12.457
    2   2H    MET   0          HT2       MET   0   2.577 -10.465 -11.339
    3   3H    MET   0          HT3       MET   0   4.238 -10.375 -10.915
    4    HA   MET   0           HA       MET   0   4.212  -8.093 -10.785
    5   1HB   MET   0          HB2       MET   0   2.142  -6.827 -11.458
    6   2HB   MET   0          HB1       MET   0   3.010  -7.583 -12.788
    7   1HG   MET   0          HG2       MET   0   0.893  -9.227 -11.597
    8   2HG   MET   0          HG1       MET   0   0.342  -7.754 -12.391
    9   1HE   MET   0          HE1       MET   0  -0.120 -11.019 -14.748
   10   2HE   MET   0          HE2       MET   0  -1.044  -9.629 -14.178
   11   3HE   MET   0          HE3       MET   0  -0.334 -10.752 -13.018
   12    H    LYS   1           HN       LYS   1   3.955  -7.459  -8.741
   13    HA   LYS   1           HA       LYS   1   1.956  -8.810  -7.098
   14   1HB   LYS   1          HB2       LYS   1   4.614  -8.037  -6.670
   15   2HB   LYS   1          HB1       LYS   1   3.660  -6.954  -5.667
   16   1HG   LYS   1          HG2       LYS   1   3.693  -8.578  -4.150
   17   2HG   LYS   1          HG1       LYS   1   2.518  -9.403  -5.175
   18   1HD   LYS   1          HD2       LYS   1   4.950 -10.021  -6.338
   19   2HD   LYS   1          HD1       LYS   1   5.291 -10.070  -4.608
   20   1HE   LYS   1          HE2       LYS   1   4.499 -12.166  -4.729
   21   2HE   LYS   1          HE1       LYS   1   2.917 -11.390  -4.726
   22   1HZ   LYS   1          HZ1       LYS   1   3.498 -11.303  -7.317
   23   2HZ   LYS   1          HZ2       LYS   1   2.665 -12.587  -6.597
   24   3HZ   LYS   1          HZ3       LYS   1   4.325 -12.717  -6.890
   25    H    ALA   2           HN       ALA   2   0.215  -7.839  -6.253
   26    HA   ALA   2           HA       ALA   2   0.060  -4.940  -6.097
   27   1HB   ALA   2          HB1       ALA   2  -1.522  -4.579  -7.662
   28   2HB   ALA   2          HB2       ALA   2  -2.309  -6.132  -7.379
   29   3HB   ALA   2          HB3       ALA   2  -0.857  -6.048  -8.377
   30    H    ALA   3           HN       ALA   3  -1.632  -4.185  -4.739
   31    HA   ALA   3           HA       ALA   3  -3.041  -6.256  -3.203
   32   1HB   ALA   3          HB1       ALA   3  -1.081  -5.640  -1.908
   33   2HB   ALA   3          HB2       ALA   3  -2.547  -5.062  -1.116
   34   3HB   ALA   3          HB3       ALA   3  -1.526  -3.936  -2.011
   35    H    ARG   4           HN       ARG   4  -5.087  -5.744  -2.561
   36    HA   ARG   4           HA       ARG   4  -6.162  -3.223  -3.605
   37   1HB   ARG   4          HB2       ARG   4  -7.049  -5.760  -3.980
   38   2HB   ARG   4          HB1       ARG   4  -8.022  -5.284  -2.596
   39   1HG   ARG   4          HG2       ARG   4  -9.238  -3.798  -3.786
   40   2HG   ARG   4          HG1       ARG   4  -7.884  -3.358  -4.828
   41   1HD   ARG   4          HD2       ARG   4  -8.217  -5.855  -5.665
   42   2HD   ARG   4          HD1       ARG   4  -9.859  -5.559  -5.096
   43    HE   ARG   4           HE       ARG   4  -8.991  -3.420  -6.726
   44   1HH1  ARG   4          HH11      ARG   4 -10.025  -6.748  -6.920
   45   2HH1  ARG   4          HH12      ARG   4 -10.639  -6.594  -8.531
   46   1HH2  ARG   4          HH21      ARG   4  -9.799  -3.217  -8.846
   47   2HH2  ARG   4          HH22      ARG   4 -10.509  -4.590  -9.626
   48    H    LEU   5           HN       LEU   5  -6.561  -1.632  -2.232
   49    HA   LEU   5           HA       LEU   5  -6.460  -2.030   0.603
   50   1HB   LEU   5          HB2       LEU   5  -5.864   0.060  -0.970
   51   2HB   LEU   5          HB1       LEU   5  -7.494   0.515  -0.512
   52    HG   LEU   5           HG       LEU   5  -6.466  -0.097   1.919
   53   1HD1  LEU   5          HD11      LEU   5  -4.247   0.188   2.118
   54   2HD1  LEU   5          HD12      LEU   5  -4.193   1.449   0.887
   55   3HD1  LEU   5          HD13      LEU   5  -4.225  -0.248   0.409
   56   1HD2  LEU   5          HD21      LEU   5  -6.039   2.402   2.098
   57   2HD2  LEU   5          HD22      LEU   5  -7.650   1.906   1.581
   58   3HD2  LEU   5          HD23      LEU   5  -6.485   2.492   0.394
   59    H    LYS   6           HN       LYS   6  -8.118  -1.654   2.114
   60    HA   LYS   6           HA       LYS   6 -10.852  -1.522   1.069
   61   1HB   LYS   6          HB2       LYS   6  -9.712  -3.682   2.822
   62   2HB   LYS   6          HB1       LYS   6 -11.428  -3.300   2.852
