*HEADER    PROTEIN/RNA                             12-APR-99   1QFQ              
*TITLE     BACTERIOPHAGE LAMBDA N-PROTEIN-NUTBOXB-RNA COMPLEX                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: N-PROTEIN NUTBOXB;                                         
*COMPND   3 CHAIN: B;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL BINDING-DOMAIN, RESIDUES 2-36;                  
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 BIOLOGICAL_UNIT: MONOMER;                                            
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: RNA                                                        
*COMPND   9 (5'-R(P*GP*CP*CP*CP*UP*GP*AP*AP*AP*AP*AP*GP*GP*GP*C)-3');            
*COMPND  10 CHAIN: A;                                                            
*COMPND  11 FRAGMENT: BACTERIOPHAGE LAMBDA NUTBOXB-RNA;                          
*COMPND  12 ENGINEERED: YES;                                                     
*COMPND  13 BIOLOGICAL_UNIT: MONOMER;                                            
*COMPND  14 OTHER_DETAILS: NUTBOXB-RNA FROM THE NUTR-SEQUENCE                    
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE LAMBDA;                           
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   4 MOL_ID: 2;                                                           
*SOURCE   5 SYNTHETIC: YES;                                                      
*SOURCE   6 OTHER_DETAILS: SEQUENCE FROM BACTERIOPHAGE LAMBDA. RNA WAS           
*SOURCE   7 UNIFORMLY LABELLED WITH (13)C AND ( 15)N                             
*KEYWDS    BACTERIOPHAGE LAMBDA, ANTITERMINATION, PEPTIDE-RNA-COMPLEX,           
*KEYWDS   2 N-NUT, GNRA-TETRALOOP, BENT-ALPHA-HELIX,                             
*KEYWDS   3 PEPTIDE-RNA-RECOGNITION, PROTEIN/RNA                                 
*EXPDTA    NMR, 29 STRUCTURES                                                    
*AUTHOR    M.SCHAERPF,H.STICHT,P.ROESCH                                          
*REVDAT   1   20-APR-99 1QFQ    0                                                
!RNA intraresidual NOEs

assign (resid 1 and name H1') (resid 1 and name H2')  0.0 0.0 3.0
assign (resid 1 and name H1') (resid 1 and name H3')  0.0 0.0 4.0
assign (resid 1 and name H1') (resid 1 and name H4')  0.0 0.0 4.0
assign (resid 1 and name H1') (resid 1 and name H5')  0.0 0.0 5.0
assign (resid 1 and name H2') (resid 1 and name H4')  0.0 0.0 4.0
assign (resid 1 and name H2') (resid 1 and name H5')  0.0 0.0 5.0
assign (resid 1 and name H3') (resid 1 and name H2')  0.0 0.0 3.0
assign (resid 1 and name H3') (resid 1 and name H4')  0.0 0.0 4.0
assign (resid 1 and name H8) (resid 1 and name H1')  0.0 0.0 4.0
assign (resid 1 and name H8) (resid 1 and name H2')  0.0 0.0 4.0
assign (resid 1 and name H8) (resid 1 and name H3')  0.0 0.0 3.0
assign (resid 1 and name H8) (resid 1 and name H4')  0.0 0.0 5.0
assign (resid 10 and name H1') (resid 10 and name H2')  2.0 0.0 3.0
assign (resid 10 and name H1') (resid 10 and name H3')  2.0 0.0 4.0
assign (resid 10 and name H1') (resid 10 and name H4')  2.0 0.0 4.0
assign (resid 10 and name H1') (resid 10 and name H5'')  2.0 0.0 5.0
assign (resid 10 and name H1') (resid 10 and name H5')  2.0 0.0 5.0
assign (resid 10 and name H2') (resid 10 and name H3')  0.0 0.0 3.0
assign (resid 10 and name H2') (resid 10 and name H4')  0.0 0.0 5.0
assign (resid 10 and name H2') (resid 10 and name H5'')  0.0 0.0 5.0
assign (resid 10 and name H2') (resid 10 and name H5')  0.0 0.0 5.0
assign (resid 10 and name H2) (resid 10 and name H1')  0.0 0.0 5.0
assign (resid 10 and name H2) (resid 10 and name H3')  0.0 0.0 7.0
assign (resid 10 and name H4') (resid 10 and name H3')  0.0 0.0 3.0
assign (resid 10 and name H4') (resid 10 and name H5'')  0.0 0.0 3.0
assign (resid 10 and name H4') (resid 10 and name H5')  0.0 0.0 4.0
assign (resid 10 and name H5'') (resid 10 and name H3')  0.0 0.0 3.0
assign (resid 10 and name H5'') (resid 10 and name H5')  0.0 0.0 3.0
assign (resid 10 and name H5') (resid 10 and name H3')  0.0 0.0 3.0
assign (resid 10 and name H8) (resid 10 and name H1')  0.0 0.0 4.0
assign (resid 10 and name H8) (resid 10 and name H2')  0.0 0.0 5.0
assign (resid 10 and name H8) (resid 10 and name H3')  0.0 0.0 4.0
assign (resid 10 and name H8) (resid 10 and name H4')  0.0 0.0 5.0
assign (resid 10 and name H8) (resid 10 and name H5'')  0.0 0.0 3.0
assign (resid 10 and name H8) (resid 10 and name H5')  0.0 0.0 4.0
assign (resid 11 and name H1') (resid 11 and name H2')  0.0 0.0 3.0
assign (resid 11 and name H1') (resid 11 and name H3')  0.0 0.0 4.0
assign (resid 11 and name H1') (resid 11 and name H4')  0.0 0.0 4.0
assign (resid 11 and name H1') (resid 11 and name H5'')  0.0 0.0 6.0
assign (resid 11 and name H1') (resid 11 and name H5')  0.0 0.0 5.0
assign (resid 11 and name H2') (resid 11 and name H3')  0.0 0.0 3.0
assign (resid 11 and name H2) (resid 11 and name H1')  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 11 and name H2')  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 11 and name H61)  0.0 0.0 5.0
assign (resid 11 and name H3') (resid 11 and name H4')  0.0 0.0 3.0
assign (resid 11 and name H3') (resid 11 and name H5')  0.0 0.0 4.0
assign (resid 11 and name H4') (resid 11 and name H2')  0.0 0.0 4.0
assign (resid 11 and name H4') (resid 11 and name H5')  0.0 0.0 3.0
assign (resid 11 and name H4') (resid 11 and name H8)  0.0 0.0 5.0
assign (resid 11 and name H5'') (resid 11 and name H3')  0.0 0.0 3.0
assign (resid 11 and name H5'') (resid 11 and name H4')  0.0 0.0 3.0
assign (resid 11 and name H5'') (resid 11 and name H5')  0.0 0.0 3.0
assign (resid 11 and name H62) (resid 11 and name H61)  0.0 0.0 3.0
assign (resid 11 and name H8) (resid 11 and name H1')  0.0 0.0 4.0
assign (resid 11 and name H8) (resid 11 and name H2')  0.0 0.0 4.0
assign (resid 11 and name H8) (resid 11 and name H3')  0.0 0.0 3.0
assign (resid 11 and name H8) (resid 11 and name H5')  0.0 0.0 4.0
assign (resid 12 and name H1') (resid 12 and name H2')  0.0 0.0 3.0
assign (resid 12 and name H1') (resid 12 and name H3')  0.0 0.0 4.0
assign (resid 12 and name H1') (resid 12 and name H4')  0.0 0.0 4.0
assign (resid 12 and name H1') (resid 12 and name H5'')  0.0 0.0 5.0
assign (resid 12 and name H1') (resid 12 and name H5')  0.0 0.0 5.0
assign (resid 12 and name H1) (resid 12 and name H21)  0.0 0.0 3.0
assign (resid 12 and name H1) (resid 12 and name H22)  0.0 0.0 4.0
assign (resid 12 and name H2') (resid 12 and name H22)  0.0 0.0 5.0
assign (resid 12 and name H2') (resid 12 and name H3')  0.0 0.0 3.0
assign (resid 12 and name H2') (resid 12 and name H4')  0.0 0.0 4.0
assign (resid 12 and name H4') (resid 12 and name H3')  0.0 0.0 3.0
assign (resid 12 and name H4') (resid 12 and name H5'')  0.0 0.0 3.0
assign (resid 12 and name H4') (resid 12 and name H5')  0.0 0.0 3.0
assign (resid 12 and name H5'') (resid 12 and name H2')  0.0 0.0 5.0
assign (resid 12 and name H5'') (resid 12 and name H3')  0.0 0.0 3.0
assign (resid 12 and name H5'') (resid 12 and name H5')  0.0 0.0 3.0
assign (resid 12 and name H5') (resid 12 and name H2')  0.0 0.0 5.0
assign (resid 12 and name H5') (resid 12 and name H3')  0.0 0.0 3.0
assign (resid 12 and name H8) (resid 12 and name H1')  0.0 0.0 4.0
assign (resid 12 and name H8) (resid 12 and name H2')  0.0 0.0 5.0
assign (resid 12 and name H8) (resid 12 and name H3')  0.0 0.0 4.0
assign (resid 12 and name H8) (resid 12 and name H4')  0.0 0.0 5.0
assign (resid 12 and name H8) (resid 12 and name H5'')  0.0 0.0 4.0
assign (resid 12 and name H8) (resid 12 and name H5')  0.0 0.0 4.0
assign (resid 13 and name H1') (resid 13 and name H2')  0.0 0.0 3.0
assign (resid 13 and name H1') (resid 13 and name H21)  0.0 0.0 6.0
assign (resid 13 and name H1') (resid 13 and name H22)  0.0 0.0 5.0
assign (resid 13 and name H1') (resid 13 and name H3')  0.0 0.0 4.0
assign (resid 13 and name H1') (resid 13 and name H4')  0.0 0.0 4.0
assign (resid 13 and name H1') (resid 13 and name H5'')  0.0 0.0 6.0
assign (resid 13 and name H1') (resid 13 and name H5')  0.0 0.0 5.0
assign (resid 13 and name H1) (resid 13 and name H1')  0.0 0.0 6.0
assign (resid 13 and name H1) (resid 13 and name H21)  0.0 0.0 4.0
assign (resid 13 and name H1) (resid 13 and name H22)  0.0 0.0 4.0
assign (resid 13 and name H3') (resid 13 and name H2')  0.0 0.0 3.0
assign (resid 13 and name H3') (resid 13 and name H4')  0.0 0.0 4.0
assign (resid 13 and name H4') (resid 13 and name H2')  0.0 0.0 4.0
assign (resid 13 and name H5'') (resid 13 and name H2')  0.0 0.0 5.0
assign (resid 13 and name H5'') (resid 13 and name H3')  0.0 0.0 3.0
assign (resid 13 and name H5'') (resid 13 and name H4')  0.0 0.0 3.0
assign (resid 13 and name H5') (resid 13 and name H2')  0.0 0.0 5.0
assign (resid 13 and name H5') (resid 13 and name H3')  0.0 0.0 4.0
assign (resid 13 and name H5') (resid 13 and name H4')  0.0 0.0 3.0
assign (resid 13 and name H5') (resid 13 and name H5'')  0.0 0.0 3.0
assign (resid 13 and name H5') (resid 13 and name H8)  0.0 0.0 4.0
assign (resid 13 and name H8) (resid 13 and name H1')  0.0 0.0 4.0
assign (resid 13 and name H8) (resid 13 and name H2')  0.0 0.0 4.0
assign (resid 13 and name H8) (resid 13 and name H3')  0.0 0.0 4.0
assign (resid 13 and name H8) (resid 13 and name H4')  0.0 0.0 5.0
assign (resid 13 and name H8) (resid 13 and name H5'')  0.0 0.0 5.0
assign (resid 14 and name H1') (resid 14 and name H1)  0.0 0.0 6.0
assign (resid 14 and name H1') (resid 14 and name H2')  0.0 0.0 3.0
assign (resid 14 and name H1') (resid 14 and name H3')  0.0 0.0 4.0
assign (resid 14 and name H2') (resid 14 and name H3')  0.0 0.0 3.0
assign (resid 14 and name H3') (resid 14 and name H5'')  0.0 0.0 4.0
assign (resid 14 and name H3') (resid 14 and name H5')  0.0 0.0 4.0
assign (resid 14 and name H4') (resid 14 and name H1')  0.0 0.0 4.0
assign (resid 14 and name H4') (resid 14 and name H2')  0.0 0.0 4.0
assign (resid 14 and name H4') (resid 14 and name H3')  0.0 0.0 3.0
assign (resid 14 and name H4') (resid 14 and name H5'')  0.0 0.0 3.0
assign (resid 14 and name H4') (resid 14 and name H5')  0.0 0.0 3.0
assign (resid 14 and name H4') (resid 14 and name H8)  0.0 0.0 5.0
assign (resid 14 and name H5') (resid 14 and name H1')  0.0 0.0 5.0
assign (resid 14 and name H5') (resid 14 and name H5'')  0.0 0.0 3.0
assign (resid 14 and name H8) (resid 14 and name H1')  0.0 0.0 4.0
assign (resid 14 and name H8) (resid 14 and name H2')  0.0 0.0 4.0
assign (resid 14 and name H8) (resid 14 and name H3')  0.0 0.0 4.0
assign (resid 14 and name H8) (resid 14 and name H5'')  0.0 0.0 5.0
assign (resid 14 and name H8) (resid 14 and name H5')  0.0 0.0 4.0
assign (resid 15 and name H1') (resid 15 and name H2')  0.0 0.0 3.0
assign (resid 15 and name H1') (resid 15 and name H3')  0.0 0.0 4.0
assign (resid 15 and name H1') (resid 15 and name H4')  0.0 0.0 3.0
assign (resid 15 and name H1') (resid 15 and name H5'')  0.0 0.0 6.0
assign (resid 15 and name H1') (resid 15 and name H5)  0.0 0.0 6.0
assign (resid 15 and name H2') (resid 15 and name H5'')  0.0 0.0 5.0
assign (resid 15 and name H3') (resid 15 and name H2')  0.0 0.0 3.0
assign (resid 15 and name H3') (resid 15 and name H5'')  0.0 0.0 3.0
assign (resid 15 and name H3') (resid 15 and name H5')  0.0 0.0 4.0
assign (resid 15 and name H4') (resid 15 and name H2')  0.0 0.0 4.0
assign (resid 15 and name H4') (resid 15 and name H3')  0.0 0.0 3.0
assign (resid 15 and name H4') (resid 15 and name H5')  0.0 0.0 3.0
assign (resid 15 and name H41) (resid 15 and name H42)  0.0 0.0 3.0
assign (resid 15 and name H41) (resid 15 and name H5)  0.0 0.0 4.0
assign (resid 15 and name H41) (resid 15 and name H6)  0.0 0.0 6.0
assign (resid 15 and name H42) (resid 15 and name H2')  0.0 0.0 6.0
assign (resid 15 and name H42) (resid 15 and name H5)  0.0 0.0 3.0
assign (resid 15 and name H5'') (resid 15 and name H4')  0.0 0.0 3.0
assign (resid 15 and name H5'') (resid 15 and name H5')  0.0 0.0 3.0
assign (resid 15 and name H5') (resid 15 and name H1')  0.0 0.0 5.0
assign (resid 15 and name H5) (resid 15 and name H2')  0.0 0.0 5.0
assign (resid 15 and name H5) (resid 15 and name H3')  0.0 0.0 6.0
assign (resid 15 and name H6) (resid 15 and name H1')  0.0 0.0 4.0
assign (resid 15 and name H6) (resid 15 and name H2')  0.0 0.0 4.0
assign (resid 15 and name H6) (resid 15 and name H3')  0.0 0.0 3.0
assign (resid 15 and name H6) (resid 15 and name H4')  0.0 0.0 5.0
assign (resid 15 and name H6) (resid 15 and name H42)  0.0 0.0 5.0
assign (resid 15 and name H6) (resid 15 and name H5'')  0.0 0.0 5.0
assign (resid 15 and name H6) (resid 15 and name H5')  0.0 0.0 5.0
assign (resid 15 and name H6) (resid 15 and name H5)  0.0 0.0 3.0
assign (resid 2 and name H1') (resid 2 and name H2')  2.0 0.0 3.0
assign (resid 2 and name H1') (resid 2 and name H3')  2.0 0.0 4.0
assign (resid 2 and name H1') (resid 2 and name H4')  2.0 0.0 4.0
assign (resid 2 and name H1') (resid 2 and name H5'')  2.0 0.0 6.0
assign (resid 2 and name H1') (resid 2 and name H5')  2.0 0.0 5.0
assign (resid 2 and name H1') (resid 2 and name H5)  2.0 0.0 6.0
assign (resid 2 and name H2') (resid 2 and name H3')  0.0 0.0 3.0
assign (resid 2 and name H2') (resid 2 and name H4')  0.0 0.0 4.0
assign (resid 2 and name H2') (resid 2 and name H5')  0.0 0.0 6.0
assign (resid 2 and name H2') (resid 2 and name H5)  0.0 0.0 5.0
assign (resid 2 and name H3') (resid 2 and name H5')  0.0 0.0 4.0
assign (resid 2 and name H4') (resid 2 and name H3')  0.0 0.0 4.0
assign (resid 2 and name H4') (resid 2 and name H5')  0.0 0.0 3.0
assign (resid 2 and name H41) (resid 2 and name H42)  0.0 0.0 3.0
assign (resid 2 and name H41) (resid 2 and name H5)  0.0 0.0 4.0
assign (resid 2 and name H42) (resid 2 and name H5)  0.0 0.0 3.0
assign (resid 2 and name H5'') (resid 2 and name H3')  0.0 0.0 3.0
assign (resid 2 and name H5'') (resid 2 and name H4')  0.0 0.0 3.0
assign (resid 2 and name H5'') (resid 2 and name H5')  0.0 0.0 3.0
assign (resid 2 and name H5) (resid 2 and name H3')  0.0 0.0 5.0
assign (resid 2 and name H5) (resid 2 and name H4')  0.0 0.0 7.0
assign (resid 2 and name H5) (resid 2 and name H5'')  0.0 0.0 7.0
assign (resid 2 and name H6) (resid 2 and name H1')  0.0 0.0 4.0
assign (resid 2 and name H6) (resid 2 and name H2')  0.0 0.0 4.0
assign (resid 2 and name H6) (resid 2 and name H3')  0.0 0.0 3.0
assign (resid 2 and name H6) (resid 2 and name H4')  0.0 0.0 5.0
assign (resid 2 and name H6) (resid 2 and name H42)  0.0 0.0 5.0
assign (resid 2 and name H6) (resid 2 and name H5'')  0.0 0.0 5.0
assign (resid 2 and name H6) (resid 2 and name H5')  0.0 0.0 4.0
assign (resid 2 and name H6) (resid 2 and name H5)  0.0 0.0 3.0
assign (resid 3 and name H1') (resid 3 and name H2')  0.0 0.0 3.0
assign (resid 3 and name H1') (resid 3 and name H3')  0.0 0.0 4.0
assign (resid 3 and name H1') (resid 3 and name H4')  0.0 0.0 4.0
assign (resid 3 and name H1') (resid 3 and name H5'')  0.0 0.0 5.0
assign (resid 3 and name H1') (resid 3 and name H5')  0.0 0.0 6.0
assign (resid 3 and name H2') (resid 3 and name H3')  0.0 0.0 3.0
assign (resid 3 and name H2') (resid 3 and name H5'')  0.0 0.0 5.0
assign (resid 3 and name H2') (resid 3 and name H5')  0.0 0.0 5.0
assign (resid 3 and name H3') (resid 3 and name H4')  0.0 0.0 3.0
assign (resid 3 and name H3') (resid 3 and name H5'')  0.0 0.0 3.0
assign (resid 3 and name H3') (resid 3 and name H5')  0.0 0.0 4.0
assign (resid 3 and name H4') (resid 3 and name H2')  0.0 0.0 4.0
assign (resid 3 and name H4') (resid 3 and name H5'')  0.0 0.0 3.0
assign (resid 3 and name H4') (resid 3 and name H5')  0.0 0.0 3.0
assign (resid 3 and name H41) (resid 3 and name H1')  0.0 0.0 7.0
assign (resid 3 and name H41) (resid 3 and name H42)  0.0 0.0 3.0
assign (resid 3 and name H41) (resid 3 and name H5)  0.0 0.0 4.0
assign (resid 3 and name H41) (resid 3 and name H6)  0.0 0.0 6.0
assign (resid 3 and name H42) (resid 3 and name H1')  0.0 0.0 7.0
assign (resid 3 and name H42) (resid 3 and name H5'')  0.0 0.0 7.0
assign (resid 3 and name H42) (resid 3 and name H5)  0.0 0.0 5.0
assign (resid 3 and name H5') (resid 3 and name H5'')  0.0 0.0 3.0
assign (resid 3 and name H5) (resid 3 and name H2')  0.0 0.0 6.0
assign (resid 3 and name H5) (resid 3 and name H3')  0.0 0.0 6.0
assign (resid 3 and name H5) (resid 3 and name H5'')  0.0 0.0 5.0
assign (resid 3 and name H5) (resid 3 and name H5')  0.0 0.0 7.0
assign (resid 3 and name H6) (resid 3 and name H1')  0.0 0.0 4.0
assign (resid 3 and name H6) (resid 3 and name H2')  0.0 0.0 4.0
assign (resid 3 and name H6) (resid 3 and name H3')  0.0 0.0 4.0
assign (resid 3 and name H6) (resid 3 and name H4')  0.0 0.0 4.0
assign (resid 3 and name H6) (resid 3 and name H5'')  0.0 0.0 3.0
assign (resid 3 and name H6) (resid 3 and name H5')  0.0 0.0 4.0
assign (resid 3 and name H6) (resid 3 and name H5)  0.0 0.0 3.0
assign (resid 4 and name H1') (resid 4 and name H2')  0.0 0.0 3.0
assign (resid 4 and name H1') (resid 4 and name H3')  0.0 0.0 4.0
assign (resid 4 and name H1') (resid 4 and name H4')  0.0 0.0 4.0
assign (resid 4 and name H1') (resid 4 and name H41)  0.0 0.0 7.0
assign (resid 4 and name H1') (resid 4 and name H5'')  0.0 0.0 6.0
assign (resid 4 and name H1') (resid 4 and name H5')  0.0 0.0 5.0
assign (resid 4 and name H3') (resid 4 and name H2')  0.0 0.0 3.0
assign (resid 4 and name H3') (resid 4 and name H5'')  0.0 0.0 3.0
assign (resid 4 and name H3') (resid 4 and name H5')  0.0 0.0 4.0
assign (resid 4 and name H3') (resid 4 and name H5)  0.0 0.0 5.0
assign (resid 4 and name H4') (resid 4 and name H2')  0.0 0.0 4.0
assign (resid 4 and name H4') (resid 4 and name H3')  0.0 0.0 3.0
assign (resid 4 and name H4') (resid 4 and name H5'')  0.0 0.0 3.0
assign (resid 4 and name H41) (resid 4 and name H42)  0.0 0.0 3.0
assign (resid 4 and name H41) (resid 4 and name H5)  0.0 0.0 4.0
assign (resid 4 and name H41) (resid 4 and name H6)  0.0 0.0 5.0
assign (resid 4 and name H42) (resid 4 and name H5)  0.0 0.0 3.0
assign (resid 4 and name H5) (resid 4 and name H1')  0.0 0.0 6.0
assign (resid 4 and name H5) (resid 4 and name H2')  0.0 0.0 5.0
assign (resid 4 and name H6) (resid 4 and name H1')  0.0 0.0 4.0
assign (resid 4 and name H6) (resid 4 and name H2')  0.0 0.0 4.0
assign (resid 4 and name H6) (resid 4 and name H3')  0.0 0.0 3.0
assign (resid 4 and name H6) (resid 4 and name H4')  0.0 0.0 5.0
assign (resid 4 and name H6) (resid 4 and name H42)  0.0 0.0 5.0
assign (resid 4 and name H6) (resid 4 and name H5'')  0.0 0.0 5.0
assign (resid 4 and name H6) (resid 4 and name H5')  0.0 0.0 4.0
assign (resid 4 and name H6) (resid 4 and name H5)  0.0 0.0 3.0
assign (resid 5 and name H1') (resid 5 and name H2')  0.0 0.0 3.0
assign (resid 5 and name H1') (resid 5 and name H3')  0.0 0.0 4.0
assign (resid 5 and name H1') (resid 5 and name H4')  0.0 0.0 3.0
assign (resid 5 and name H1') (resid 5 and name H5'')  0.0 0.0 5.0
assign (resid 5 and name H1') (resid 5 and name H5')  0.0 0.0 5.0
assign (resid 5 and name H2') (resid 5 and name H3')  0.0 0.0 3.0
assign (resid 5 and name H2') (resid 5 and name H3')  0.0 0.0 3.0
assign (resid 5 and name H2') (resid 5 and name H5'')  0.0 0.0 5.0
assign (resid 5 and name H3') (resid 5 and name H5'')  0.0 0.0 3.0
assign (resid 5 and name H3) (resid 5 and name H1')  0.0 0.0 6.0
assign (resid 5 and name H3) (resid 5 and name H2')  0.0 0.0 6.0
assign (resid 5 and name H3) (resid 5 and name H5)  0.0 0.0 5.0
assign (resid 5 and name H3) (resid 5 and name H6)  0.0 0.0 6.0
assign (resid 5 and name H4') (resid 5 and name H2')  0.0 0.0 4.0
assign (resid 5 and name H4') (resid 5 and name H5'')  0.0 0.0 3.0
assign (resid 5 and name H5') (resid 5 and name H3')  0.0 0.0 4.0
assign (resid 5 and name H5') (resid 5 and name H4')  0.0 0.0 3.0
assign (resid 5 and name H5') (resid 5 and name H5'')  0.0 0.0 3.0
assign (resid 5 and name H6) (resid 5 and name H1')  0.0 0.0 4.0
assign (resid 5 and name H6) (resid 5 and name H2')  0.0 0.0 4.0
assign (resid 5 and name H6) (resid 5 and name H3')  0.0 0.0 4.0
assign (resid 5 and name H6) (resid 5 and name H4')  0.0 0.0 5.0
assign (resid 5 and name H6) (resid 5 and name H5'')  0.0 0.0 5.0
assign (resid 5 and name H6) (resid 5 and name H5')  0.0 0.0 5.0
assign (resid 5 and name H6) (resid 5 and name H5)  0.0 0.0 3.0
assign (resid 6 and name H1') (resid 6 and name H2')  0.0 0.0 3.0
assign (resid 6 and name H1') (resid 6 and name H3')  0.0 0.0 4.0
assign (resid 6 and name H1') (resid 6 and name H4')  0.0 0.0 4.0
assign (resid 6 and name H1') (resid 6 and name H5'')  0.0 0.0 6.0
assign (resid 6 and name H1') (resid 6 and name H5')  0.0 0.0 5.0
assign (resid 6 and name H1) (resid 6 and name H21)  0.0 0.0 3.0
assign (resid 6 and name H1) (resid 6 and name H22)  0.0 0.0 4.0
assign (resid 6 and name H3') (resid 6 and name H2')  0.0 0.0 3.0
assign (resid 6 and name H3') (resid 6 and name H4')  0.0 0.0 4.0
assign (resid 6 and name H3') (resid 6 and name H5'')  0.0 0.0 4.0
assign (resid 6 and name H4') (resid 6 and name H2')  0.0 0.0 4.0
assign (resid 6 and name H4') (resid 6 and name H5'')  0.0 0.0 3.0
assign (resid 6 and name H5') (resid 6 and name H3')  0.0 0.0 4.0
assign (resid 6 and name H5') (resid 6 and name H4')  0.0 0.0 3.0
assign (resid 6 and name H5') (resid 6 and name H5'')  0.0 0.0 3.0
assign (resid 6 and name H8) (resid 6 and name H1')  0.0 0.0 4.0
assign (resid 6 and name H8) (resid 6 and name H2')  0.0 0.0 3.0
assign (resid 6 and name H8) (resid 6 and name H3')  0.0 0.0 3.0
assign (resid 6 and name H8) (resid 6 and name H4')  0.0 0.0 5.0
assign (resid 6 and name H8) (resid 6 and name H5'')  0.0 0.0 5.0
assign (resid 6 and name H8) (resid 6 and name H5')  0.0 0.0 5.0
assign (resid 7 and name H1') (resid 7 and name H2')  0.0 0.0 3.0
assign (resid 7 and name H1') (resid 7 and name H3')  0.0 0.0 4.0
assign (resid 7 and name H1') (resid 7 and name H4')  0.0 0.0 3.0
assign (resid 7 and name H1') (resid 7 and name H5')  0.0 0.0 5.0
assign (resid 7 and name H2) (resid 7 and name H1')  0.0 0.0 5.0
assign (resid 7 and name H2) (resid 7 and name H2')  0.0 0.0 5.0
assign (resid 7 and name H5'') (resid 7 and name H3')  0.0 0.0 3.0
assign (resid 7 and name H5'') (resid 7 and name H4')  0.0 0.0 3.0
assign (resid 7 and name H5') (resid 7 and name H3')  0.0 0.0 4.0
assign (resid 7 and name H5') (resid 7 and name H4')  0.0 0.0 3.0
assign (resid 7 and name H5') (resid 7 and name H5'')  0.0 0.0 3.0
assign (resid 7 and name H8) (resid 7 and name H1')  0.0 0.0 4.0
assign (resid 7 and name H8) (resid 7 and name H2')  0.0 0.0 4.0
assign (resid 7 and name H8) (resid 7 and name H3')  0.0 0.0 4.0
assign (resid 7 and name H8) (resid 7 and name H4')  0.0 0.0 5.0
assign (resid 7 and name H8) (resid 7 and name H5'')  0.0 0.0 5.0
assign (resid 7 and name H8) (resid 7 and name H5')  0.0 0.0 5.0
assign (resid 8 and name H1') (resid 8 and name H2')  0.0 0.0 3.0
assign (resid 8 and name H1') (resid 8 and name H3')  0.0 0.0 4.0
assign (resid 8 and name H1') (resid 8 and name H4')  0.0 0.0 4.0
assign (resid 8 and name H1') (resid 8 and name H5'')  0.0 0.0 6.0
assign (resid 8 and name H1') (resid 8 and name H5')  0.0 0.0 5.0
assign (resid 8 and name H2') (resid 8 and name H2)  0.0 0.0 5.0
assign (resid 8 and name H2') (resid 8 and name H5'')  0.0 0.0 5.0
assign (resid 8 and name H2') (resid 8 and name H5')  0.0 0.0 6.0
assign (resid 8 and name H2) (resid 8 and name H1')  0.0 0.0 5.0
assign (resid 8 and name H3') (resid 8 and name H2')  0.0 0.0 3.0
assign (resid 8 and name H3') (resid 8 and name H4')  0.0 0.0 3.0
assign (resid 8 and name H3') (resid 8 and name H5'')  0.0 0.0 3.0
assign (resid 8 and name H3') (resid 8 and name H5')  0.0 0.0 4.0
assign (resid 8 and name H4') (resid 8 and name H2')  0.0 0.0 4.0
assign (resid 8 and name H4') (resid 8 and name H5'')  0.0 0.0 3.0
assign (resid 8 and name H4') (resid 8 and name H5')  0.0 0.0 3.0
assign (resid 8 and name H5') (resid 8 and name H5'')  0.0 0.0 3.0
assign (resid 8 and name H8) (resid 8 and name H1')  0.0 0.0 4.0
assign (resid 8 and name H8) (resid 8 and name H2')  0.0 0.0 4.0
assign (resid 8 and name H8) (resid 8 and name H3')  0.0 0.0 3.0
assign (resid 8 and name H8) (resid 8 and name H4')  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 8 and name H5'')  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 8 and name H5')  0.0 0.0 4.0
assign (resid 9 and name H1') (resid 9 and name H2')  0.0 0.0 3.0
assign (resid 9 and name H1') (resid 9 and name H3')  0.0 0.0 4.0
assign (resid 9 and name H1') (resid 9 and name H4')  0.0 0.0 4.0
assign (resid 9 and name H1') (resid 9 and name H5'')  0.0 0.0 5.0
assign (resid 9 and name H1') (resid 9 and name H5')  0.0 0.0 5.0
assign (resid 9 and name H2) (resid 9 and name H1')  0.0 0.0 6.0
assign (resid 9 and name H2) (resid 9 and name H2')  0.0 0.0 7.0
assign (resid 9 and name H2) (resid 9 and name H3')  0.0 0.0 7.0
assign (resid 9 and name H2) (resid 9 and name H4')  0.0 0.0 7.0
assign (resid 9 and name H3') (resid 9 and name H1')  0.0 0.0 4.0
assign (resid 9 and name H3') (resid 9 and name H2')  0.0 0.0 3.0
assign (resid 9 and name H3') (resid 9 and name H4')  0.0 0.0 3.0
assign (resid 9 and name H3') (resid 9 and name H5'')  0.0 0.0 4.0
assign (resid 9 and name H3') (resid 9 and name H5')  0.0 0.0 3.0
assign (resid 9 and name H4') (resid 9 and name H5'')  0.0 0.0 3.0
assign (resid 9 and name H4') (resid 9 and name H5')  0.0 0.0 3.0
assign (resid 9 and name H5'') (resid 9 and name H2')  0.0 0.0 6.0
assign (resid 9 and name H5') (resid 9 and name H5'')  0.0 0.0 3.0
assign (resid 9 and name H8) (resid 9 and name H1')  0.0 0.0 4.0
assign (resid 9 and name H8) (resid 9 and name H2')  0.0 0.0 3.0
assign (resid 9 and name H8) (resid 9 and name H3')  0.0 0.0 3.0
assign (resid 9 and name H8) (resid 9 and name H4')  0.0 0.0 6.0
assign (resid 9 and name H8) (resid 9 and name H5'')  0.0 0.0 6.0
assign (resid 9 and name H8) (resid 9 and name H5')  0.0 0.0 5.0