   63   1HG   LYS   6          HG2       LYS   6  -9.839  -4.215   0.464
   64   2HG   LYS   6          HG1       LYS   6 -11.014  -5.163   1.378
   65   1HD   LYS   6          HD2       LYS   6 -12.441  -2.914   0.701
   66   2HD   LYS   6          HD1       LYS   6 -11.430  -3.176  -0.721
   67   1HE   LYS   6          HE2       LYS   6 -13.247  -5.211   0.567
   68   2HE   LYS   6          HE1       LYS   6 -13.569  -4.335  -0.928
   69   1HZ   LYS   6          HZ1       LYS   6 -11.061  -5.796  -0.830
   70   2HZ   LYS   6          HZ2       LYS   6 -12.173  -5.637  -2.094
   71   3HZ   LYS   6          HZ3       LYS   6 -12.460  -6.747  -0.851
   72    H    PHE   7           HN       PHE   7  -8.900   0.212   2.651
   73    HA   PHE   7           HA       PHE   7 -10.863   1.168   4.545
   74   1HB   PHE   7          HB2       PHE   7  -8.106   0.497   5.575
   75   2HB   PHE   7          HB1       PHE   7  -9.500   1.038   6.503
   76    HD1  PHE   7           HD2      PHE   7  -8.017  -1.791   4.686
   77    HD2  PHE   7           HD1      PHE   7 -11.185  -0.489   7.211
   78    HE1  PHE   7           HE2      PHE   7  -8.633  -4.134   5.115
   79    HE2  PHE   7           HE1      PHE   7 -11.807  -2.829   7.645
   80    HZ   PHE   7           HZ       PHE   7 -10.531  -4.656   6.596
   81    H    ASP   8           HN       ASP   8 -10.948   3.276   4.169
   82    HA   ASP   8           HA       ASP   8  -8.975   4.711   2.762
   83   1HB   ASP   8          HB2       ASP   8 -11.427   5.292   2.920
   84   2HB   ASP   8          HB1       ASP   8 -11.108   5.901   4.542
   85    H    PHE   9           HN       PHE   9  -7.026   5.226   3.489
   86    HA   PHE   9           HA       PHE   9  -6.745   6.011   6.316
   87   1HB   PHE   9          HB2       PHE   9  -5.532   3.874   5.167
   88   2HB   PHE   9          HB1       PHE   9  -4.324   5.120   4.871
   89    HD1  PHE   9           HD2      PHE   9  -4.090   6.724   7.105
   90    HD2  PHE   9           HD1      PHE   9  -5.105   2.592   7.007
   91    HE1  PHE   9           HE2      PHE   9  -3.263   6.471   9.408
   92    HE2  PHE   9           HE1      PHE   9  -4.280   2.332   9.311
   93    HZ   PHE   9           HZ       PHE   9  -3.357   4.272  10.514
   94    H    GLN  10           HN       GLN  10  -5.747   7.903   6.782
   95    HA   GLN  10           HA       GLN  10  -5.060   9.614   4.504
   96   1HB   GLN  10          HB2       GLN  10  -5.203  11.465   6.182
   97   2HB   GLN  10          HB1       GLN  10  -6.706  10.580   5.954
   98   1HG   GLN  10          HG2       GLN  10  -6.767   9.918   8.077
   99   2HG   GLN  10          HG1       GLN  10  -5.058   9.485   8.086
  100   1HE2  GLN  10          HE21      GLN  10  -7.070  12.408   7.926
  101   2HE2  GLN  10          HE22      GLN  10  -6.132  13.321   9.054
  102    H    ALA  11           HN       ALA  11  -3.046  10.334   4.145
  103    HA   ALA  11           HA       ALA  11  -0.876   9.189   5.624
  104   1HB   ALA  11          HB1       ALA  11  -0.476   9.376   3.331
  105   2HB   ALA  11          HB2       ALA  11   0.497  10.665   4.041
  106   3HB   ALA  11          HB3       ALA  11  -1.045  11.044   3.274
  107    H    GLN  12           HN       GLN  12   0.002   9.985   7.408
  108    HA   GLN  12           HA       GLN  12  -0.616  12.678   8.266
  109   1HB   GLN  12          HB2       GLN  12   0.826  11.916  10.274
  110   2HB   GLN  12          HB1       GLN  12  -0.757  11.191  10.048
  111   1HG   GLN  12          HG2       GLN  12   1.466   9.780   8.747
  112   2HG   GLN  12          HG1       GLN  12   1.517   9.811  10.508
  113   1HE2  GLN  12          HE21      GLN  12   0.649   8.082  11.372
  114   2HE2  GLN  12          HE22      GLN  12  -0.714   7.208  10.771
  115    H    SER  13           HN       SER  13   2.192  10.816   7.238
  116    HA   SER  13           HA       SER  13   3.858  13.225   7.445
  117   1HB   SER  13          HB2       SER  13   5.685  11.415   6.847
  118   2HB   SER  13          HB1       SER  13   5.064  11.550   8.492
  119    HG   SER  13           HG       SER  13   4.418   9.646   6.510
  120    HA   PRO  14           HA       PRO  14   4.086  13.894   3.105
  121   1HB   PRO  14          HB2       PRO  14   6.769  14.265   2.681
  122   2HB   PRO  14          HB1       PRO  14   5.704  15.486   3.386
  123   1HG   PRO  14          HG2       PRO  14   7.563  13.579   4.749
  124   2HG   PRO  14          HG1       PRO  14   7.265  15.293   5.093
  125   1HD   PRO  14          HD2       PRO  14   6.170  13.336   6.580
  126   2HD   PRO  14          HD1       PRO  14   5.306  14.851   6.244
  127    H    LYS  15           HN       LYS  15   6.195  11.444   4.459
  128    HA   LYS  15           HA       LYS  15   6.886  10.243   1.960
  129   1HB   LYS  15          HB2       LYS  15   7.806  10.030   4.549
  130   2HB   LYS  15          HB1       LYS  15   6.991   8.492   4.305
  131   1HG   LYS  15          HG2       LYS  15   8.430   8.751   1.996
  132   2HG   LYS  15          HG1       LYS  15   9.497   9.490   3.192
  133   1HD   LYS  15          HD2       LYS  15   9.375   7.489   4.568
  134   2HD   LYS  15          HD1       LYS  15   8.246   6.753   3.429
  135   1HE   LYS  15          HE2       LYS  15   9.868   6.293   1.906
  136   2HE   LYS  15          HE1       LYS  15  10.825   7.711   2.335
  137   1HZ   LYS  15          HZ1       LYS  15  11.928   6.594   3.943
  138   2HZ   LYS  15          HZ2       LYS  15  11.549   5.260   2.974
  139   3HZ   LYS  15          HZ3       LYS  15  10.614   5.604   4.340
  140    H    GLU  16           HN       GLU  16   4.262   9.910   4.222
  141    HA   GLU  16           HA       GLU  16   3.323   7.399   3.206
  142   1HB   GLU  16          HB2       GLU  16   2.386   9.405   5.184
  143   2HB   GLU  16          HB1       GLU  16   1.159   8.375   4.461
  144   1HG   GLU  16          HG2       GLU  16   3.392   6.779   5.260
  145   2HG   GLU  16          HG1       GLU  16   2.873   7.791   6.607
  146    H    LEU  17           HN       LEU  17   1.130   7.164   2.248
  147    HA   LEU  17           HA       LEU  17   0.419   9.427   0.509
  148   1HB   LEU  17          HB2       LEU  17   1.731   7.845  -0.802
  149   2HB   LEU  17          HB1       LEU  17   0.666   6.537  -0.324
  150    HG   LEU  17           HG       LEU  17  -0.533   8.871  -1.734
  151   1HD1  LEU  17          HD11      LEU  17   0.309   8.427  -3.780
  152   2HD1  LEU  17          HD12      LEU  17   0.496   6.704  -3.451
  153   3HD1  LEU  17          HD13      LEU  17   1.687   7.853  -2.841
  154   1HD2  LEU  17          HD21      LEU  17  -1.123   6.019  -1.239
  155   2HD2  LEU  17          HD22      LEU  17  -1.624   6.671  -2.799
  156   3HD2  LEU  17          HD23      LEU  17  -2.205   7.409  -1.306
  157    H    THR  18           HN       THR  18  -1.682   9.907   0.500
  158    HA   THR  18           HA       THR  18  -3.501   8.250   2.033
  159    HB   THR  18           HB       THR  18  -4.007  10.883   0.633
  160    HG1  THR  18           HG1      THR  18  -3.332  11.846   2.407
  161   1HG2  THR  18          HG21      THR  18  -5.723   9.125   2.177
  162   2HG2  THR  18          HG22      THR  18  -6.129  10.510   1.163
  163   3HG2  THR  18          HG23      THR  18  -5.633  10.757   2.837
  164    H    LEU  19           HN       LEU  19  -4.791   6.771   1.173
  165    HA   LEU  19           HA       LEU  19  -5.871   7.155  -1.506
  166   1HB   LEU  19          HB2       LEU  19  -5.189   5.001  -2.311
  167   2HB   LEU  19          HB1       LEU  19  -3.766   5.885  -1.793
  168    HG   LEU  19           HG       LEU  19  -5.088   3.923   0.051
  169   1HD1  LEU  19          HD11      LEU  19  -2.789   2.917  -1.446
  170   2HD1  LEU  19          HD12      LEU  19  -4.236   3.150  -2.426
  171   3HD1  LEU  19          HD13      LEU  19  -4.295   2.116  -0.999
  172   1HD2  LEU  19          HD21      LEU  19  -2.187   4.146   0.004
  173   2HD2  LEU  19          HD22      LEU  19  -3.312   4.276   1.355
  174   3HD2  LEU  19          HD23      LEU  19  -2.986   5.681   0.342
  175    H    GLN  20           HN       GLN  20  -7.868   6.268  -1.793
  176    HA   GLN  20           HA       GLN  20  -9.197   5.295   0.588
  177   1HB   GLN  20          HB2       GLN  20 -10.042   6.936  -1.356
  178   2HB   GLN  20          HB1       GLN  20 -10.626   5.413  -2.014
  179   1HG   GLN  20          HG2       GLN  20 -12.363   5.449  -0.653
  180   2HG   GLN  20          HG1       GLN  20 -11.301   5.536   0.751
  181   1HE2  GLN  20          HE21      GLN  20 -13.901   6.811   0.190
  182   2HE2  GLN  20          HE22      GLN  20 -13.641   8.505   0.405
  183    H    LYS  21           HN       LYS  21 -10.720   3.421   0.397
  184    HA   LYS  21           HA       LYS  21  -9.362   1.075  -0.182