!RNA sequential (|i - j| = 1) NOEs

assign (resid 1 and name H8) (resid 2 and name H5)  0.0 0.0 5.0
assign (resid 10 and name H2) (resid 11 and name H1')  0.0 0.0 3.0
assign (resid 10 and name H2) (resid 11 and name H2')  0.0 0.0 6.0
assign (resid 10 and name H2) (resid 11 and name H8)  0.0 0.0 7.0
assign (resid 10 and name H5'') (resid 11 and name H8)  0.0 0.0 5.0
assign (resid 10 and name H8) (resid 11 and name H2')  0.0 0.0 6.0
assign (resid 10 and name H8) (resid 11 and name H61)  0.0 0.0 7.0
assign (resid 10 and name H8) (resid 9 and name H3')  0.0 0.0 6.0
assign (resid 11 and name H2) (resid 12 and name H1')  0.0 0.0 4.0
assign (resid 11 and name H2) (resid 12 and name H2')  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 12 and name H22)  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 12 and name H8)  0.0 0.0 6.0
assign (resid 11 and name H3') (resid 12 and name H5')  0.0 0.0 5.0
assign (resid 11 and name H4') (resid 10 and name H2')  0.0 0.0 4.0
assign (resid 11 and name H62) (resid 12 and name H8)  0.0 0.0 5.0
assign (resid 11 and name H8) (resid 10 and name H2')  0.0 0.0 3.0
assign (resid 11 and name H8) (resid 10 and name H3')  0.0 0.0 3.0
assign (resid 11 and name H8) (resid 10 and name H4')  0.0 0.0 5.0
assign (resid 11 and name H8) (resid 10 and name H5')  0.0 0.0 4.0
assign (resid 11 and name H8) (resid 12 and name H8)  0.0 0.0 5.0
assign (resid 12 and name H1') (resid 11 and name H1')  0.0 0.0 4.0
assign (resid 12 and name H1') (resid 11 and name H2')  0.0 0.0 3.0
assign (resid 12 and name H1) (resid 13 and name H1')  0.0 0.0 7.0
assign (resid 12 and name H1) (resid 13 and name H1)  0.0 0.0 5.0
assign (resid 12 and name H4') (resid 11 and name H2')  0.0 0.0 3.0
assign (resid 12 and name H8) (resid 11 and name H1')  0.0 0.0 5.0
assign (resid 12 and name H8) (resid 11 and name H2')  0.0 0.0 3.0
assign (resid 12 and name H8) (resid 11 and name H3')  0.0 0.0 4.0
assign (resid 13 and name H1') (resid 12 and name H22)  0.0 0.0 4.0
assign (resid 13 and name H1) (resid 12 and name H21)  0.0 0.0 5.0
assign (resid 13 and name H1) (resid 14 and name H1)  0.0 0.0 5.0
assign (resid 13 and name H8) (resid 12 and name H1')  0.0 0.0 5.0
assign (resid 13 and name H8) (resid 12 and name H2')  0.0 0.0 3.0
assign (resid 13 and name H8) (resid 12 and name H22)  0.0 0.0 5.0
assign (resid 13 and name H8) (resid 12 and name H3')  0.0 0.0 3.0
assign (resid 13 and name H8) (resid 12 and name H5'')  0.0 0.0 6.0
assign (resid 13 and name H8) (resid 12 and name H8)  0.0 0.0 6.0
assign (resid 14 and name H1') (resid 13 and name H22)  0.0 0.0 4.0
assign (resid 14 and name H1) (resid 15 and name H41)  0.0 0.0 5.0
assign (resid 14 and name H1) (resid 15 and name H42)  0.0 0.0 6.0
assign (resid 14 and name H2') (resid 15 and name H5')  0.0 0.0 4.0
assign (resid 14 and name H4') (resid 15 and name H6)  0.0 0.0 6.0
assign (resid 14 and name H8) (resid 13 and name H1')  0.0 0.0 5.0
assign (resid 14 and name H8) (resid 13 and name H1)  0.0 0.0 6.0
assign (resid 14 and name H8) (resid 13 and name H2')  0.0 0.0 3.0
assign (resid 14 and name H8) (resid 13 and name H3')  0.0 0.0 4.0
assign (resid 14 and name H8) (resid 13 and name H4')  0.0 0.0 5.0
assign (resid 14 and name H8) (resid 15 and name H5)  0.0 0.0 5.0
assign (resid 14 and name H8) (resid 15 and name H6)  0.0 0.0 5.0
assign (resid 15 and name H5') (resid 14 and name H4')  0.0 0.0 4.0
assign (resid 15 and name H5) (resid 14 and name H2')  0.0 0.0 4.0
assign (resid 15 and name H5) (resid 14 and name H3')  0.0 0.0 5.0
assign (resid 15 and name H6) (resid 14 and name H1')  0.0 0.0 5.0
assign (resid 15 and name H6) (resid 14 and name H2')  0.0 0.0 3.0
assign (resid 15 and name H6) (resid 14 and name H3')  0.0 0.0 4.0
assign (resid 2 and name H1') (resid 3 and name H6)  2.0 0.0 5.0
assign (resid 2 and name H2') (resid 3 and name H5'')  0.0 0.0 4.0
assign (resid 2 and name H3') (resid 3 and name H5'')  0.0 0.0 5.0
assign (resid 2 and name H4') (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 2 and name H41) (resid 3 and name H5)  0.0 0.0 5.0
assign (resid 2 and name H41) (resid 3 and name H6)  0.0 0.0 6.0
assign (resid 2 and name H42) (resid 3 and name H42)  0.0 0.0 4.0
assign (resid 2 and name H42) (resid 3 and name H5)  0.0 0.0 5.0
assign (resid 2 and name H5) (resid 3 and name H42)  0.0 0.0 5.0
assign (resid 2 and name H6) (resid 1 and name H1')  0.0 0.0 5.0
assign (resid 2 and name H6) (resid 1 and name H2')  0.0 0.0 4.0
assign (resid 2 and name H6) (resid 1 and name H3')  0.0 0.0 5.0
assign (resid 2 and name H6) (resid 3 and name H5)  0.0 0.0 5.0
assign (resid 23 and name HD2) (resid 24 and name HB*)  0.0 0.0 5.0
assign (resid 3 and name H2') (resid 4 and name H6)  0.0 0.0 3.0
assign (resid 3 and name H3') (resid 4 and name H6)  0.0 0.0 3.0
assign (resid 3 and name H41) (resid 2 and name H42)  0.0 0.0 5.0
assign (resid 3 and name H41) (resid 2 and name H5)  0.0 0.0 6.0
assign (resid 3 and name H41) (resid 4 and name H41)  0.0 0.0 4.0
assign (resid 3 and name H41) (resid 4 and name H42)  0.0 0.0 4.0
assign (resid 3 and name H41) (resid 4 and name H5)  0.0 0.0 5.0
assign (resid 3 and name H42) (resid 4 and name H42)  0.0 0.0 4.0
assign (resid 3 and name H5) (resid 2 and name H2')  0.0 0.0 5.0
assign (resid 3 and name H5) (resid 2 and name H5)  0.0 0.0 4.0
assign (resid 3 and name H5) (resid 4 and name H6)  0.0 0.0 6.0
assign (resid 3 and name H6) (resid 2 and name H2')  0.0 0.0 3.0
assign (resid 3 and name H6) (resid 2 and name H3')  0.0 0.0 4.0
assign (resid 3 and name H6) (resid 4 and name H5)  0.0 0.0 4.0
assign (resid 4 and name H41) (resid 3 and name H42)  0.0 0.0 4.0
assign (resid 4 and name H41) (resid 3 and name H5)  0.0 0.0 5.0
assign (resid 4 and name H41) (resid 5 and name H5)  0.0 0.0 5.0
assign (resid 4 and name H42) (resid 3 and name H5)  0.0 0.0 4.0
assign (resid 4 and name H42) (resid 5 and name H5)  0.0 0.0 4.0
assign (resid 4 and name H5) (resid 5 and name H5)  0.0 0.0 5.0
assign (resid 5 and name H1') (resid 4 and name H2')  0.0 0.0 5.0
assign (resid 5 and name H3') (resid 6 and name H8)  0.0 0.0 4.0
assign (resid 5 and name H3) (resid 4 and name H41)  0.0 0.0 5.0
assign (resid 5 and name H3) (resid 6 and name H1')  0.0 0.0 6.0
assign (resid 5 and name H5') (resid 4 and name H3')  0.0 0.0 4.0
assign (resid 5 and name H5) (resid 4 and name H2')  0.0 0.0 4.0
assign (resid 5 and name H5) (resid 6 and name H8)  0.0 0.0 5.0
assign (resid 5 and name H6) (resid 4 and name H1')  0.0 0.0 5.0
assign (resid 5 and name H6) (resid 4 and name H2')  0.0 0.0 3.0
assign (resid 5 and name H6) (resid 4 and name H6)  0.0 0.0 6.0
assign (resid 6 and name H1') (resid 7 and name H3')  0.0 0.0 5.0
assign (resid 6 and name H2') (resid 5 and name H2')  0.0 0.0 5.0
assign (resid 6 and name H2') (resid 7 and name H2')  0.0 0.0 4.0
assign (resid 6 and name H2') (resid 7 and name H3')  0.0 0.0 3.0
assign (resid 6 and name H2') (resid 7 and name H5'')  0.0 0.0 4.0
assign (resid 6 and name H8) (resid 5 and name H1')  0.0 0.0 5.0
assign (resid 6 and name H8) (resid 5 and name H2')  0.0 0.0 3.0
assign (resid 6 and name H8) (resid 5 and name H3')  0.0 0.0 4.0
assign (resid 6 and name H8) (resid 5 and name H4')  0.0 0.0 6.0
assign (resid 6 and name H8) (resid 5 and name H6)  0.0 0.0 4.0
assign (resid 7 and name H1') (resid 8 and name H1')  0.0 0.0 5.0
assign (resid 7 and name H2) (resid 8 and name H2)  0.0 0.0 6.0
assign (resid 7 and name H2) (resid 8 and name H3')  0.0 0.0 7.0
assign (resid 7 and name H4') (resid 8 and name H5')  0.0 0.0 5.0
assign (resid 7 and name H8) (resid 6 and name H1')  0.0 0.0 5.0
assign (resid 7 and name H8) (resid 6 and name H2')  0.0 0.0 4.0
assign (resid 8 and name H1') (resid 7 and name H2')  0.0 0.0 4.0
assign (resid 8 and name H1') (resid 7 and name H3')  0.0 0.0 6.0
assign (resid 8 and name H1') (resid 9 and name H3')  0.0 0.0 5.0
assign (resid 8 and name H2') (resid 9 and name H3')  0.0 0.0 5.0
assign (resid 8 and name H4') (resid 7 and name H2')  0.0 0.0 4.0
assign (resid 8 and name H4') (resid 9 and name H2)  0.0 0.0 6.0
assign (resid 8 and name H4') (resid 9 and name H8)  0.0 0.0 6.0
assign (resid 8 and name H8) (resid 7 and name H1')  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 7 and name H2')  0.0 0.0 3.0
assign (resid 8 and name H8) (resid 7 and name H2)  0.0 0.0 6.0
assign (resid 8 and name H8) (resid 7 and name H3')  0.0 0.0 3.0
assign (resid 8 and name H8) (resid 7 and name H4')  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 7 and name H5')  0.0 0.0 6.0
assign (resid 8 and name H8) (resid 7 and name H8)  0.0 0.0 5.0
assign (resid 9 and name H8) (resid 10 and name H5'')  0.0 0.0 7.0
assign (resid 9 and name H8) (resid 8 and name H1')  0.0 0.0 6.0
assign (resid 9 and name H8) (resid 8 and name H2')  0.0 0.0 7.0

!RNA short range interresidue (|i - j| = 2,3,4) NOEs

assign (resid 10 and name H2) (resid 12 and name H1')  0.0 0.0 7.0
assign (resid 10 and name H2) (resid 8 and name H2)  0.0 0.0 7.0
assign (resid 10 and name H5'') (resid 8 and name H2')  0.0 0.0 4.0
assign (resid 10 and name H8) (resid 6 and name H22)  0.0 0.0 4.0
assign (resid 10 and name H8) (resid 8 and name H2')  0.0 0.0 3.0
assign (resid 10 and name H8) (resid 8 and name H3')  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 6 and name H1')  0.0 0.0 6.0
assign (resid 12 and name H8) (resid 10 and name H5')  0.0 0.0 7.0
assign (resid 13 and name H8) (resid 11 and name H2)  0.0 0.0 7.0
assign (resid 18 and name HB2) (resid 15 and name HG1)  0.0 0.0 5.0
assign (resid 2 and name H41) (resid 4 and name H41)  0.0 0.0 7.0
assign (resid 2 and name H41) (resid 4 and name H42)  0.0 0.0 7.0
assign (resid 23 and name HD2) (resid 26 and name HB)  0.0 0.0 5.0
assign (resid 6 and name H1') (resid 11 and name H61)  0.0 0.0 7.0
assign (resid 6 and name H1) (resid 10 and name H5')  0.0 0.0 6.0
assign (resid 6 and name H1) (resid 10 and name H8)  0.0 0.0 5.0
assign (resid 6 and name H1) (resid 11 and name H61)  0.0 0.0 5.0
assign (resid 6 and name H1) (resid 8 and name H2')  0.0 0.0 4.0
assign (resid 6 and name H1) (resid 8 and name H3')  0.0 0.0 4.0
assign (resid 6 and name H1) (resid 8 and name H5'')  0.0 0.0 6.0
assign (resid 6 and name H1) (resid 8 and name H8)  0.0 0.0 5.0
assign (resid 6 and name H8) (resid 11 and name H61)  0.0 0.0 7.0
assign (resid 6 and name H8) (resid 8 and name H3')  0.0 0.0 7.0
assign (resid 7 and name H2) (resid 9 and name H3')  0.0 0.0 7.0
assign (resid 8 and name H1') (resid 10 and name H8)  2.0 0.0 5.0
assign (resid 8 and name H2') (resid 10 and name H4')  0.0 0.0 6.0
assign (resid 8 and name H2') (resid 6 and name H21)  0.0 0.0 3.0
assign (resid 8 and name H2') (resid 6 and name H22)  0.0 0.0 3.0
assign (resid 8 and name H2) (resid 10 and name H1')  0.0 0.0 3.0
assign (resid 8 and name H2) (resid 6 and name H1')  0.0 0.0 7.0
assign (resid 8 and name H3') (resid 6 and name H21)  0.0 0.0 4.0
assign (resid 8 and name H8) (resid 6 and name H1')  0.0 0.0 4.0
assign (resid 8 and name H8) (resid 6 and name H2')  0.0 0.0 3.0
assign (resid 8 and name H8) (resid 6 and name H21)  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 6 and name H22)  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 6 and name H3')  0.0 0.0 6.0
assign (resid 8 and name H8) (resid 6 and name H8)  0.0 0.0 6.0

!RNA long range interresidue (|i - j| > 4) NOEs

assign (resid 1 and name H1) (resid 14 and name H1)  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 5 and name H1')  0.0 0.0 5.0
assign (resid 11 and name H2) (resid 5 and name H2')  0.0 0.0 5.0
assign (resid 11 and name H62) (resid 5 and name H5)  0.0 0.0 6.0
assign (resid 12 and name H1') (resid 5 and name H3)  0.0 0.0 5.0
assign (resid 12 and name H1) (resid 3 and name H41)  0.0 0.0 6.0
assign (resid 12 and name H1) (resid 4 and name H1')  0.0 0.0 6.0
assign (resid 12 and name H1) (resid 4 and name H41)  0.0 0.0 3.0
assign (resid 12 and name H1) (resid 4 and name H42)  0.0 0.0 4.0
assign (resid 12 and name H1) (resid 4 and name H5)  0.0 0.0 6.0
assign (resid 12 and name H1) (resid 5 and name H1')  0.0 0.0 6.0
assign (resid 12 and name H1) (resid 5 and name H5)  0.0 0.0 5.0
assign (resid 12 and name H1) (resid 5 and name H6)  0.0 0.0 6.0
assign (resid 13 and name H1) (resid 2 and name H41)  0.0 0.0 6.0
assign (resid 13 and name H1) (resid 3 and name H1')  0.0 0.0 6.0
assign (resid 13 and name H1) (resid 3 and name H41)  0.0 0.0 3.0
assign (resid 13 and name H1) (resid 3 and name H42)  0.0 0.0 4.0
assign (resid 13 and name H1) (resid 3 and name H5)  0.0 0.0 6.0
assign (resid 13 and name H1) (resid 4 and name H41)  0.0 0.0 4.0
assign (resid 13 and name H1) (resid 4 and name H42)  0.0 0.0 5.0
assign (resid 13 and name H1) (resid 4 and name H5)  0.0 0.0 5.0
assign (resid 13 and name H22) (resid 4 and name H2')  0.0 0.0 7.0
assign (resid 14 and name H1) (resid 2 and name H1')  0.0 0.0 5.0
assign (resid 14 and name H1) (resid 2 and name H41)  0.0 0.0 3.0
assign (resid 14 and name H1) (resid 2 and name H42)  0.0 0.0 4.0
assign (resid 14 and name H1) (resid 3 and name H1')  0.0 0.0 5.0
assign (resid 14 and name H1) (resid 3 and name H41)  0.0 0.0 5.0
assign (resid 14 and name H1) (resid 3 and name H5)  0.0 0.0 6.0
assign (resid 14 and name H1) (resid 3 and name H6)  0.0 0.0 6.0
assign (resid 15 and name H41) (resid 1 and name H2')  0.0 0.0 7.0
assign (resid 2 and name H41) (resid 15 and name H42)  0.0 0.0 4.0
assign (resid 2 and name H42) (resid 15 and name H42)  0.0 0.0 5.0
assign (resid 3 and name H42) (resid 14 and name H1)  0.0 0.0 6.0
assign (resid 3 and name H5) (resid 13 and name H1)  0.0 0.0 6.0
assign (resid 4 and name H1') (resid 12 and name H22)  0.0 0.0 6.0
assign (resid 4 and name H1') (resid 13 and name H1')  0.0 0.0 7.0
assign (resid 4 and name H1') (resid 13 and name H1)  0.0 0.0 5.0
assign (resid 4 and name H1') (resid 13 and name H21)  0.0 0.0 4.0
assign (resid 4 and name H5) (resid 14 and name H1)  0.0 0.0 7.0
assign (resid 5 and name H1') (resid 12 and name H21)  0.0 0.0 4.0
assign (resid 5 and name H1') (resid 12 and name H22)  0.0 0.0 4.0
assign (resid 5 and name H3) (resid 11 and name H2)  0.0 0.0 3.0
assign (resid 5 and name H3) (resid 11 and name H61)  0.0 0.0 3.0
assign (resid 5 and name H3) (resid 11 and name H62)  0.0 0.0 4.0
assign (resid 5 and name H3) (resid 12 and name H1)  0.0 0.0 3.0
assign (resid 5 and name H3) (resid 12 and name H22)  0.0 0.0 6.0