  185   1HB   LYS  21          HB2       LYS  21 -11.609  -0.007   0.018
  186   2HB   LYS  21          HB1       LYS  21 -11.190   1.049   1.356
  187   1HG   LYS  21          HG2       LYS  21 -12.606   2.793   0.469
  188   2HG   LYS  21          HG1       LYS  21 -12.964   1.813  -0.953
  189   1HD   LYS  21          HD2       LYS  21 -14.606   0.762   0.120
  190   2HD   LYS  21          HD1       LYS  21 -13.520   0.318   1.438
  191   1HE   LYS  21          HE2       LYS  21 -15.376   1.608   2.300
  192   2HE   LYS  21          HE1       LYS  21 -13.882   2.533   2.451
  193   1HZ   LYS  21          HZ1       LYS  21 -14.576   4.064   0.970
  194   2HZ   LYS  21          HZ2       LYS  21 -16.114   3.534   1.434
  195   3HZ   LYS  21          HZ3       LYS  21 -15.412   2.947   0.012
  196    H    GLY  22           HN       GLY  22  -9.536  -0.460  -1.836
  197   1HA   GLY  22          HA2       GLY  22 -10.298  -1.278  -3.920
  198   2HA   GLY  22          HA1       GLY  22 -11.016   0.297  -4.246
  199    H    ASP  23           HN       ASP  23  -8.230   1.334  -3.216
  200    HA   ASP  23           HA       ASP  23  -7.160   1.775  -5.811
  201   1HB   ASP  23          HB2       ASP  23  -6.930   3.396  -3.957
  202   2HB   ASP  23          HB1       ASP  23  -5.878   2.263  -3.114
  203    H    ILE  24           HN       ILE  24  -5.226   1.039  -6.720
  204    HA   ILE  24           HA       ILE  24  -4.207  -1.475  -5.563
  205    HB   ILE  24           HB       ILE  24  -4.090  -0.721  -8.479
  206   1HG1  ILE  24          HG12      ILE  24  -6.436  -0.860  -7.856
  207   2HG1  ILE  24          HG11      ILE  24  -5.993  -2.283  -8.794
  208   1HG2  ILE  24          HG21      ILE  24  -3.153  -2.741  -8.849
  209   2HG2  ILE  24          HG22      ILE  24  -4.087  -3.527  -7.576
  210   3HG2  ILE  24          HG23      ILE  24  -2.660  -2.577  -7.163
  211   1HD1  ILE  24          HD11      ILE  24  -7.072  -2.100  -6.140
  212   2HD1  ILE  24          HD12      ILE  24  -5.556  -3.001  -6.141
  213   3HD1  ILE  24          HD13      ILE  24  -6.884  -3.508  -7.184
  214    H    VAL  25           HN       VAL  25  -2.072  -1.670  -5.188
  215    HA   VAL  25           HA       VAL  25  -0.240   0.305  -6.347
  216    HB   VAL  25           HB       VAL  25   0.898   0.592  -4.179
  217   1HG1  VAL  25          HG11      VAL  25  -0.516   2.368  -4.657
  218   2HG1  VAL  25          HG12      VAL  25  -1.055   1.864  -3.055
  219   3HG1  VAL  25          HG13      VAL  25  -1.971   1.386  -4.484
  220   1HG2  VAL  25          HG21      VAL  25   0.348  -0.499  -2.290
  221   2HG2  VAL  25          HG22      VAL  25  -0.412  -1.649  -3.390
  222   3HG2  VAL  25          HG23      VAL  25  -1.383  -0.397  -2.614
  223    H    TYR  26           HN       TYR  26   2.073  -0.311  -5.997
  224    HA   TYR  26           HA       TYR  26   2.354  -3.240  -6.120
  225   1HB   TYR  26          HB2       TYR  26   2.906  -1.761  -8.171
  226   2HB   TYR  26          HB1       TYR  26   4.344  -1.297  -7.267
  227    HD1  TYR  26           HD1      TYR  26   5.800  -3.281  -6.372
  228    HD2  TYR  26           HD2      TYR  26   2.986  -3.627  -9.544
  229    HE1  TYR  26           HE1      TYR  26   6.957  -5.298  -7.170
  230    HE2  TYR  26           HE2      TYR  26   4.135  -5.645 -10.351
  231    HH   TYR  26           HH       TYR  26   7.130  -6.486  -9.591
  232    H    ILE  27           HN       ILE  27   3.348  -4.141  -4.451
  233    HA   ILE  27           HA       ILE  27   4.794  -2.526  -2.548
  234    HB   ILE  27           HB       ILE  27   4.326  -5.511  -2.562
  235   1HG1  ILE  27          HG12      ILE  27   2.686  -4.804  -0.690
  236   2HG1  ILE  27          HG11      ILE  27   2.800  -3.195  -1.396
  237   1HG2  ILE  27          HG21      ILE  27   6.277  -4.667  -1.204
  238   2HG2  ILE  27          HG22      ILE  27   5.041  -5.545  -0.304
  239   3HG2  ILE  27          HG23      ILE  27   5.106  -3.785  -0.224
  240   1HD1  ILE  27          HD11      ILE  27   0.888  -4.779  -2.108
  241   2HD1  ILE  27          HD12      ILE  27   2.123  -5.535  -3.116
  242   3HD1  ILE  27          HD13      ILE  27   1.730  -3.829  -3.333
  243    H    HIS  28           HN       HIS  28   6.946  -2.533  -2.128
  244    HA   HIS  28           HA       HIS  28   8.649  -3.949  -4.068
  245   1HB   HIS  28          HB2       HIS  28   8.566  -1.302  -3.694
  246   2HB   HIS  28          HB1       HIS  28   9.726  -1.707  -2.434
  247    HD1  HIS  28           HD1      HIS  28   9.586  -0.828  -5.889
  248    HD2  HIS  28           HD2      HIS  28  11.955  -3.365  -3.605
  249    HE1  HIS  28           HE1      HIS  28  11.659  -1.225  -7.256
  250    HE2  HIS  28           HE2      HIS  28  13.038  -2.832  -5.892
  251    H    LYS  29           HN       LYS  29   9.042  -2.610  -0.787
  252    HA   LYS  29           HA       LYS  29  10.401  -5.113  -0.033
  253   1HB   LYS  29          HB2       LYS  29  11.605  -3.780   1.670
  254   2HB   LYS  29          HB1       LYS  29  11.941  -3.245   0.031
  255   1HG   LYS  29          HG2       LYS  29  11.606  -1.218   0.954
  256   2HG   LYS  29          HG1       LYS  29   9.917  -1.597   0.610
  257   1HD   LYS  29          HD2       LYS  29   9.763  -2.558   2.924
  258   2HD   LYS  29          HD1       LYS  29  11.374  -1.907   3.229
  259   1HE   LYS  29          HE2       LYS  29   9.860   0.192   2.127
  260   2HE   LYS  29          HE1       LYS  29   8.831  -0.586   3.330
  261   1HZ   LYS  29          HZ1       LYS  29  11.141  -0.434   4.653
  262   2HZ   LYS  29          HZ2       LYS  29   9.943   0.758   4.724
  263   3HZ   LYS  29          HZ3       LYS  29  11.265   0.950   3.687
  264    H    GLU  30           HN       GLU  30   9.849  -6.108   1.889
  265    HA   GLU  30           HA       GLU  30   7.349  -5.147   3.100
  266   1HB   GLU  30          HB2       GLU  30   8.538  -7.918   3.009
  267   2HB   GLU  30          HB1       GLU  30   7.062  -7.494   3.864
  268   1HG   GLU  30          HG2       GLU  30   6.757  -6.538   1.242
  269   2HG   GLU  30          HG1       GLU  30   7.435  -8.159   1.109
  270    H    VAL  31           HN       VAL  31   7.714  -3.999   4.853
  271    HA   VAL  31           HA       VAL  31   9.802  -4.879   6.719
  272    HB   VAL  31           HB       VAL  31   8.364  -2.398   7.338
  273   1HG1  VAL  31          HG11      VAL  31  10.129  -2.593   8.727
  274   2HG1  VAL  31          HG12      VAL  31  10.971  -1.781   7.408
  275   3HG1  VAL  31          HG13      VAL  31  11.071  -3.535   7.572
  276   1HG2  VAL  31          HG21      VAL  31   8.512  -2.222   4.880
  277   2HG2  VAL  31          HG22      VAL  31  10.255  -2.461   4.991
  278   3HG2  VAL  31          HG23      VAL  31   9.516  -1.027   5.701
  279    H    ASP  32           HN       ASP  32   8.823  -6.481   7.779
  280    HA   ASP  32           HA       ASP  32   6.167  -6.549   8.667
  281   1HB   ASP  32          HB2       ASP  32   7.732  -8.515   8.449
  282   2HB   ASP  32          HB1       ASP  32   8.483  -7.996   9.955
  283    H    LYS  33           HN       LYS  33   8.811  -4.753   9.862
  284    HA   LYS  33           HA       LYS  33   8.415  -4.686  12.592
  285   1HB   LYS  33          HB2       LYS  33   9.445  -2.750  10.587
  286   2HB   LYS  33          HB1       LYS  33   9.036  -2.110  12.173
  287   1HG   LYS  33          HG2       LYS  33  10.641  -4.559  12.235
  288   2HG   LYS  33          HG1       LYS  33  11.439  -3.172  11.491
  289   1HD   LYS  33          HD2       LYS  33  10.431  -1.963  13.648
  290   2HD   LYS  33          HD1       LYS  33  10.578  -3.598  14.296
  291   1HE   LYS  33          HE2       LYS  33  12.958  -3.595  13.501
  292   2HE   LYS  33          HE1       LYS  33  12.759  -1.885  13.120
  293   1HZ   LYS  33          HZ1       LYS  33  13.689  -2.689  15.430
  294   2HZ   LYS  33          HZ2       LYS  33  12.044  -2.767  15.814
  295   3HZ   LYS  33          HZ3       LYS  33  12.723  -1.306  15.301
  296    H    ASN  34           HN       ASN  34   6.864  -2.598  10.154
  297    HA   ASN  34           HA       ASN  34   4.298  -2.655  11.043
  298   1HB   ASN  34          HB2       ASN  34   4.103  -0.539  12.409
  299   2HB   ASN  34          HB1       ASN  34   4.867  -1.894  13.231
  300   1HD2  ASN  34          HD21      ASN  34   5.027   1.083  13.536
  301   2HD2  ASN  34          HD22      ASN  34   6.719   1.431  13.516
  302    H    TRP  35           HN       TRP  35   6.035  -1.992   8.701
  303    HA   TRP  35           HA       TRP  35   4.333   0.056   7.622
  304   1HB   TRP  35          HB2       TRP  35   6.728   0.894   8.809
  305   2HB   TRP  35          HB1       TRP  35   7.043   0.916   7.077
  306    HD1  TRP  35           HD1      TRP  35   3.537   1.737   8.335