!protein sequential (|i - j| = 1) NOEs

assign (resid 10 and name HN) (resid 11 and name HA)  0.0 0.0 6.0
assign (resid 10 and name HN) (resid 11 and name HB1)  0.0 0.0 6.0
assign (resid 10 and name HN) (resid 11 and name HN)  0.0 0.0 3.0
assign (resid 10 and name HN) (resid 9 and name HA)  0.0 0.0 4.0
assign (resid 10 and name HN) (resid 9 and name HB*)  0.0 0.0 3.0
assign (resid 10 and name HN) (resid 9 and name HG1)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 9 and name HN)  0.0 0.0 3.0
assign (resid 11 and name HN) (resid 10 and name HA)  0.0 0.0 4.0
assign (resid 11 and name HN) (resid 10 and name HG1)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 12 and name HN)  0.0 0.0 3.0
assign (resid 12 and name HA) (resid 13 and name HN)  0.0 0.0 5.0
assign (resid 12 and name HN) (resid 11 and name HA)  0.0 0.0 4.0
assign (resid 12 and name HN) (resid 11 and name HB1)  0.0 0.0 5.0
assign (resid 12 and name HN) (resid 13 and name HB*)  0.0 0.0 5.0
assign (resid 12 and name HN) (resid 13 and name HG1)  0.0 0.0 5.0
assign (resid 13 and name HN) (resid 12 and name HA)  0.0 0.0 4.0
assign (resid 13 and name HN) (resid 12 and name HB*)  0.0 0.0 3.0
assign (resid 13 and name HN) (resid 12 and name HN)  0.0 0.0 3.0
assign (resid 13 and name HN) (resid 14 and name HN)  0.0 0.0 3.0
assign (resid 14 and name HN) (resid 13 and name HA)  0.0 0.0 4.0
assign (resid 14 and name HN) (resid 13 and name HB*)  0.0 0.0 3.0
assign (resid 14 and name HN) (resid 13 and name HG1)  0.0 0.0 5.0
assign (resid 15 and name HA) (resid 16 and name HN)  0.0 0.0 4.0
assign (resid 15 and name HE21) (resid 14 and name HG*)  0.0 0.0 5.0
assign (resid 15 and name HE21) (resid 14 and name HN)  0.0 0.0 5.0
assign (resid 15 and name HN) (resid 14 and name HA)  0.0 0.0 4.0
assign (resid 15 and name HN) (resid 14 and name HB*)  0.0 0.0 4.0
assign (resid 15 and name HN) (resid 14 and name HG*)  0.0 0.0 5.0
assign (resid 15 and name HN) (resid 14 and name HN)  0.0 0.0 3.0
assign (resid 16 and name HA) (resid 15 and name HB1)  0.0 0.0 5.0
assign (resid 16 and name HN) (resid 15 and name HB1)  0.0 0.0 3.0
assign (resid 16 and name HN) (resid 15 and name HB2)  0.0 0.0 3.0
assign (resid 16 and name HN) (resid 15 and name HE21)  0.0 0.0 5.0
assign (resid 16 and name HN) (resid 15 and name HN)  0.0 0.0 3.0
assign (resid 16 and name HN) (resid 17 and name HB1)  0.0 0.0 6.0
assign (resid 16 and name HN) (resid 17 and name HN)  0.0 0.0 3.0
assign (resid 17 and name HA) (resid 16 and name HB*)  0.0 0.0 5.0
assign (resid 17 and name HN) (resid 16 and name HA)  0.0 0.0 4.0
assign (resid 17 and name HN) (resid 16 and name HB*)  0.0 0.0 4.0
assign (resid 17 and name HN) (resid 18 and name HB2)  0.0 0.0 5.0
assign (resid 17 and name HN) (resid 18 and name HN)  0.0 0.0 3.0
assign (resid 18 and name HA) (resid 17 and name HB1)  0.0 0.0 5.0
assign (resid 18 and name HE3) (resid 19 and name HA)  0.0 0.0 5.0
assign (resid 18 and name HH2) (resid 19 and name HA)  0.0 0.0 5.0
assign (resid 18 and name HH2) (resid 19 and name HB1)  0.0 0.0 6.0
assign (resid 18 and name HH2) (resid 19 and name HG*)  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 17 and name HA)  0.0 0.0 4.0
assign (resid 18 and name HN) (resid 17 and name HB1)  0.0 0.0 4.0
assign (resid 18 and name HN) (resid 17 and name HB2)  0.0 0.0 3.0
assign (resid 18 and name HN) (resid 17 and name HG1)  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 17 and name HG2)  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 19 and name HB1)  0.0 0.0 6.0
assign (resid 18 and name HN) (resid 19 and name HB2)  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 19 and name HA)  0.0 0.0 4.0
assign (resid 18 and name HZ3) (resid 19 and name HB1)  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 19 and name HB2)  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 19 and name HE*)  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 19 and name HG*)  0.0 0.0 4.0
assign (resid 19 and name HA) (resid 18 and name HN)  0.0 0.0 6.0
assign (resid 19 and name HA) (resid 20 and name HB*)  0.0 0.0 6.0
assign (resid 19 and name HN) (resid 18 and name HA)  0.0 0.0 4.0
assign (resid 19 and name HN) (resid 18 and name HB1)  0.0 0.0 4.0
assign (resid 19 and name HN) (resid 18 and name HB2)  0.0 0.0 4.0
assign (resid 19 and name HN) (resid 18 and name HH2)  0.0 0.0 7.0
assign (resid 19 and name HN) (resid 18 and name HN)  0.0 0.0 3.0
assign (resid 19 and name HN) (resid 18 and name HZ3)  0.0 0.0 4.0
assign (resid 19 and name HN) (resid 20 and name HB*)  0.0 0.0 5.0
assign (resid 19 and name HN) (resid 20 and name HN)  0.0 0.0 3.0
assign (resid 2 and name HA) (resid 3 and name HA)  0.0 0.0 5.0
assign (resid 2 and name HA) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 20 and name HA) (resid 19 and name HN)  0.0 0.0 5.0
assign (resid 20 and name HN) (resid 19 and name HA)  0.0 0.0 4.0
assign (resid 20 and name HN) (resid 19 and name HB1)  0.0 0.0 4.0
assign (resid 20 and name HN) (resid 19 and name HB2)  0.0 0.0 4.0
assign (resid 20 and name HN) (resid 19 and name HG*)  0.0 0.0 5.0
assign (resid 20 and name HN) (resid 21 and name HB*)  0.0 0.0 5.0
assign (resid 20 and name HN) (resid 21 and name HN)  0.0 0.0 3.0
assign (resid 21 and name HA) (resid 20 and name HB*)  0.0 0.0 5.0
assign (resid 21 and name HN) (resid 20 and name HA)  0.0 0.0 4.0
assign (resid 21 and name HN) (resid 20 and name HB*)  0.0 0.0 4.0
assign (resid 21 and name HN) (resid 22 and name HD21)  0.0 0.0 5.0
assign (resid 21 and name HN) (resid 22 and name HD22)  0.0 0.0 5.0
assign (resid 21 and name HN) (resid 22 and name HN)  0.0 0.0 3.0
assign (resid 22 and name HD21) (resid 21 and name HA)  0.0 0.0 6.0
assign (resid 22 and name HD21) (resid 21 and name HB*)  0.0 0.0 4.0
assign (resid 22 and name HD22) (resid 21 and name HB*)  0.0 0.0 4.0
assign (resid 22 and name HN) (resid 21 and name HA)  0.0 0.0 3.0
assign (resid 22 and name HN) (resid 21 and name HB*)  0.0 0.0 4.0
assign (resid 22 and name HN) (resid 23 and name HD1)  0.0 0.0 4.0
assign (resid 22 and name HN) (resid 23 and name HD2)  0.0 0.0 4.0
assign (resid 23 and name HD1) (resid 22 and name HB2)  0.0 0.0 6.0
assign (resid 24 and name HN) (resid 23 and name HB1)  0.0 0.0 4.0
assign (resid 24 and name HN) (resid 23 and name HD1)  0.0 0.0 4.0
assign (resid 24 and name HN) (resid 25 and name HN)  0.0 0.0 3.0
assign (resid 25 and name HA) (resid 26 and name HG2*)  0.0 0.0 5.0
assign (resid 25 and name HN) (resid 24 and name HA)  0.0 0.0 4.0
assign (resid 25 and name HN) (resid 24 and name HB*)  0.0 0.0 4.0
assign (resid 25 and name HN) (resid 26 and name HG1*)  0.0 0.0 6.0
assign (resid 25 and name HN) (resid 26 and name HG2*)  0.0 0.0 6.0
assign (resid 25 and name HN) (resid 26 and name HN)  0.0 0.0 3.0
assign (resid 26 and name HN) (resid 25 and name HA)  0.0 0.0 3.0
assign (resid 26 and name HN) (resid 25 and name HD2*)  0.0 0.0 5.0
assign (resid 27 and name HA*) (resid 26 and name HG2*)  0.0 0.0 5.0
assign (resid 27 and name HN) (resid 26 and name HA)  0.0 0.0 3.0
assign (resid 27 and name HN) (resid 26 and name HB)  0.0 0.0 5.0
assign (resid 27 and name HN) (resid 26 and name HG1*)  0.0 0.0 4.0
assign (resid 27 and name HN) (resid 26 and name HG2*)  0.0 0.0 4.0
assign (resid 27 and name HN) (resid 26 and name HN)  0.0 0.0 5.0
assign (resid 27 and name HN) (resid 28 and name HN)  0.0 0.0 5.0
assign (resid 28 and name HN) (resid 27 and name HA*)  0.0 0.0 3.0
assign (resid 29 and name HA) (resid 28 and name HG*)  0.0 0.0 4.0
assign (resid 29 and name HB*) (resid 28 and name HG*)  0.0 0.0 5.0
assign (resid 29 and name HB*) (resid 30 and name HB*)  0.0 0.0 5.0
assign (resid 29 and name HN) (resid 28 and name HA)  0.0 0.0 3.0
assign (resid 29 and name HN) (resid 28 and name HB)  0.0 0.0 5.0
assign (resid 29 and name HN) (resid 28 and name HG*)  0.0 0.0 4.0
assign (resid 29 and name HN) (resid 28 and name HN)  0.0 0.0 5.0
assign (resid 3 and name HA) (resid 2 and name HB1)  0.0 0.0 5.0
assign (resid 3 and name HN) (resid 2 and name HA)  0.0 0.0 3.0
assign (resid 3 and name HN) (resid 2 and name HB1)  0.0 0.0 3.0
assign (resid 3 and name HN) (resid 2 and name HB2)  0.0 0.0 3.0
assign (resid 3 and name HN) (resid 4 and name HN)  0.0 0.0 3.0
assign (resid 30 and name HN) (resid 29 and name HA)  0.0 0.0 3.0
assign (resid 30 and name HN) (resid 29 and name HB*)  0.0 0.0 5.0
assign (resid 31 and name HA) (resid 32 and name HD1)  0.0 0.0 3.0
assign (resid 31 and name HA) (resid 32 and name HD2)  0.0 0.0 3.0
assign (resid 31 and name HN) (resid 30 and name HA)  0.0 0.0 3.0
assign (resid 31 and name HN) (resid 32 and name HA)  0.0 0.0 5.0
assign (resid 32 and name HD1) (resid 31 and name HB2)  0.0 0.0 5.0
assign (resid 33 and name HN) (resid 32 and name HA)  0.0 0.0 3.0
assign (resid 33 and name HN) (resid 32 and name HB1)  0.0 0.0 5.0
assign (resid 33 and name HN) (resid 32 and name HB2)  0.0 0.0 5.0
assign (resid 34 and name HN) (resid 33 and name HA)  0.0 0.0 4.0
assign (resid 34 and name HN) (resid 33 and name HB)  0.0 0.0 5.0
assign (resid 34 and name HN) (resid 35 and name HN)  0.0 0.0 5.0
assign (resid 35 and name HN) (resid 34 and name HA)  0.0 0.0 3.0
assign (resid 4 and name HA) (resid 5 and name HN)  0.0 0.0 4.0
assign (resid 4 and name HN) (resid 3 and name HA)  0.0 0.0 4.0
assign (resid 4 and name HN) (resid 3 and name HB*)  0.0 0.0 3.0
assign (resid 4 and name HN) (resid 5 and name HN)  0.0 0.0 3.0
assign (resid 5 and name HA) (resid 4 and name HB2)  0.0 0.0 6.0
assign (resid 5 and name HN) (resid 4 and name HB1)  0.0 0.0 3.0
assign (resid 5 and name HN) (resid 4 and name HB2)  0.0 0.0 4.0
assign (resid 5 and name HN) (resid 4 and name HG1)  0.0 0.0 5.0
assign (resid 5 and name HN) (resid 4 and name HG2)  0.0 0.0 5.0
assign (resid 5 and name HN) (resid 6 and name HB2)  0.0 0.0 5.0
assign (resid 5 and name HN) (resid 6 and name HN)  0.0 0.0 3.0
assign (resid 6 and name HN) (resid 5 and name HA)  0.0 0.0 4.0
assign (resid 6 and name HN) (resid 5 and name HB)  0.0 0.0 3.0
assign (resid 6 and name HN) (resid 5 and name HG2*)  0.0 0.0 4.0
assign (resid 7 and name HA) (resid 8 and name HA)  0.0 0.0 5.0
assign (resid 7 and name HN) (resid 6 and name HA)  0.0 0.0 4.0
assign (resid 7 and name HN) (resid 6 and name HB1)  0.0 0.0 4.0
assign (resid 7 and name HN) (resid 6 and name HB2)  0.0 0.0 3.0
assign (resid 7 and name HN) (resid 6 and name HG*)  0.0 0.0 5.0
assign (resid 7 and name HN) (resid 6 and name HN)  0.0 0.0 3.0
assign (resid 8 and name HA) (resid 9 and name HN)  0.0 0.0 4.0
assign (resid 8 and name HN) (resid 7 and name HA)  0.0 0.0 4.0
assign (resid 8 and name HN) (resid 7 and name HN)  0.0 0.0 3.0
assign (resid 8 and name HN) (resid 9 and name HB*)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 9 and name HG2)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 9 and name HN)  0.0 0.0 3.0
assign (resid 9 and name HN) (resid 8 and name HA)  0.0 0.0 4.0
assign (resid 9 and name HN) (resid 8 and name HB1)  0.0 0.0 3.0
assign (resid 9 and name HN) (resid 8 and name HB2)  0.0 0.0 4.0
assign (resid 9 and name HN) (resid 8 and name HG1)  0.0 0.0 5.0
assign (resid 9 and name HN) (resid 8 and name HG2)  0.0 0.0 5.0
assign (resid 10 and name HG1) (resid 9 and name HB*)  0.0 0.0 6.0
assign (resid 13 and name HG1) (resid 12 and name HB*)  0.0 0.0 5.0
assign (resid 13 and name HG2) (resid 12 and name HB*)  0.0 0.0 6.0
assign (resid 15 and name HB2) (resid 16 and name HB*)  0.0 0.0 6.0
assign (resid 2 and name HB2) (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 6 and name HB2) (resid 5 and name HG2*)  0.0 0.0 5.0
assign (resid 7 and name HB1) (resid 8 and name HN)  0.0 0.0 3.0
assign (resid 10 and name HA) (resid 11 and name HE)  0.0 0.0 5.0
assign (resid 10 and name HB2) (resid 11 and name HE)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 11 and name HB2)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 11 and name HG2)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 10 and name HA)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 12 and name HA)  0.0 0.0 5.0
assign (resid 11 and name HB1) (resid 12 and name HA)  0.0 0.0 5.0
assign (resid 11 and name HB2) (resid 12 and name HA)  0.0 0.0 5.0
assign (resid 11 and name HE) (resid 10 and name HB1)  0.0 0.0 5.0
assign (resid 11 and name HE) (resid 10 and name HG2)  0.0 0.0 5.0
assign (resid 11 and name HE) (resid 10 and name HG2)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 10 and name HB1)  0.0 0.0 4.0
assign (resid 11 and name HN) (resid 10 and name HB2)  0.0 0.0 4.0
assign (resid 11 and name HN) (resid 10 and name HG2)  0.0 0.0 6.0
assign (resid 11 and name HN) (resid 12 and name HB*)  0.0 0.0 5.0
assign (resid 6 and name HA) (resid 5 and name HG2*)  0.0 0.0 5.0
assign (resid 6 and name HB1) (resid 7 and name HA)  0.0 0.0 4.0
assign (resid 6 and name HB2) (resid 5 and name HB)  0.0 0.0 5.0
assign (resid 6 and name HB2) (resid 7 and name HA)  0.0 0.0 5.0
assign (resid 6 and name HB2) (resid 7 and name HB1)  0.0 0.0 5.0
assign (resid 6 and name HG*) (resid 5 and name HB)  0.0 0.0 5.0
assign (resid 6 and name HN) (resid 7 and name HB2)  0.0 0.0 6.0
assign (resid 7 and name HB1) (resid 6 and name HB1)  0.0 0.0 5.0
assign (resid 7 and name HB1) (resid 8 and name HD1)  0.0 0.0 6.0
assign (resid 7 and name HB2) (resid 6 and name HB1)  0.0 0.0 5.0
assign (resid 7 and name HE) (resid 8 and name HE)  0.0 0.0 5.0
assign (resid 7 and name HN) (resid 8 and name HB1)  0.0 0.0 6.0
assign (resid 8 and name HA) (resid 7 and name HB1)  0.0 0.0 5.0
assign (resid 8 and name HA) (resid 7 and name HG*)  0.0 0.0 5.0
assign (resid 8 and name HE) (resid 7 and name HB1)  0.0 0.0 5.0
assign (resid 8 and name HG1) (resid 9 and name HA)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 7 and name HB2)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 7 and name HG*)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 9 and name HG1)  0.0 0.0 5.0
assign (resid 9 and name HB*) (resid 10 and name HA)  0.0 0.0 5.0