  307    HE1  TRP  35           HE1      TRP  35   3.062   4.229   7.899
  308    HE3  TRP  35           HE3      TRP  35   8.202   3.205   6.845
  309    HZ2  TRP  35           HZ2      TRP  35   4.478   6.514   7.039
  310    HZ3  TRP  35           HZ3      TRP  35   8.558   5.561   6.232
  311    HH2  TRP  35           HH2      TRP  35   6.733   7.180   6.327
  312    H    LEU  36           HN       LEU  36   3.797  -0.759   5.702
  313    HA   LEU  36           HA       LEU  36   5.670  -2.442   4.253
  314   1HB   LEU  36          HB2       LEU  36   3.343  -3.160   4.658
  315   2HB   LEU  36          HB1       LEU  36   2.777  -1.780   3.734
  316    HG   LEU  36           HG       LEU  36   4.305  -2.823   1.860
  317   1HD1  LEU  36          HD11      LEU  36   4.655  -4.677   3.862
  318   2HD1  LEU  36          HD12      LEU  36   4.989  -4.928   2.147
  319   3HD1  LEU  36          HD13      LEU  36   3.439  -5.427   2.827
  320   1HD2  LEU  36          HD21      LEU  36   2.333  -3.215   0.884
  321   2HD2  LEU  36          HD22      LEU  36   1.612  -2.707   2.413
  322   3HD2  LEU  36          HD23      LEU  36   1.882  -4.421   2.091
  323    H    GLU  37           HN       GLU  37   6.154  -2.073   2.023
  324    HA   GLU  37           HA       GLU  37   6.074   0.768   1.302
  325   1HB   GLU  37          HB2       GLU  37   8.175  -0.970   1.305
  326   2HB   GLU  37          HB1       GLU  37   7.665  -1.056  -0.374
  327   1HG   GLU  37          HG2       GLU  37   7.746   1.479  -0.375
  328   2HG   GLU  37          HG1       GLU  37   8.591   1.346   1.166
  329    H    GLY  38           HN       GLY  38   5.142   1.503  -0.549
  330   1HA   GLY  38          HA2       GLY  38   4.135  -0.413  -2.508
  331   2HA   GLY  38          HA1       GLY  38   2.934   0.545  -1.655
  332    H    GLU  39           HN       GLU  39   3.819   0.427  -4.531
  333    HA   GLU  39           HA       GLU  39   4.008   3.320  -4.885
  334   1HB   GLU  39          HB2       GLU  39   5.657   2.798  -6.827
  335   2HB   GLU  39          HB1       GLU  39   6.269   2.891  -5.182
  336   1HG   GLU  39          HG2       GLU  39   6.439   0.548  -5.006
  337   2HG   GLU  39          HG1       GLU  39   5.481   0.294  -6.464
  338    H    HIS  40           HN       HIS  40   3.163   4.085  -6.848
  339    HA   HIS  40           HA       HIS  40   1.921   2.124  -8.628
  340   1HB   HIS  40          HB2       HIS  40   0.240   2.777  -6.900
  341   2HB   HIS  40          HB1       HIS  40   0.388   4.445  -7.442
  342    HD1  HIS  40           HD1      HIS  40   0.541   2.183 -10.269
  343    HD2  HIS  40           HD2      HIS  40  -2.463   3.974  -8.024
  344    HE1  HIS  40           HE1      HIS  40  -1.540   2.009 -11.670
  345    HE2  HIS  40           HE2      HIS  40  -3.362   3.019 -10.253
  346    H    HIS  41           HN       HIS  41   2.458   2.605 -10.641
  347    HA   HIS  41           HA       HIS  41   3.137   3.741 -12.490
  348   1HB   HIS  41          HB2       HIS  41   0.832   4.982 -11.554
  349   2HB   HIS  41          HB1       HIS  41   1.943   6.318 -11.843
  350    HD1  HIS  41           HD1      HIS  41   3.175   6.042 -14.368
  351    HD2  HIS  41           HD2      HIS  41  -0.576   4.359 -13.764
  352    HE1  HIS  41           HE1      HIS  41   2.205   5.721 -16.666
  353    HE2  HIS  41           HE2      HIS  41  -0.096   4.772 -16.272
  354    H    GLY  42           HN       GLY  42   4.941   3.762 -10.323
  355   1HA   GLY  42          HA2       GLY  42   7.064   4.707 -10.112
  356   2HA   GLY  42          HA1       GLY  42   6.530   6.070 -11.080
  357    H    ARG  43           HN       ARG  43   4.123   5.941  -8.990
  358    HA   ARG  43           HA       ARG  43   5.262   7.997  -7.312
  359   1HB   ARG  43          HB2       ARG  43   2.717   7.455  -8.300
  360   2HB   ARG  43          HB1       ARG  43   2.584   7.120  -6.579
  361   1HG   ARG  43          HG2       ARG  43   3.500   9.691  -7.848
  362   2HG   ARG  43          HG1       ARG  43   1.974   9.404  -7.010
  363   1HD   ARG  43          HD2       ARG  43   3.493   8.734  -5.015
  364   2HD   ARG  43          HD1       ARG  43   4.741   9.622  -5.889
  365    HE   ARG  43           HE       ARG  43   2.489  10.723  -4.483
  366   1HH1  ARG  43          HH11      ARG  43   4.829  11.272  -7.013
  367   2HH1  ARG  43          HH12      ARG  43   4.705  12.997  -6.925
  368   1HH2  ARG  43          HH21      ARG  43   2.325  12.992  -4.365
  369   2HH2  ARG  43          HH22      ARG  43   3.286  13.974  -5.420
  370    H    LEU  44           HN       LEU  44   5.460   7.930  -5.068
  371    HA   LEU  44           HA       LEU  44   5.729   5.229  -3.974
  372   1HB   LEU  44          HB2       LEU  44   6.911   7.889  -3.307
  373   2HB   LEU  44          HB1       LEU  44   6.823   6.663  -2.057
  374    HG   LEU  44           HG       LEU  44   7.925   5.329  -4.241
  375   1HD1  LEU  44          HD11      LEU  44   9.660   6.643  -5.112
  376   2HD1  LEU  44          HD12      LEU  44   9.411   7.917  -3.917
  377   3HD1  LEU  44          HD13      LEU  44   8.225   7.665  -5.199
  378   1HD2  LEU  44          HD21      LEU  44   8.686   4.796  -2.112
  379   2HD2  LEU  44          HD22      LEU  44   9.013   6.479  -1.699
  380   3HD2  LEU  44          HD23      LEU  44  10.065   5.629  -2.831
  381    H    GLY  45           HN       GLY  45   4.527   4.473  -2.329
  382   1HA   GLY  45          HA2       GLY  45   2.960   6.279  -0.677
  383   2HA   GLY  45          HA1       GLY  45   2.033   5.216  -1.721
  384    H    ILE  46           HN       ILE  46   3.265   5.550   1.312
  385    HA   ILE  46           HA       ILE  46   3.405   2.639   1.726
  386    HB   ILE  46           HB       ILE  46   4.707   4.882   3.266
  387   1HG1  ILE  46          HG12      ILE  46   5.789   2.670   1.517
  388   2HG1  ILE  46          HG11      ILE  46   5.798   4.393   1.164
  389   1HG2  ILE  46          HG21      ILE  46   4.816   3.547   5.035
  390   2HG2  ILE  46          HG22      ILE  46   5.760   2.406   4.079
  391   3HG2  ILE  46          HG23      ILE  46   4.009   2.251   4.157
  392   1HD1  ILE  46          HD11      ILE  46   7.535   2.807   2.946
  393   2HD1  ILE  46          HD12      ILE  46   7.154   4.461   3.429
  394   3HD1  ILE  46          HD13      ILE  46   7.923   4.152   1.872
  395    H    PHE  47           HN       PHE  47   2.348   1.721   3.475
  396    HA   PHE  47           HA       PHE  47   0.784   3.298   5.301
  397   1HB   PHE  47          HB2       PHE  47  -1.359   2.031   4.578
  398   2HB   PHE  47          HB1       PHE  47  -0.855   3.431   3.638
  399    HD1  PHE  47           HD1      PHE  47  -0.257  -0.254   3.710
  400    HD2  PHE  47           HD2      PHE  47  -0.934   3.228   1.359
  401    HE1  PHE  47           HE1      PHE  47  -0.251  -1.633   1.672
  402    HE2  PHE  47           HE2      PHE  47  -0.931   1.856  -0.682
  403    HZ   PHE  47           HZ       PHE  47  -0.590  -0.579  -0.527
  404    HA   PRO  48           HA       PRO  48   1.292  -0.156   7.972
  405   1HB   PRO  48          HB2       PRO  48  -1.272  -0.514   8.970
  406   2HB   PRO  48          HB1       PRO  48  -0.094   0.649   9.585
  407   1HG   PRO  48          HG2       PRO  48  -2.369   1.071   7.694
  408   2HG   PRO  48          HG1       PRO  48  -1.787   2.117   9.003
  409   1HD   PRO  48          HD2       PRO  48  -1.223   2.652   6.441
  410   2HD   PRO  48          HD1       PRO  48  -0.033   2.948   7.726
  411    H    ALA  49           HN       ALA  49   1.445  -2.273   7.625
  412    HA   ALA  49           HA       ALA  49   0.158  -3.522   5.435
  413   1HB   ALA  49          HB1       ALA  49   1.354  -5.260   7.491
  414   2HB   ALA  49          HB2       ALA  49   2.416  -4.029   6.806
  415   3HB   ALA  49          HB3       ALA  49   1.627  -5.201   5.750
  416    H    ASN  50           HN       ASN  50  -0.881  -2.981   8.624
  417    HA   ASN  50           HA       ASN  50  -2.604  -5.317   8.726
  418   1HB   ASN  50          HB2       ASN  50  -1.587  -3.369  10.628
  419   2HB   ASN  50          HB1       ASN  50  -3.316  -3.637  10.830
  420   1HD2  ASN  50          HD21      ASN  50  -2.650  -4.523  12.898
  421   2HD2  ASN  50          HD22      ASN  50  -2.145  -6.173  12.982
  422    H    TYR  51           HN       TYR  51  -2.881  -2.841   6.830
  423    HA   TYR  51           HA       TYR  51  -5.780  -2.603   7.231
  424   1HB   TYR  51          HB2       TYR  51  -3.770  -0.425   7.019
  425   2HB   TYR  51          HB1       TYR  51  -5.293  -0.193   6.167
  426    HD1  TYR  51           HD1      TYR  51  -7.416  -0.108   7.431
  427    HD2  TYR  51           HD2      TYR  51  -3.655  -0.330   9.407
  428    HE1  TYR  51           HE1      TYR  51  -8.482   0.613   9.527