!protein short range interresidue (|i - j| = 2,3,4) NOEs

assign (resid 8 and name HA) (resid 11 and name HG1)  0.0 0.0 3.0
assign (resid 8 and name HA) (resid 11 and name HG2)  0.0 0.0 3.0
assign (resid 10 and name HA) (resid 12 and name HN)  0.0 0.0 4.0
assign (resid 10 and name HE) (resid 7 and name HA)  0.0 0.0 6.0
assign (resid 10 and name HN) (resid 12 and name HN)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 7 and name HA)  0.0 0.0 4.0
assign (resid 10 and name HN) (resid 7 and name HG*)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 8 and name HN)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 14 and name HB*)  0.0 0.0 4.0
assign (resid 11 and name HA) (resid 14 and name HD*)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 14 and name HE2)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 14 and name HG*)  0.0 0.0 3.0
assign (resid 11 and name HE) (resid 15 and name HE21)  0.0 0.0 7.0
assign (resid 11 and name HN) (resid 15 and name HE22)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 7 and name HA)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 8 and name HA)  0.0 0.0 3.0
assign (resid 12 and name HA) (resid 14 and name HN)  0.0 0.0 5.0
assign (resid 12 and name HA) (resid 15 and name HB1)  0.0 0.0 3.0
assign (resid 12 and name HA) (resid 15 and name HE21)  0.0 0.0 4.0
assign (resid 12 and name HA) (resid 15 and name HE22)  0.0 0.0 5.0
assign (resid 12 and name HA) (resid 15 and name HN)  0.0 0.0 4.0
assign (resid 12 and name HN) (resid 8 and name HA)  0.0 0.0 5.0
assign (resid 13 and name HA) (resid 16 and name HB*)  0.0 0.0 4.0
assign (resid 13 and name HN) (resid 11 and name HA)  0.0 0.0 4.0
assign (resid 13 and name HN) (resid 11 and name HN)  0.0 0.0 5.0
assign (resid 13 and name HN) (resid 15 and name HN)  0.0 0.0 5.0
assign (resid 14 and name HA) (resid 17 and name HB2)  0.0 0.0 3.0
assign (resid 14 and name HA) (resid 17 and name HG1)  0.0 0.0 5.0
assign (resid 14 and name HA) (resid 17 and name HG2)  0.0 0.0 5.0
assign (resid 14 and name HA) (resid 17 and name HN)  0.0 0.0 4.0
assign (resid 14 and name HN) (resid 11 and name HA)  0.0 0.0 3.0
assign (resid 15 and name HA) (resid 18 and name HB1)  0.0 0.0 4.0
assign (resid 15 and name HA) (resid 18 and name HB2)  0.0 0.0 3.0
assign (resid 15 and name HA) (resid 19 and name HN)  0.0 0.0 4.0
assign (resid 15 and name HE21) (resid 11 and name HA)  0.0 0.0 5.0
assign (resid 15 and name HE21) (resid 11 and name HB1)  0.0 0.0 4.0
assign (resid 15 and name HE21) (resid 12 and name HA)  0.0 0.0 5.0
assign (resid 15 and name HE22) (resid 11 and name HB1)  0.0 0.0 4.0
assign (resid 15 and name HE22) (resid 12 and name HB*)  0.0 0.0 5.0
assign (resid 15 and name HN) (resid 11 and name HB2)  0.0 0.0 5.0
assign (resid 16 and name HA) (resid 19 and name HB1)  0.0 0.0 4.0
assign (resid 16 and name HA) (resid 19 and name HB2)  0.0 0.0 3.0
assign (resid 16 and name HA) (resid 19 and name HD*)  0.0 0.0 5.0
assign (resid 16 and name HA) (resid 20 and name HB*)  0.0 0.0 5.0
assign (resid 16 and name HN) (resid 13 and name HA)  0.0 0.0 4.0
assign (resid 16 and name HN) (resid 14 and name HN)  0.0 0.0 5.0
assign (resid 16 and name HN) (resid 18 and name HB2)  0.0 0.0 5.0
assign (resid 16 and name HN) (resid 18 and name HN)  0.0 0.0 5.0
assign (resid 17 and name HA) (resid 20 and name HB*)  0.0 0.0 4.0
assign (resid 17 and name HA) (resid 20 and name HN)  0.0 0.0 4.0
assign (resid 17 and name HA) (resid 21 and name HB*)  0.0 0.0 5.0
assign (resid 17 and name HA) (resid 21 and name HN)  0.0 0.0 5.0
assign (resid 17 and name HN) (resid 13 and name HA)  0.0 0.0 5.0
assign (resid 17 and name HN) (resid 15 and name HA)  0.0 0.0 5.0
assign (resid 17 and name HN) (resid 15 and name HN)  0.0 0.0 5.0
assign (resid 17 and name HN) (resid 20 and name HB*)  0.0 0.0 6.0
assign (resid 18 and name HA) (resid 21 and name HB*)  0.0 0.0 4.0
assign (resid 18 and name HD1) (resid 21 and name HB*)  0.0 0.0 6.0
assign (resid 18 and name HD1) (resid 22 and name HB2)  0.0 0.0 6.0
assign (resid 18 and name HD1) (resid 22 and name HD21)  0.0 0.0 4.0
assign (resid 18 and name HE1) (resid 22 and name HB1)  0.0 0.0 6.0
assign (resid 18 and name HE1) (resid 22 and name HB2)  0.0 0.0 6.0
assign (resid 18 and name HE1) (resid 22 and name HD21)  0.0 0.0 4.0
assign (resid 18 and name HE3) (resid 16 and name HA)  0.0 0.0 6.0
assign (resid 18 and name HE3) (resid 21 and name HN)  0.0 0.0 5.0
assign (resid 18 and name HE3) (resid 22 and name HB2)  0.0 0.0 4.0
assign (resid 18 and name HH2) (resid 22 and name HB1)  0.0 0.0 5.0
assign (resid 18 and name HH2) (resid 22 and name HB2)  0.0 0.0 6.0
assign (resid 18 and name HH2) (resid 22 and name HD21)  0.0 0.0 6.0
assign (resid 18 and name HN) (resid 14 and name HA)  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 15 and name HA)  0.0 0.0 4.0
assign (resid 18 and name HN) (resid 16 and name HA)  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 16 and name HB*)  0.0 0.0 6.0
assign (resid 18 and name HN) (resid 20 and name HB*)  0.0 0.0 7.0
assign (resid 18 and name HN) (resid 20 and name HN)  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 21 and name HB*)  0.0 0.0 7.0
assign (resid 18 and name HN) (resid 21 and name HN)  0.0 0.0 6.0
assign (resid 18 and name HZ2) (resid 22 and name HB2)  0.0 0.0 5.0
assign (resid 18 and name HZ2) (resid 22 and name HD21)  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 22 and name HB2)  0.0 0.0 4.0
assign (resid 18 and name HZ3) (resid 22 and name HD21)  0.0 0.0 5.0
assign (resid 19 and name HA) (resid 21 and name HB*)  0.0 0.0 6.0
assign (resid 19 and name HA) (resid 22 and name HB2)  0.0 0.0 5.0
assign (resid 19 and name HN) (resid 16 and name HA)  0.0 0.0 5.0
assign (resid 19 and name HN) (resid 21 and name HN)  0.0 0.0 5.0
assign (resid 20 and name HA) (resid 22 and name HN)  0.0 0.0 5.0
assign (resid 20 and name HN) (resid 16 and name HA)  0.0 0.0 4.0
assign (resid 20 and name HN) (resid 18 and name HB2)  0.0 0.0 5.0
assign (resid 20 and name HN) (resid 22 and name HN)  0.0 0.0 5.0
assign (resid 21 and name HN) (resid 18 and name HA)  0.0 0.0 4.0
assign (resid 21 and name HN) (resid 18 and name HB1)  0.0 0.0 6.0
assign (resid 21 and name HN) (resid 18 and name HB2)  0.0 0.0 6.0
assign (resid 21 and name HN) (resid 19 and name HA)  0.0 0.0 5.0
assign (resid 21 and name HN) (resid 19 and name HB2)  0.0 0.0 6.0
assign (resid 22 and name HD21) (resid 18 and name HA)  0.0 0.0 4.0
assign (resid 22 and name HD21) (resid 19 and name HA)  0.0 0.0 5.0
assign (resid 22 and name HD21) (resid 24 and name HD2*)  0.0 0.0 7.0
assign (resid 22 and name HD22) (resid 18 and name HA)  0.0 0.0 4.0
assign (resid 22 and name HD22) (resid 18 and name HD1)  0.0 0.0 4.0
assign (resid 22 and name HD22) (resid 18 and name HE1)  0.0 0.0 4.0
assign (resid 22 and name HN) (resid 18 and name HA)  0.0 0.0 5.0
assign (resid 22 and name HN) (resid 18 and name HB2)  0.0 0.0 7.0
assign (resid 22 and name HN) (resid 19 and name HA)  0.0 0.0 4.0
assign (resid 22 and name HN) (resid 20 and name HB*)  0.0 0.0 6.0
assign (resid 23 and name HD1) (resid 20 and name HB*)  0.0 0.0 5.0
assign (resid 23 and name HD1) (resid 21 and name HA)  0.0 0.0 6.0
assign (resid 23 and name HD1) (resid 21 and name HB*)  0.0 0.0 6.0
assign (resid 23 and name HD1) (resid 25 and name HB*)  0.0 0.0 6.0
assign (resid 23 and name HD1) (resid 25 and name HD1*)  0.0 0.0 7.0
assign (resid 24 and name HA) (resid 26 and name HG1*)  0.0 0.0 5.0
assign (resid 24 and name HA) (resid 28 and name HA)  0.0 0.0 5.0
assign (resid 25 and name HN) (resid 22 and name HB2)  0.0 0.0 5.0
assign (resid 26 and name HA) (resid 30 and name HB*)  0.0 0.0 5.0
assign (resid 26 and name HN) (resid 23 and name HA)  0.0 0.0 5.0
assign (resid 28 and name HA) (resid 31 and name HG*)  0.0 0.0 5.0
assign (resid 3 and name HA) (resid 6 and name HB1)  0.0 0.0 5.0
assign (resid 3 and name HA) (resid 6 and name HB2)  0.0 0.0 4.0
assign (resid 3 and name HA) (resid 6 and name HD1)  0.0 0.0 6.0
assign (resid 3 and name HA) (resid 6 and name HN)  0.0 0.0 4.0
assign (resid 3 and name HN) (resid 5 and name HN)  0.0 0.0 5.0
assign (resid 31 and name HN) (resid 29 and name HB*)  0.0 0.0 5.0
assign (resid 4 and name HA) (resid 6 and name HN)  0.0 0.0 5.0
assign (resid 4 and name HA) (resid 7 and name HB*)  0.0 0.0 4.0
assign (resid 4 and name HA) (resid 7 and name HN)  0.0 0.0 4.0
assign (resid 4 and name HN) (resid 2 and name HA)  0.0 0.0 5.0
assign (resid 4 and name HN) (resid 2 and name HB1)  0.0 0.0 4.0
assign (resid 4 and name HN) (resid 2 and name HB2)  0.0 0.0 5.0
assign (resid 5 and name HA) (resid 8 and name HB1)  0.0 0.0 4.0
assign (resid 5 and name HA) (resid 8 and name HB2)  0.0 0.0 3.0
assign (resid 5 and name HA) (resid 8 and name HD1)  0.0 0.0 6.0
assign (resid 5 and name HA) (resid 8 and name HD2)  0.0 0.0 6.0
assign (resid 5 and name HA) (resid 8 and name HG2)  0.0 0.0 5.0
assign (resid 5 and name HN) (resid 2 and name HA)  0.0 0.0 6.0
assign (resid 5 and name HN) (resid 2 and name HB1)  0.0 0.0 6.0
assign (resid 5 and name HN) (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 5 and name HN) (resid 7 and name HN)  0.0 0.0 5.0
assign (resid 6 and name HA) (resid 9 and name HB*)  0.0 0.0 5.0
assign (resid 6 and name HA) (resid 9 and name HG1)  0.0 0.0 4.0
assign (resid 6 and name HA) (resid 9 and name HG2)  0.0 0.0 5.0
assign (resid 6 and name HA) (resid 9 and name HN)  0.0 0.0 4.0
assign (resid 6 and name HE) (resid 3 and name HA)  0.0 0.0 5.0
assign (resid 7 and name HA) (resid 10 and name HD1)  0.0 0.0 5.0
assign (resid 7 and name HA) (resid 11 and name HG2)  0.0 0.0 5.0
assign (resid 7 and name HA) (resid 9 and name HN)  0.0 0.0 5.0
assign (resid 7 and name HD1) (resid 11 and name HG2)  0.0 0.0 5.0
assign (resid 7 and name HE) (resid 11 and name HB2)  0.0 0.0 6.0
assign (resid 7 and name HE) (resid 11 and name HD1)  0.0 0.0 5.0
assign (resid 7 and name HE) (resid 11 and name HG2)  0.0 0.0 4.0
assign (resid 7 and name HE) (resid 4 and name HE22)  0.0 0.0 7.0
assign (resid 7 and name HN) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 7 and name HN) (resid 4 and name HA)  0.0 0.0 3.0
assign (resid 7 and name HN) (resid 9 and name HN)  0.0 0.0 5.0
assign (resid 8 and name HE) (resid 4 and name HE21)  0.0 0.0 4.0
assign (resid 8 and name HE) (resid 4 and name HG1)  0.0 0.0 4.0
assign (resid 8 and name HE) (resid 4 and name HG2)  0.0 0.0 6.0
assign (resid 8 and name HE) (resid 5 and name HA)  0.0 0.0 5.0
assign (resid 8 and name HE) (resid 5 and name HG2*)  0.0 0.0 7.0
assign (resid 8 and name HN) (resid 11 and name HG2)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 4 and name HA)  0.0 0.0 3.0
assign (resid 8 and name HN) (resid 4 and name HG2)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 5 and name HA)  0.0 0.0 4.0
assign (resid 8 and name HN) (resid 5 and name HG2*)  0.0 0.0 6.0
assign (resid 8 and name HN) (resid 6 and name HN)  0.0 0.0 5.0
assign (resid 9 and name HA) (resid 12 and name HB*)  0.0 0.0 4.0
assign (resid 9 and name HA) (resid 12 and name HN)  0.0 0.0 4.0
assign (resid 15 and name HB2) (resid 12 and name HB*)  0.0 0.0 6.0
assign (resid 19 and name HE*) (resid 15 and name HB1)  0.0 0.0 5.0
assign (resid 35 and name HD*) (resid 33 and name HB)  0.0 0.0 5.0
assign (resid 36 and name HG*) (resid 33 and name HG2*)  0.0 0.0 6.0
assign (resid 5 and name HG2*) (resid 8 and name HB2)  0.0 0.0 5.0
assign (resid 9 and name HB*) (resid 6 and name HB2)  0.0 0.0 6.0
assign (resid 9 and name HB*) (resid 6 and name HG*)  0.0 0.0 6.0
assign (resid 11 and name HB1) (resid 14 and name HB*)  0.0 0.0 3.0
assign (resid 14 and name HG*) (resid 11 and name HD2)  0.0 0.0 3.0
assign (resid 7 and name HG*) (resid 11 and name HE)  0.0 0.0 4.0
assign (resid 7 and name HG*) (resid 11 and name HN)  0.0 0.0 5.0
assign (resid 10 and name HB2) (resid 7 and name HG*)  0.0 0.0 5.0
assign (resid 10 and name HD2) (resid 7 and name HB2)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 8 and name HA)  0.0 0.0 5.0
assign (resid 10 and name HN) (resid 8 and name HB1)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 13 and name HB*)  0.0 0.0 5.0
assign (resid 11 and name HA) (resid 14 and name HA)  0.0 0.0 5.0
assign (resid 11 and name HB1) (resid 14 and name HG*)  0.0 0.0 5.0
assign (resid 11 and name HB1) (resid 14 and name HN)  0.0 0.0 4.0
assign (resid 11 and name HB1) (resid 15 and name HN)  0.0 0.0 4.0
assign (resid 11 and name HB1) (resid 8 and name HD1)  0.0 0.0 5.0
assign (resid 11 and name HB2) (resid 14 and name HN)  0.0 0.0 5.0
assign (resid 11 and name HB2) (resid 15 and name HE21)  0.0 0.0 5.0
assign (resid 11 and name HB2) (resid 15 and name HE22)  0.0 0.0 6.0
assign (resid 11 and name HB2) (resid 8 and name HB1)  0.0 0.0 5.0
assign (resid 11 and name HB2) (resid 8 and name HG2)  0.0 0.0 5.0
assign (resid 11 and name HB2) (resid 9 and name HN)  0.0 0.0 5.0
assign (resid 11 and name HD1) (resid 14 and name HD1)  0.0 0.0 5.0
assign (resid 11 and name HD1) (resid 14 and name HD2)  0.0 0.0 5.0
assign (resid 11 and name HD1) (resid 14 and name HE1)  0.0 0.0 5.0
assign (resid 11 and name HD2) (resid 14 and name HD2)  0.0 0.0 5.0
assign (resid 11 and name HG1) (resid 7 and name HD2)  0.0 0.0 5.0
assign (resid 11 and name HG1) (resid 7 and name HG*)  0.0 0.0 4.0
assign (resid 11 and name HG1) (resid 8 and name HG1)  0.0 0.0 6.0
assign (resid 11 and name HG2) (resid 14 and name HG*)  0.0 0.0 5.0
assign (resid 11 and name HG2) (resid 7 and name HD2)  0.0 0.0 5.0
assign (resid 11 and name HG2) (resid 7 and name HG*)  0.0 0.0 4.0
assign (resid 11 and name HG2) (resid 9 and name HN)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 14 and name HB*)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 8 and name HB1)  0.0 0.0 5.0
assign (resid 11 and name HN) (resid 9 and name HA)  0.0 0.0 4.0
assign (resid 11 and name HN) (resid 9 and name HB*)  0.0 0.0 5.0
assign (resid 5 and name HN) (resid 8 and name HN)  0.0 0.0 5.0
assign (resid 6 and name HA) (resid 8 and name HB1)  0.0 0.0 5.0
assign (resid 6 and name HB1) (resid 10 and name HD1)  0.0 0.0 6.0
assign (resid 6 and name HB2) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 6 and name HB2) (resid 8 and name HN)  0.0 0.0 5.0
assign (resid 6 and name HD2) (resid 3 and name HA)  0.0 0.0 5.0
assign (resid 6 and name HE) (resid 3 and name HA)  0.0 0.0 3.0
assign (resid 6 and name HE) (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 6 and name HN) (resid 8 and name HB1)  0.0 0.0 6.0
assign (resid 6 and name HN) (resid 9 and name HN)  0.0 0.0 6.0
assign (resid 7 and name HA) (resid 10 and name HB1)  0.0 0.0 4.0
assign (resid 7 and name HA) (resid 10 and name HB2)  0.0 0.0 3.0
assign (resid 7 and name HA) (resid 10 and name HD2)  0.0 0.0 4.0
assign (resid 7 and name HA) (resid 10 and name HG1)  0.0 0.0 5.0
assign (resid 7 and name HA) (resid 10 and name HG2)  0.0 0.0 5.0
assign (resid 7 and name HA) (resid 4 and name HA)  0.0 0.0 6.0
assign (resid 7 and name HB1) (resid 11 and name HG*)  0.0 0.0 6.0
assign (resid 7 and name HB1) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 7 and name HB1) (resid 4 and name HA)  0.0 0.0 3.0
assign (resid 7 and name HB1) (resid 4 and name HG1)  0.0 0.0 5.0
assign (resid 7 and name HB1) (resid 4 and name HG2)  0.0 0.0 5.0
assign (resid 7 and name HB2) (resid 10 and name HB2)  0.0 0.0 5.0
assign (resid 7 and name HB2) (resid 10 and name HD1)  0.0 0.0 5.0
assign (resid 7 and name HB2) (resid 3 and name HA)  0.0 0.0 5.0
assign (resid 7 and name HB2) (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 7 and name HB2) (resid 4 and name HA)  0.0 0.0 4.0
assign (resid 7 and name HD2) (resid 11 and name HE)  0.0 0.0 5.0
assign (resid 7 and name HE) (resid 11 and name HD2)  0.0 0.0 4.0
assign (resid 7 and name HE) (resid 11 and name HE)  0.0 0.0 4.0
assign (resid 7 and name HE) (resid 11 and name HG*)  0.0 0.0 4.0
assign (resid 7 and name HG*) (resid 10 and name HB1)  0.0 0.0 4.0
assign (resid 7 and name HG*) (resid 10 and name HD1)  0.0 0.0 5.0
assign (resid 7 and name HG*) (resid 10 and name HD1)  0.0 0.0 5.0
assign (resid 7 and name HG*) (resid 10 and name HD2)  0.0 0.0 6.0
assign (resid 7 and name HG*) (resid 11 and name HB1)  0.0 0.0 5.0
assign (resid 7 and name HG*) (resid 11 and name HB2)  0.0 0.0 5.0
assign (resid 7 and name HG*) (resid 11 and name HD1)  0.0 0.0 6.0
assign (resid 7 and name HG*) (resid 11 and name HD2)  0.0 0.0 5.0
assign (resid 7 and name HG*) (resid 11 and name HG*)  0.0 0.0 4.0
assign (resid 7 and name HG*) (resid 4 and name HA)  0.0 0.0 6.0
assign (resid 7 and name HN) (resid 10 and name HB2)  0.0 0.0 6.0
assign (resid 8 and name HA) (resid 11 and name HA)  0.0 0.0 5.0
assign (resid 8 and name HA) (resid 11 and name HB1)  0.0 0.0 4.0
assign (resid 8 and name HA) (resid 11 and name HB2)  0.0 0.0 3.0
assign (resid 8 and name HD1) (resid 11 and name HG*)  0.0 0.0 5.0
assign (resid 8 and name HD2) (resid 11 and name HB1)  0.0 0.0 5.0
assign (resid 8 and name HD2) (resid 11 and name HG*)  0.0 0.0 5.0
assign (resid 8 and name HE) (resid 5 and name HG2*)  0.0 0.0 5.0
assign (resid 8 and name HG1) (resid 11 and name HN)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 10 and name HB2)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 11 and name HG*)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 11 and name HN)  0.0 0.0 5.0
assign (resid 8 and name HN) (resid 4 and name HG2)  0.0 0.0 6.0