  429    HE2  TYR  51           HE2      TYR  51  -4.710   0.389  11.509
  430    HH   TYR  51           HH       TYR  51  -6.662   1.539  12.292
  431    H    VAL  52           HN       VAL  52  -4.177  -4.294   5.466
  432    HA   VAL  52           HA       VAL  52  -5.547  -3.662   3.001
  433    HB   VAL  52           HB       VAL  52  -2.833  -4.301   2.256
  434   1HG1  VAL  52          HG11      VAL  52  -3.150  -2.167   0.929
  435   2HG1  VAL  52          HG12      VAL  52  -4.757  -2.075   1.649
  436   3HG1  VAL  52          HG13      VAL  52  -4.320  -3.455   0.641
  437   1HG2  VAL  52          HG21      VAL  52  -3.112  -1.644   3.647
  438   2HG2  VAL  52          HG22      VAL  52  -1.664  -2.340   2.918
  439   3HG2  VAL  52          HG23      VAL  52  -2.345  -3.055   4.379
  440    H    GLU  53           HN       GLU  53  -5.484  -5.414   1.456
  441    HA   GLU  53           HA       GLU  53  -4.831  -7.995   2.720
  442   1HB   GLU  53          HB2       GLU  53  -7.190  -7.060   1.199
  443   2HB   GLU  53          HB1       GLU  53  -6.622  -8.676   0.803
  444   1HG   GLU  53          HG2       GLU  53  -7.228  -9.535   2.805
  445   2HG   GLU  53          HG1       GLU  53  -6.909  -8.033   3.672
  446    H    VAL  54           HN       VAL  54  -3.218  -9.059   1.790
  447    HA   VAL  54           HA       VAL  54  -2.041  -8.187  -0.646
  448    HB   VAL  54           HB       VAL  54  -0.705  -9.206   1.145
  449   1HG1  VAL  54          HG11      VAL  54  -1.630 -11.933   0.408
  450   2HG1  VAL  54          HG12      VAL  54  -2.623 -10.982   1.512
  451   3HG1  VAL  54          HG13      VAL  54  -0.946 -11.340   1.922
  452   1HG2  VAL  54          HG21      VAL  54   0.599 -10.790  -0.290
  453   2HG2  VAL  54          HG22      VAL  54   0.263  -9.227  -1.036
  454   3HG2  VAL  54          HG23      VAL  54  -0.675 -10.646  -1.501
  455    H    LEU  55           HN       LEU  55  -2.646  -8.665  -2.649
  456    HA   LEU  55           HA       LEU  55  -3.272 -11.246  -3.559
  457   1HB   LEU  55          HB2       LEU  55  -5.667 -10.893  -4.123
  458   2HB   LEU  55          HB1       LEU  55  -5.353 -11.045  -2.405
  459    HG   LEU  55           HG       LEU  55  -5.248  -8.281  -3.008
  460   1HD1  LEU  55          HD11      LEU  55  -6.541  -9.091  -5.071
  461   2HD1  LEU  55          HD12      LEU  55  -7.229  -7.774  -4.120
  462   3HD1  LEU  55          HD13      LEU  55  -7.860  -9.411  -3.944
  463   1HD2  LEU  55          HD21      LEU  55  -7.515  -9.768  -1.703
  464   2HD2  LEU  55          HD22      LEU  55  -6.964  -8.122  -1.389
  465   3HD2  LEU  55          HD23      LEU  55  -5.964  -9.493  -0.910
  466    HA   PRO  56           HA       PRO  56  -1.847  -8.196  -6.737
  467   1HB   PRO  56          HB2       PRO  56  -0.899 -10.777  -7.867
  468   2HB   PRO  56          HB1       PRO  56  -0.041  -9.242  -7.691
  469   1HG   PRO  56          HG2       PRO  56   0.496 -11.293  -6.078
  470   2HG   PRO  56          HG1       PRO  56   0.466  -9.630  -5.460
  471   1HD   PRO  56          HD2       PRO  56  -1.575 -11.796  -5.181
  472   2HD   PRO  56          HD1       PRO  56  -1.060 -10.573  -4.002
  473    H    LEU  57           HN       LEU  57  -2.962  -7.639  -8.515
  474    HA   LEU  57           HA       LEU  57  -5.204  -9.266  -9.319
  475   1HB   LEU  57          HB2       LEU  57  -4.199  -6.541 -10.074
  476   2HB   LEU  57          HB1       LEU  57  -5.473  -7.314 -10.999
  477    HG   LEU  57           HG       LEU  57  -6.489  -7.578  -8.511
  478   1HD1  LEU  57          HD11      LEU  57  -4.341  -6.065  -7.933
  479   2HD1  LEU  57          HD12      LEU  57  -5.855  -6.002  -7.031
  480   3HD1  LEU  57          HD13      LEU  57  -5.524  -4.805  -8.283
  481   1HD2  LEU  57          HD21      LEU  57  -6.936  -4.941  -9.778
  482   2HD2  LEU  57          HD22      LEU  57  -8.097  -6.155  -9.240
  483   3HD2  LEU  57          HD23      LEU  57  -7.241  -6.369 -10.767
  484    H    GLU  58           HN       GLU  58  -5.603  -9.172 -11.864
  485    HA   GLU  58           HA       GLU  58  -3.172  -9.843 -13.330
  486   1HB   GLU  58          HB2       GLU  58  -5.511 -11.744 -13.340
  487   2HB   GLU  58          HB1       GLU  58  -3.910 -11.995 -14.021
  488   1HG   GLU  58          HG2       GLU  58  -3.010 -11.892 -11.681
  489   2HG   GLU  58          HG1       GLU  58  -4.680 -11.915 -11.118