! protein long range interresidue (|i - j| > 4) NOEs

assign (resid 15 and name HE21) (resid 8 and name HA)  0.0 0.0 5.0
assign (resid 15 and name HE22) (resid 8 and name HA)  0.0 0.0 4.0
assign (resid 15 and name HE22) (resid 8 and name HD1)  0.0 0.0 5.0
assign (resid 15 and name HE22) (resid 8 and name HG1)  0.0 0.0 4.0
assign (resid 15 and name HE22) (resid 8 and name HG2)  0.0 0.0 5.0
assign (resid 18 and name HD1) (resid 24 and name HD2*)  0.0 0.0 7.0
assign (resid 18 and name HE1) (resid 24 and name HD2*)  0.0 0.0 5.0
assign (resid 18 and name HE1) (resid 26 and name HG*)  0.0 0.0 6.0
assign (resid 18 and name HE3) (resid 24 and name HD2*)  0.0 0.0 6.0
assign (resid 18 and name HE3) (resid 26 and name HG1*)  0.0 0.0 6.0
assign (resid 18 and name HE3) (resid 26 and name HG2*)  0.0 0.0 6.0
assign (resid 18 and name HH2) (resid 24 and name HD2*)  0.0 0.0 5.0
assign (resid 18 and name HH2) (resid 26 and name HG1*)  0.0 0.0 5.0
assign (resid 18 and name HH2) (resid 26 and name HG2*)  0.0 0.0 5.0
assign (resid 18 and name HZ2) (resid 24 and name HD2*)  0.0 0.0 4.0
assign (resid 18 and name HZ2) (resid 26 and name HG2*)  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 24 and name HD2*)  0.0 0.0 6.0
assign (resid 18 and name HZ3) (resid 26 and name HG1*)  0.0 0.0 5.0
assign (resid 8 and name HG1) (resid 15 and name HE21)  0.0 0.0 5.0

! RNA-protein NOEs

assign (resid 6 and name H1) (resid 4 and name HE21)  0.0 0.0 4.0
assign (resid 6 and name H1) (resid 4 and name HG2)  0.0 0.0 5.0
assign (resid 6 and name H1) (resid 4 and name HE22)  0.0 0.0 4.0
assign (resid 18 and name HE1) (resid 7 and name H8)  0.0 0.0 4.0
assign (resid 18 and name HE1) (resid 7 and name H2)  0.0 0.0 7.0
assign (resid 18 and name HE1) (resid 7 and name H1')  0.0 0.0 5.0
assign (resid 18 and name HE1) (resid 7 and name H5')  0.0 0.0 6.0
assign (resid 3 and name H41) (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 2 and name H41) (resid 3 and name HB*)  0.0 0.0 7.0
assign (resid 7 and name HE) (resid 11 and name H62)  0.0 0.0 7.0
assign (resid 7 and name HE) (resid 4 and name H3')  0.0 0.0 4.0
assign (resid 4 and name H41) (resid 4 and name HA)  0.0 0.0 5.0
assign (resid 4 and name H41) (resid 4 and name HB1)  0.0 0.0 5.0
assign (resid 4 and name HE21) (resid 4 and name H42)  0.0 0.0 6.0
assign (resid 11 and name HE) (resid 4 and name H6)  0.0 0.0 7.0
assign (resid 17 and name HN) (resid 7 and name H5'')  0.0 0.0 6.0
assign (resid 2 and name H6) (resid 3 and name HB*)  0.0 0.0 4.0
assign (resid 15 and name HE21) (resid 7 and name H3')  0.0 0.0 7.0
assign (resid 15 and name HE21) (resid 8 and name H5')  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 7 and name H1')  0.0 0.0 6.0
assign (resid 18 and name HN) (resid 7 and name H4')  0.0 0.0 5.0
assign (resid 18 and name HN) (resid 7 and name H5')  0.0 0.0 5.0
assign (resid 8 and name H8) (resid 18 and name HB2)  0.0 0.0 7.0
assign (resid 8 and name H8) (resid 11 and name HB2)  0.0 0.0 7.0
assign (resid 15 and name HN) (resid 7 and name H1')  0.0 0.0 6.0
assign (resid 15 and name HN) (resid 8 and name H5'')  0.0 0.0 7.0
assign (resid 15 and name HN) (resid 7 and name H5'')  0.0 0.0 5.0
assign (resid 15 and name HN) (resid 7 and name H4')  0.0 0.0 5.0
assign (resid 6 and name H8) (resid 11 and name HD1)  0.0 0.0 7.0
assign (resid 6 and name H8) (resid 11 and name HD2)  0.0 0.0 6.0
assign (resid 6 and name H8) (resid 14 and name HD*)  0.0 0.0 7.0
assign (resid 7 and name H8) (resid 18 and name HZ3)  0.0 0.0 7.0
assign (resid 7 and name H8) (resid 18 and name HD1)  0.0 0.0 4.0
assign (resid 7 and name H8) (resid 18 and name HH2)  0.0 0.0 7.0
assign (resid 7 and name H8) (resid 18 and name HE3)  0.0 0.0 6.0
assign (resid 7 and name H8) (resid 18 and name HZ2)  0.0 0.0 5.0
assign (resid 7 and name H8) (resid 18 and name HA)  0.0 0.0 6.0
assign (resid 7 and name H8) (resid 18 and name HB1)  0.0 0.0 5.0
assign (resid 7 and name H8) (resid 18 and name HB2)  0.0 0.0 5.0
assign (resid 2 and name H42) (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 4 and name HE22) (resid 8 and name H3')  0.0 0.0 7.0
assign (resid 4 and name HE22) (resid 10 and name H5')  0.0 0.0 7.0
assign (resid 7 and name H2) (resid 18 and name HH2)  0.0 0.0 4.0
assign (resid 7 and name H2) (resid 18 and name HE3)  0.0 0.0 6.0
assign (resid 7 and name H2) (resid 18 and name HZ2)  0.0 0.0 6.0
assign (resid 7 and name H2) (resid 15 and name HG1)  0.0 0.0 7.0
assign (resid 7 and name H2) (resid 19 and name HG*)  0.0 0.0 7.0
assign (resid 5 and name H6) (resid 7 and name HE)  0.0 0.0 4.0
assign (resid 3 and name H42) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 15 and name HE22) (resid 8 and name H5'')  0.0 0.0 5.0
assign (resid 15 and name HE22) (resid 8 and name H5')  0.0 0.0 5.0
assign (resid 18 and name HZ3) (resid 8 and name H1')  0.0 0.0 7.0
assign (resid 18 and name HZ3) (resid 7 and name H1')  0.0 0.0 4.0
assign (resid 18 and name HZ3) (resid 7 and name H2')  0.0 0.0 6.0
assign (resid 3 and name H6) (resid 3 and name HA)  0.0 0.0 5.0
assign (resid 3 and name H6) (resid 3 and name HB*)  0.0 0.0 3.0
assign (resid 18 and name HD1) (resid 7 and name H1')  0.0 0.0 4.0
assign (resid 18 and name HD1) (resid 15 and name HA)  0.0 0.0 6.0
assign (resid 18 and name HD1) (resid 7 and name H3')  0.0 0.0 6.0
assign (resid 18 and name HD1) (resid 7 and name H5'')  0.0 0.0 6.0
assign (resid 18 and name HD1) (resid 7 and name H4')  0.0 0.0 5.0
assign (resid 18 and name HD1) (resid 7 and name H5')  0.0 0.0 4.0
assign (resid 19 and name HZ*) (resid 8 and name H4')  0.0 0.0 6.0
assign (resid 18 and name HD1) (resid 6 and name H2')  0.0 0.0 6.0
assign (resid 18 and name HH2) (resid 7 and name H1')  0.0 0.0 5.0
assign (resid 18 and name HH2) (resid 7 and name H2')  0.0 0.0 6.0
assign (resid 18 and name HE3) (resid 7 and name H1')  0.0 0.0 5.0
assign (resid 18 and name HZ2) (resid 7 and name H1')  0.0 0.0 5.0
assign (resid 18 and name HZ2) (resid 7 and name H2')  0.0 0.0 7.0
assign (resid 2 and name H1') (resid 3 and name HB*)  2.0 0.0 6.0
assign (resid 8 and name H1') (resid 18 and name HZ2)  2.0 0.0 7.0
assign (resid 8 and name H1') (resid 15 and name HG1)  0.0 0.0 7.0
assign (resid 2 and name H5) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 3 and name H1') (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 4 and name H5) (resid 7 and name HE)  0.0 0.0 5.0
assign (resid 4 and name H5) (resid 7 and name HD1)  0.0 0.0 4.0
assign (resid 4 and name H5) (resid 7 and name HD2)  0.0 0.0 4.0
assign (resid 4 and name H5) (resid 3 and name HB*)  0.0 0.0 5.0
assign (resid 3 and name H5) (resid 3 and name HA)  0.0 0.0 5.0
assign (resid 3 and name H5) (resid 3 and name HB*)  0.0 0.0 3.0
assign (resid 2 and name H2') (resid 3 and name HB*)  0.0 0.0 4.0
assign (resid 3 and name H4') (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 8 and name H4') (resid 8 and name HD1)  0.0 0.0 4.0
assign (resid 8 and name H4') (resid 8 and name HD2)  0.0 0.0 6.0
assign (resid 8 and name H4') (resid 15 and name HB1)  0.0 0.0 6.0
assign (resid 8 and name H4') (resid 8 and name HG1)  0.0 0.0 6.0
assign (resid 8 and name H4') (resid 8 and name HG2)  0.0 0.0 6.0
assign (resid 8 and name H4') (resid 15 and name HE21)  0.0 0.0 7.0
assign (resid 8 and name H4') (resid 15 and name HE22)  0.0 0.0 7.0
assign (resid 4 and name H3') (resid 7 and name HD2)  0.0 0.0 4.0
assign (resid 5 and name H5) (resid 7 and name HD1)  0.0 0.0 5.0
assign (resid 5 and name H5) (resid 7 and name HD2)  0.0 0.0 5.0
assign (resid 5 and name H5) (resid 7 and name HE)  0.0 0.0 3.0
assign (resid 2 and name H3') (resid 3 and name HB*)  0.0 0.0 4.0
assign (resid 9 and name H5') (resid 8 and name HD1)  0.0 0.0 6.0
assign (resid 7 and name H1') (resid 19 and name HN)  0.0 0.0 5.0
assign (resid 7 and name H1') (resid 18 and name HB1)  0.0 0.0 4.0
assign (resid 7 and name H1') (resid 18 and name HB2)  0.0 0.0 3.0
assign (resid 7 and name H1') (resid 19 and name HE*)  0.0 0.0 6.0
assign (resid 7 and name H1') (resid 15 and name HG1)  0.0 0.0 4.0
assign (resid 7 and name H1') (resid 15 and name HB2)  0.0 0.0 7.0
assign (resid 7 and name H1') (resid 15 and name HB1)  0.0 0.0 6.0
assign (resid 7 and name H1') (resid 19 and name HB2)  0.0 0.0 6.0
assign (resid 7 and name H1') (resid 19 and name HB1)  0.0 0.0 7.0
assign (resid 8 and name H5'') (resid 15 and name HG1)  0.0 0.0 4.0
assign (resid 8 and name H5') (resid 15 and name HG1)  0.0 0.0 5.0
assign (resid 8 and name H5') (resid 8 and name HG2)  0.0 0.0 6.0
assign (resid 8 and name H5'') (resid 8 and name HG2)  0.0 0.0 5.0
assign (resid 8 and name H5') (resid 8 and name HG1)  0.0 0.0 5.0
assign (resid 8 and name H5'') (resid 8 and name HG1)  0.0 0.0 5.0
assign (resid 8 and name H5') (resid 8 and name HD1)  0.0 0.0 4.0
assign (resid 8 and name H5'') (resid 8 and name HD1)  0.0 0.0 3.0
assign (resid 8 and name H5'') (resid 15 and name HE21)  0.0 0.0 5.0
assign (resid 3 and name H5') (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 3 and name H5'') (resid 3 and name HB*)  0.0 0.0 6.0
assign (resid 7 and name H5') (resid 15 and name HE21)  0.0 0.0 6.0
assign (resid 7 and name H5'') (resid 15 and name HE21)  0.0 0.0 6.0
assign (resid 7 and name H5') (resid 18 and name HB2)  0.0 0.0 4.0
assign (resid 7 and name H5'') (resid 18 and name HB2)  0.0 0.0 5.0
assign (resid 7 and name H5'') (resid 14 and name HB*)  0.0 0.0 4.0
assign (resid 7 and name H5') (resid 14 and name HB*)  0.0 0.0 4.0
assign (resid 7 and name H5') (resid 14 and name HG*)  0.0 0.0 5.0
assign (resid 7 and name H5'') (resid 14 and name HG*)  0.0 0.0 5.0
assign (resid 7 and name H5') (resid 14 and name HD*)  0.0 0.0 5.0
assign (resid 7 and name H5'') (resid 14 and name HD*)  0.0 0.0 5.0
assign (resid 14 and name HA) (resid 7 and name H5')  0.0 0.0 5.0
assign (resid 3 and name HA) (resid 2 and name H2')  0.0 0.0 5.0
assign (resid 3 and name HA) (resid 2 and name H3')  0.0 0.0 4.0
assign (resid 18 and name HA) (resid 7 and name H1')  0.0 0.0 6.0
assign (resid 7 and name H4') (resid 17 and name HN)  0.0 0.0 6.0
assign (resid 7 and name H4') (resid 15 and name HE21)  0.0 0.0 6.0
assign (resid 7 and name H4') (resid 14 and name HN)  0.0 0.0 7.0
assign (resid 7 and name H4') (resid 18 and name HZ3)  0.0 0.0 7.0
assign (resid 7 and name H4') (resid 19 and name HA)  0.0 0.0 7.0
assign (resid 7 and name H4') (resid 18 and name HB1)  0.0 0.0 3.0
assign (resid 7 and name H4') (resid 18 and name HB2)  0.0 0.0 3.0
assign (resid 7 and name H4') (resid 15 and name HG1)  0.0 0.0 4.0
assign (resid 7 and name H4') (resid 15 and name HB1)  0.0 0.0 5.0
assign (resid 7 and name H4') (resid 15 and name HB2)  0.0 0.0 5.0
assign (resid 7 and name H4') (resid 15 and name HG2)  0.0 0.0 5.0
assign (resid 7 and name H4') (resid 14 and name HD*)  0.0 0.0 7.0
assign (resid 5 and name H6) (resid 7 and name HE)  0.0 0.0 4.0
assign (resid 4 and name H6) (resid 7 and name HD2)  0.0 0.0 4.0
assign (resid 3 and name H3') (resid 7 and name HD2)  0.0 0.0 4.0
assign (resid 7 and name HE) (resid 6 and name H8)  0.0 0.0 6.0
assign (resid 7 and name HE) (resid 5 and name H5)  0.0 0.0 3.0
assign (resid 7 and name HE) (resid 5 and name H3')  0.0 0.0 6.0
assign (resid 7 and name HE) (resid 5 and name H2')  0.0 0.0 6.0
assign (resid 7 and name HE) (resid 4 and name H6)  0.0 0.0 5.0
assign (resid 7 and name HE) (resid 4 and name H3')  0.0 0.0 4.0
assign (resid 7 and name HB1) (resid 3 and name H5'')  0.0 0.0 5.0
assign (resid 7 and name HB1) (resid 3 and name H5')  0.0 0.0 6.0
assign (resid 7 and name HB1) (resid 3 and name H5)  0.0 0.0 6.0
assign (resid 7 and name HB1) (resid 3 and name H3')  0.0 0.0 6.0
assign (resid 7 and name HB1) (resid 4 and name H6)  0.0 0.0 6.0
assign (resid 7 and name HG*) (resid 3 and name H3')  0.0 0.0 5.0
assign (resid 7 and name HG*) (resid 4 and name H5)  0.0 0.0 6.0
assign (resid 7 and name HG*) (resid 4 and name H3')  0.0 0.0 6.0
assign (resid 7 and name HG*) (resid 5 and name H5)  0.0 0.0 5.0
assign (resid 7 and name HD2) (resid 3 and name H5'')  0.0 0.0 5.0
assign (resid 7 and name HD2) (resid 4 and name H2')  0.0 0.0 5.0
assign (resid 7 and name HD2) (resid 4 and name H5'')  0.0 0.0 6.0
assign (resid 8 and name HE) (resid 8 and name H3')  0.0 0.0 5.0
assign (resid 8 and name HD1) (resid 8 and name H5')  0.0 0.0 5.0
assign (resid 8 and name HD1) (resid 8 and name H3')  0.0 0.0 5.0
assign (resid 11 and name HB1) (resid 7 and name H5'')  0.0 0.0 6.0
assign (resid 15 and name HA) (resid 7 and name H4')  0.0 0.0 3.0
assign (resid 15 and name HA) (resid 7 and name H5')  0.0 0.0 4.0
assign (resid 11 and name HB1) (resid 7 and name H3')  0.0 0.0 6.0

!hydrogen bonds restraints

assign (resid 1 and name H1 and segid "boxb") (resid 15 and name N3 and segid "boxb") 2 0.1 0.1
assign (resid 1 and name N1 and segid "boxb") (resid 15 and name N3 and segid "boxb") 3 0.1 0.1

assign (resid 1 and name H21 and segid "boxb") (resid 15 and name O2 and segid "boxb") 2 0.1 0.1
assign (resid 1 and name N2 and segid "boxb") (resid 15 and name O2 and segid "boxb") 3 0.1 0.1

assign (resid 11 and name H61 and segid "boxb") (resid 5 and name O4 and segid "boxb") 2 0.1 0.1
assign (resid 11 and name N6 and segid "boxb") (resid 5 and name O4 and segid "boxb") 3 0.1 0.1

assign (resid 12 and name H1 and segid "boxb") (resid 4 and name N3 and segid "boxb") 2 0.1 0.1
assign (resid 12 and name N1 and segid "boxb") (resid 4 and name N3 and segid "boxb") 3 0.1 0.1

assign (resid 12 and name H21 and segid "boxb") (resid 4 and name O2 and segid "boxb") 2 0.1 0.1
assign (resid 12 and name N2 and segid "boxb") (resid 4 and name O2 and segid "boxb") 3 0.1 0.1

assign (resid 13 and name H1 and segid "boxb") (resid 3 and name N3 and segid "boxb") 2 0.1 0.1
assign (resid 13 and name N1 and segid "boxb") (resid 3 and name N3 and segid "boxb") 3 0.1 0.1

assign (resid 13 and name H21 and segid "boxb") (resid 3 and name O2 and segid "boxb") 2 0.1 0.1
assign (resid 13 and name N2 and segid "boxb") (resid 3 and name O2 and segid "boxb") 3 0.1 0.1

assign (resid 14 and name H1 and segid "boxb") (resid 2 and name N3 and segid "boxb") 2 0.1 0.1
assign (resid 14 and name N1 and segid "boxb") (resid 2 and name N3 and segid "boxb") 3 0.1 0.1

assign (resid 14 and name H21 and segid "boxb") (resid 2 and name O2 and segid "boxb") 2 0.1 0.1
assign (resid 14 and name N2 and segid "boxb") (resid 2 and name O2 and segid "boxb") 3 0.1 0.1

assign (resid 15 and name H41 and segid "boxb") (resid 1 and name O6 and segid "boxb") 2 0.1 0.1
assign (resid 15 and name N4 and segid "boxb") (resid 1 and name O6 and segid "boxb") 3 0.1 0.1

assign (resid 2 and name H41 and segid "boxb") (resid 14 and name O6 and segid "boxb") 2 0.1 0.1
assign (resid 2 and name N4 and segid "boxb") (resid 14 and name O6 and segid "boxb") 3 0.1 0.1

assign (resid 3 and name H41 and segid "boxb") (resid 13 and name O6 and segid "boxb") 2 0.1 0.1
assign (resid 3 and name N4 and segid "boxb") (resid 13 and name O6 and segid "boxb") 3 0.1 0.1

assign (resid 4 and name H41 and segid "boxb") (resid 12 and name O6 and segid "boxb") 2 0.1 0.1
assign (resid 4 and name N4 and segid "boxb") (resid 12 and name O6 and segid "boxb") 3 0.1 0.1

assign (resid 5 and name H3 and segid "boxb") (resid 11 and name N1 and segid "boxb") 2 0.1 0.1
assign (resid 5 and name N3 and segid "boxb") (resid 11 and name N1 and segid "boxb") 3 0.1 0.1

assign (resid 6 and name H22 and segid "boxb") (resid 10 and name N7 and segid "boxb") 2 0.1 0.1
assign (resid 6 and name N2 and segid "boxb") (resid 10 and name N7 and segid "boxb") 3 0.1 0.1

assign (resid 6 and name H21 and segid "boxb") (resid 10 and name O1P and segid "boxb") 2 0.1 0.1
assign (resid 6 and name N2 and segid "boxb") (resid 10 and name O1P and segid "boxb") 3 0.1 0.1

!phi-angle restraints

assign (resid 3 and name c ) (resid 4 and name n)
       (resid 4 and name ca) (resid 4 and name c) 20 -60  20   2

assign (resid 4 and name c ) (resid 5 and name n)
       (resid 5 and name ca) (resid 5 and name c) 20 -60  20   2

assign (resid 8 and name c ) (resid 9 and name n)
       (resid 9 and name ca) (resid 9 and name c) 20 -60  20   2

assign (resid 9 and name c ) (resid 10 and name n)
       (resid 10 and name ca) (resid 10 and name c) 20 -60  20   2

assign (resid 12 and name c ) (resid 13 and name n)
       (resid 13 and name ca) (resid 13 and name c) 20 -60  20   2

assign (resid 13 and name c ) (resid 14 and name n)
       (resid 14 and name ca) (resid 14 and name c) 20 -60  20   2

assign (resid 14 and name c ) (resid 15 and name n)
       (resid 15 and name ca) (resid 15 and name c) 20 -60  20   2

assign (resid 15 and name c ) (resid 16 and name n)
       (resid 16 and name ca) (resid 16 and name c) 20 -60  20   2

assign (resid 16 and name c ) (resid 17 and name n)
       (resid 17 and name ca) (resid 17 and name c) 20 -60  20   2

assign (resid 17 and name c ) (resid 18 and name n)
       (resid 18 and name ca) (resid 18 and name c) 20 -60  20   2

assign (resid 19 and name c ) (resid 20 and name n)
       (resid 20 and name ca) (resid 20 and name c) 20 -60  20   2


!sugar pucker restraints

assign  (resid 1 and name C4') (resid 1 and name O4')
        (resid 1 and name C1') (resid 1 and name C2') 50.0    0.0  11.5  2 

assign  (resid 1 and name O4') (resid 1 and name C1')
        (resid 1 and name C2') (resid 1 and name C3') 50.0  350.5   9.5  2 

assign  (resid 1 and name C1') (resid 1 and name C2')
        (resid 1 and name C3') (resid 1 and name C4') 50.0   35.5   3.6  2 
assign  (resid 1 and name C2') (resid 1 and name C3')
        (resid 1 and name C4') (resid 1 and name O4') 50.0  324.7   3.7  2 

assign  (resid 1 and name C3') (resid 1 and name C4')
        (resid 1 and name O4') (resid 1 and name C1') 50.0   21.6   9.5  2 
assign  (resid 1 and name C5') (resid 1 and name C4')
        (resid 1 and name C3') (resid 1 and name O3') 50.0    84.7  3.7  2 
assign  (resid 2 and name C4') (resid 2 and name O4')
        (resid 2 and name C1') (resid 2 and name C2') 50.0    0.0  11.5  2 

assign  (resid 2 and name O4') (resid 2 and name C1')
        (resid 2 and name C2') (resid 2 and name C3') 50.0  350.5   9.5  2 

assign  (resid 2 and name C1') (resid 2 and name C2')
        (resid 2 and name C3') (resid 2 and name C4') 50.0   35.5   3.6  2 
assign  (resid 2 and name C2') (resid 2 and name C3')
        (resid 2 and name C4') (resid 2 and name O4') 50.0  324.7   3.7  2 

assign  (resid 2 and name C3') (resid 2 and name C4')
        (resid 2 and name O4') (resid 2 and name C1') 50.0   21.6   9.5  2 
assign  (resid 2 and name C5') (resid 2 and name C4')
        (resid 2 and name C3') (resid 2 and name O3') 50.0    84.7  3.7  2 
assign  (resid 3 and name C4') (resid 3 and name O4')
        (resid 3 and name C1') (resid 3 and name C2') 50.0    0.0  11.5  2 
assign  (resid 3 and name O4') (resid 3 and name C1')
        (resid 3 and name C2') (resid 3 and name C3') 50.0  350.5   9.5  2 

assign  (resid 3 and name C1') (resid 3 and name C2')
        (resid 3 and name C3') (resid 3 and name C4') 50.0   35.5   3.6  2 
assign  (resid 3 and name C2') (resid 3 and name C3')
        (resid 3 and name C4') (resid 3 and name O4') 50.0  324.7   3.7  2 

assign  (resid 3 and name C3') (resid 3 and name C4')
        (resid 3 and name O4') (resid 3 and name C1') 50.0   21.6   9.5  2 
assign  (resid 3 and name C5') (resid 3 and name C4')
        (resid 3 and name C3') (resid 3 and name O3') 50.0    84.7  3.7  2 
assign  (resid 4 and name C4') (resid 4 and name O4')
        (resid 4 and name C1') (resid 4 and name C2') 50.0    0.0  11.5  2 

assign  (resid 4 and name O4') (resid 4 and name C1')
        (resid 4 and name C2') (resid 4 and name C3') 50.0  350.5   9.5  2 

assign  (resid 4 and name C1') (resid 4 and name C2')
        (resid 4 and name C3') (resid 4 and name C4') 50.0   35.5   3.6  2 
assign  (resid 4 and name C2') (resid 4 and name C3')
        (resid 4 and name C4') (resid 4 and name O4') 50.0  324.7   3.7  2 

assign  (resid 4 and name C3') (resid 4 and name C4')
        (resid 4 and name O4') (resid 4 and name C1') 50.0   21.6   9.5  2 
assign  (resid 4 and name C5') (resid 4 and name C4')
        (resid 4 and name C3') (resid 4 and name O3') 50.0    84.7  3.7  2 
assign  (resid 5 and name C4') (resid 5 and name O4')
        (resid 5 and name C1') (resid 5 and name C2') 50.0    0.0  11.5  2 

assign  (resid 5 and name O4') (resid 5 and name C1')
        (resid 5 and name C2') (resid 5 and name C3') 50.0  350.5   9.5  2 
assign  (resid 5 and name C1') (resid 5 and name C2')
        (resid 5 and name C3') (resid 5 and name C4') 50.0   35.5   3.6  2 
assign  (resid 5 and name C2') (resid 5 and name C3')
        (resid 5 and name C4') (resid 5 and name O4') 50.0  324.7   3.7  2 

assign  (resid 5 and name C3') (resid 5 and name C4')
        (resid 5 and name O4') (resid 5 and name C1') 50.0   21.6   9.5  2 
assign  (resid 5 and name C5') (resid 5 and name C4')
        (resid 5 and name C3') (resid 5 and name O3') 50.0    84.7  3.7  2 
assign  (resid 6 and name C4') (resid 6 and name O4')
        (resid 6 and name C1') (resid 6 and name C2') 50.0    0.0  11.5  2 

assign  (resid 6 and name O4') (resid 6 and name C1')
        (resid 6 and name C2') (resid 6 and name C3') 50.0  350.5   9.5  2 

assign  (resid 6 and name C1') (resid 6 and name C2')
        (resid 6 and name C3') (resid 6 and name C4') 50.0   35.5   3.6  2 
assign  (resid 6 and name C2') (resid 6 and name C3')
        (resid 6 and name C4') (resid 6 and name O4') 50.0  324.7   3.7  2 

assign  (resid 6 and name C3') (resid 6 and name C4')
        (resid 6 and name O4') (resid 6 and name C1') 50.0   21.6   9.5  2 
assign  (resid 6 and name C5') (resid 6 and name C4')
        (resid 6 and name C3') (resid 6 and name O3') 50.0    84.7  3.7  2 
assign  (resid 7 and name C4') (resid 7 and name O4')
        (resid 7 and name C1') (resid 7 and name C2') 50.0    0.0  11.5  2 

assign  (resid 7 and name O4') (resid 7 and name C1')
        (resid 7 and name C2') (resid 7 and name C3') 50.0  350.5   9.5  2 

assign  (resid 7 and name C1') (resid 7 and name C2')
        (resid 7 and name C3') (resid 7 and name C4') 50.0   35.5   3.6  2 
assign  (resid 7 and name C2') (resid 7 and name C3')
        (resid 7 and name C4') (resid 7 and name O4') 50.0  324.7   3.7  2 

assign  (resid 7 and name C3') (resid 7 and name C4')
        (resid 7 and name O4') (resid 7 and name C1') 50.0   21.6   9.5  2 
assign  (resid 7 and name C5') (resid 7 and name C4')
        (resid 7 and name C3') (resid 7 and name O3') 50.0    84.7  3.7  2 
assign  (resid 8 and name C4') (resid 8 and name O4')
        (resid 8 and name C1') (resid 8 and name C2') 50.0    0.0  11.5  2 

assign  (resid 8 and name O4') (resid 8 and name C1')
        (resid 8 and name C2') (resid 8 and name C3') 50.0  350.5   9.5  2 

assign  (resid 8 and name C1') (resid 8 and name C2')
        (resid 8 and name C3') (resid 8 and name C4') 50.0   35.5   3.6  2 
assign  (resid 8 and name C2') (resid 8 and name C3')
        (resid 8 and name C4') (resid 8 and name O4') 50.0  324.7   3.7  2 

assign  (resid 8 and name C3') (resid 8 and name C4')
        (resid 8 and name O4') (resid 8 and name C1') 50.0   21.6   9.5  2 
assign  (resid 8 and name C5') (resid 8 and name C4')
        (resid 8 and name C3') (resid 8 and name O3') 50.0    84.7  3.7  2 
assign  (resid 9 and name C4') (resid 9 and name O4')
        (resid 9 and name C1') (resid 9 and name C2') 50.0    0.0  11.5  2 
assign  (resid 9 and name O4') (resid 9 and name C1')
        (resid 9 and name C2') (resid 9 and name C3') 50.0  350.5   9.5  2 

assign  (resid 9 and name C1') (resid 9 and name C2')
        (resid 9 and name C3') (resid 9 and name C4') 50.0   35.5   3.6  2 
assign  (resid 9 and name C2') (resid 9 and name C3')
        (resid 9 and name C4') (resid 9 and name O4') 50.0  324.7   3.7  2 

assign  (resid 9 and name C3') (resid 9 and name C4')
        (resid 9 and name O4') (resid 9 and name C1') 50.0   21.6   9.5  2 

assign  (resid 9 and name C5') (resid 9 and name C4')
        (resid 9 and name C3') (resid 9 and name O3') 50.0    84.7  3.7  2 
assign  (resid 10 and name C4') (resid 10 and name O4')
        (resid 10 and name C1') (resid 10 and name C2') 50.0    0.0  11.5  2 
assign  (resid 10 and name O4') (resid 10 and name C1')
        (resid 10 and name C2') (resid 10 and name C3') 50.0  350.5   9.5  2 

assign  (resid 10 and name C1') (resid 10 and name C2')
        (resid 10 and name C3') (resid 10 and name C4') 50.0   35.5   3.6  2 
assign  (resid 10 and name C2') (resid 10 and name C3')
        (resid 10 and name C4') (resid 10 and name O4') 50.0  324.7   3.7  2 

assign  (resid 10 and name C3') (resid 10 and name C4')
        (resid 10 and name O4') (resid 10 and name C1') 50.0   21.6   9.5  2 

assign  (resid 10 and name C5') (resid 10 and name C4')
        (resid 10 and name C3') (resid 10 and name O3') 50.0    84.7  3.7  2

assign  (resid 11 and name C4') (resid 11 and name O4')
        (resid 11 and name C1') (resid 11 and name C2') 50.0    0.0  11.5  2 
assign  (resid 11 and name O4') (resid 11 and name C1')
        (resid 11 and name C2') (resid 11 and name C3') 50.0  350.5   9.5  2 

assign  (resid 11 and name C1') (resid 11 and name C2')
        (resid 11 and name C3') (resid 11 and name C4') 50.0   35.5   3.6  2 
assign  (resid 11 and name C2') (resid 11 and name C3')
        (resid 11 and name C4') (resid 11 and name O4') 50.0  324.7   3.7  2 

assign  (resid 11 and name C3') (resid 11 and name C4')
        (resid 11 and name O4') (resid 11 and name C1') 50.0   21.6   9.5  2 
assign  (resid 11 and name C5') (resid 11 and name C4')
        (resid 11 and name C3') (resid 11 and name O3') 50.0    84.7  3.7  2 
assign  (resid 12 and name C4') (resid 12 and name O4')
        (resid 12 and name C1') (resid 12 and name C2') 50.0    0.0  11.5  2 

assign  (resid 12 and name O4') (resid 12 and name C1')
        (resid 12 and name C2') (resid 12 and name C3') 50.0  350.5   9.5  2 

assign  (resid 12 and name C1') (resid 12 and name C2')
        (resid 12 and name C3') (resid 12 and name C4') 50.0   35.5   3.6  2 
assign  (resid 12 and name C2') (resid 12 and name C3')
        (resid 12 and name C4') (resid 12 and name O4') 50.0  324.7   3.7  2 

assign  (resid 12 and name C3') (resid 12 and name C4')
        (resid 12 and name O4') (resid 12 and name C1') 50.0   21.6   9.5  2 
assign  (resid 12 and name C5') (resid 12 and name C4')
        (resid 12 and name C3') (resid 12 and name O3') 50.0    84.7  3.7  2 
assign  (resid 13 and name C4') (resid 13 and name O4')
        (resid 13 and name C1') (resid 13 and name C2') 50.0    0.0  11.5  2 
assign  (resid 13 and name O4') (resid 13 and name C1')
        (resid 13 and name C2') (resid 13 and name C3') 50.0  350.5   9.5  2 

assign  (resid 13 and name C1') (resid 13 and name C2')
        (resid 13 and name C3') (resid 13 and name C4') 50.0   35.5   3.6  2 
assign  (resid 13 and name C2') (resid 13 and name C3')
        (resid 13 and name C4') (resid 13 and name O4') 50.0  324.7   3.7  2 

assign  (resid 13 and name C3') (resid 13 and name C4')
        (resid 13 and name O4') (resid 13 and name C1') 50.0   21.6   9.5  2 
assign  (resid 13 and name C5') (resid 13 and name C4')
        (resid 13 and name C3') (resid 13 and name O3') 50.0    84.7  3.7  2 
assign  (resid 14 and name C4') (resid 14 and name O4')
        (resid 14 and name C1') (resid 14 and name C2') 50.0    0.0  11.5  2 

assign  (resid 14 and name O4') (resid 14 and name C1')
        (resid 14 and name C2') (resid 14 and name C3') 50.0  350.5   9.5  2 

assign  (resid 14 and name C1') (resid 14 and name C2')
        (resid 14 and name C3') (resid 14 and name C4') 50.0   35.5   3.6  2 
assign  (resid 14 and name C2') (resid 14 and name C3')
        (resid 14 and name C4') (resid 14 and name O4') 50.0  324.7   3.7  2 

assign  (resid 14 and name C3') (resid 14 and name C4')
        (resid 14 and name O4') (resid 14 and name C1') 50.0   21.6   9.5  2 
assign  (resid 14 and name C5') (resid 14 and name C4')
        (resid 14 and name C3') (resid 14 and name O3') 50.0    84.7  3.7  2 
assign  (resid 15 and name C4') (resid 15 and name O4')
        (resid 15 and name C1') (resid 15 and name C2') 50.0    0.0  11.5  2 

assign  (resid 15 and name O4') (resid 15 and name C1')
        (resid 15 and name C2') (resid 15 and name C3') 50.0  350.5   9.5  2 

assign  (resid 15 and name C1') (resid 15 and name C2')
        (resid 15 and name C3') (resid 15 and name C4') 50.0   35.5   3.6  2 
assign  (resid 15 and name C2') (resid 15 and name C3')
        (resid 15 and name C4') (resid 15 and name O4') 50.0  324.7   3.7  2 

assign  (resid 15 and name C3') (resid 15 and name C4')
        (resid 15 and name O4') (resid 15 and name C1') 50.0   21.6   9.5  2 
assign  (resid 15 and name C5') (resid 15 and name C4')
        (resid 15 and name C3') (resid 15 and name O3') 50.0    84.7  3.7  2 
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  11.918 -16.284   1.485
    2   2H5*    G   1          2H5*        G   1  12.933 -16.523   2.924
    3    H4*    G   1           H4*        G   1  11.185 -18.811   2.378
    4    H3*    G   1           H3*        G   1   9.961 -16.067   2.817
    5    H2*    G   1           H2*        G   1   8.406 -17.013   4.330
    6   2HO*    G   1          2HO*        G   1   9.233 -19.634   3.649
    7    H1*    G   1           H1*        G   1  10.165 -18.841   5.469
    8    H8     G   1           H8         G   1  11.914 -15.554   5.127
    9    H1     G   1           H1         G   1   7.574 -15.635   9.863
   10   1H2     G   1          1H2         G   1   6.640 -17.753   9.900
   11   2H2     G   1          2H2         G   1   6.258 -18.340   8.297
   12   1H5*    C   2          1H5*        C   2   6.433 -18.993   2.995
   13   2H5*    C   2          2H5*        C   2   5.674 -18.425   1.490
   14    H4*    C   2           H4*        C   2   4.001 -18.528   3.266
   15    H3*    C   2           H3*        C   2   4.856 -15.715   2.488
   16    H2*    C   2           H2*        C   2   3.337 -14.851   4.057
   17   2HO*    C   2          2HO*        C   2   1.529 -16.090   3.492
   18    H1*    C   2           H1*        C   2   3.647 -16.898   5.958
   19   1H4     C   2          1H4         C   2   6.909 -12.081   8.435
   20   2H4     C   2          2H4         C   2   8.130 -12.193   7.190
   21    H5     C   2           H5         C   2   7.753 -13.498   5.156
   22    H6     C   2           H6         C   2   6.619 -15.498   4.305
   23   1H5*    C   3          1H5*        C   3   0.322 -13.944   1.623
   24   2H5*    C   3          2H5*        C   3   1.324 -12.534   1.996
   25    H4*    C   3           H4*        C   3  -0.104 -14.421   3.829
   26    H3*    C   3           H3*        C   3   0.395 -11.442   3.685
   27    H2*    C   3           H2*        C   3   0.237 -11.278   6.016
   28   2HO*    C   3          2HO*        C   3  -0.780 -13.925   6.072
   29    H1*    C   3           H1*        C   3   1.508 -13.678   6.619
   30   1H4     C   3          1H4         C   3   5.775  -8.945   7.207
   31   2H4     C   3          2H4         C   3   6.186  -9.118   5.516
   32    H5     C   3           H5         C   3   5.163 -10.832   4.122
   33    H6     C   3           H6         C   3   3.404 -12.483   3.959
   34   1H5*    C   4          2H5*        C   4  -1.971 -11.456   5.838
   35   2H5*    C   4          1H5*        C   4  -3.729 -11.626   5.892
   36    H4*    C   4           H4*        C   4  -3.737 -10.094   7.535
   37    H3*    C   4           H3*        C   4  -2.596  -8.324   5.358
   38    H2*    C   4           H2*        C   4  -2.033  -6.705   6.973
   39   2HO*    C   4          2HO*        C   4  -2.856  -6.718   9.053
   40    H1*    C   4           H1*        C   4  -1.268  -8.495   8.966
   41   1H4     C   4          1H4         C   4   4.314  -7.042   6.386
   42   2H4     C   4          2H4         C   4   3.682  -7.163   4.764
   43    H5     C   4           H5         C   4   1.821  -8.882   4.620
   44    H6     C   4           H6         C   4  -0.256  -9.525   5.645
   45   1H5*    U   5          1H5*        U   5  -4.823  -6.180   8.098
   46   2H5*    U   5          2H5*        U   5  -5.868  -4.947   7.367
   47    H4*    U   5           H4*        U   5  -4.484  -3.931   9.083
   48    H3*    U   5           H3*        U   5  -3.653  -3.171   6.268
   49    H2*    U   5           H2*        U   5  -2.047  -1.732   7.226
   50   2HO*    U   5          2HO*        U   5  -2.367  -1.707   9.786
   51    H1*    U   5           H1*        U   5  -1.541  -3.355   9.472
   52    H3     U   5           H3         U   5   2.334  -2.523   7.242
   53    H5     U   5           H5         U   5   0.544  -5.679   5.152
   54    H6     U   5           H6         U   5  -1.463  -5.224   6.377
   55   1H5*    G   6          1H5*        G   6  -1.776   0.050   8.000
   56   2H5*    G   6          2H5*        G   6  -3.023   1.315   8.087
   57    H4*    G   6           H4*        G   6  -1.736   2.506   6.670
   58    H3*    G   6           H3*        G   6  -2.540   0.257   4.783
   59    H2*    G   6           H2*        G   6  -1.034   1.103   3.202
   60   2HO*    G   6          2HO*        G   6  -0.578   3.170   3.005
   61    H1*    G   6           H1*        G   6   0.879   2.010   5.064
   62    H8     G   6           H8         G   6  -0.746  -1.506   4.953
   63    H1     G   6           H1         G   6   5.107  -1.016   2.323
   64   1H2     G   6          1H2         G   6   5.662   1.151   2.141
   65   2H2     G   6          2H2         G   6   4.914   2.300   3.235
   66   1H5*    A   7          1H5*        A   7  -4.529   1.646   0.785
   67   2H5*    A   7          2H5*        A   7  -3.496   0.203   0.743
   68    H4*    A   7           H4*        A   7  -2.802   1.694  -1.022
   69    H3*    A   7           H3*        A   7  -0.908   1.724   1.354
   70    H2*    A   7           H2*        A   7   0.464   3.237   0.145
   71   2HO*    A   7          2HO*        A   7   0.782   2.755  -1.864
   72    H1*    A   7           H1*        A   7  -1.646   4.517  -1.166
   73    H8     A   7           H8         A   7  -2.525   4.553   2.421
   74   1H6     A   7          1H6         A   7   0.034   8.523   3.796
   75   2H6     A   7          2H6         A   7   1.666   8.969   3.352
   76    H2     A   7           H2         A   7   2.152   7.469  -0.877
   77   1H5*    A   8          1H5*        A   8   1.036   0.888  -1.708
   78   2H5*    A   8          2H5*        A   8   2.387  -0.246  -1.938
   79    H4*    A   8           H4*        A   8   3.259   1.961  -2.263
   80    H3*    A   8           H3*        A   8   3.896   0.828   0.481
   81    H2*    A   8           H2*        A   8   5.109   2.783   1.011
   82   2HO*    A   8          2HO*        A   8   4.919   3.545  -1.722
   83    H1*    A   8           H1*        A   8   3.366   4.547  -0.297
   84    H8     A   8           H8         A   8   1.300   2.083   1.601
   85   1H6     A   8          1H6         A   8   2.433   5.334   6.724
   86   2H6     A   8          2H6         A   8   1.183   4.422   5.908
   87    H2     A   8           H2         A   8   5.076   6.945   3.455
   88   1H5*    A   9          2H5*        A   9   8.468  -0.448  -2.421
   89   2H5*    A   9          1H5*        A   9   7.460   0.422  -1.246
   90    H4*    A   9           H4*        A   9   9.558   1.480  -2.784
   91    H3*    A   9           H3*        A   9   7.312   2.753  -1.197
   92    H2*    A   9           H2*        A   9   8.011   4.872  -1.986
   93   2HO*    A   9          2HO*        A   9  10.313   3.696  -3.132
   94    H1*    A   9           H1*        A   9   8.621   4.002  -4.570
   95    H8     A   9           H8         A   9   6.236   5.226  -2.132
   96   1H6     A   9          1H6         A   9   1.730   4.727  -5.097
   97   2H6     A   9          2H6         A   9   2.260   5.998  -6.176
   98    H2     A   9           H2         A   9   5.253   2.681  -7.941
   99   1H5*    A  10          1H5*        A  10  10.027   1.454   3.759
  100   2H5*    A  10          2H5*        A  10   8.352   1.763   3.255
  101    H4*    A  10           H4*        A  10  10.167   4.118   3.571
  102    H3*    A  10           H3*        A  10   9.090   2.432   5.835
  103    H2*    A  10           H2*        A  10   8.427   4.347   7.017
  104   2HO*    A  10          2HO*        A  10   9.820   5.997   5.187
  105    H1*    A  10           H1*        A  10   7.581   5.837   4.818
  106    H8     A  10           H8         A  10   6.132   2.728   3.871
  107   1H6     A  10          1H6         A  10   1.715   3.399   7.467
  108   2H6     A  10          2H6         A  10   2.677   2.035   7.991
  109    H2     A  10           H2         A  10   5.253   6.097   9.267
  110   1H5*    A  11          1H5*        A  11  10.104   4.646   8.494
  111   2H5*    A  11          2H5*        A  11  10.817   3.658   9.789
  112    H4*    A  11           H4*        A  11   8.469   4.558  10.223
  113    H3*    A  11           H3*        A  11   9.085   1.596  10.333
  114    H2*    A  11           H2*        A  11   6.830   1.153  10.873
  115   2HO*    A  11          2HO*        A  11   5.593   2.512  11.921
  116    H1*    A  11           H1*        A  11   5.707   3.104   9.255
  117    H8     A  11           H8         A  11   8.438   1.345   7.361
  118   1H6     A  11          1H6         A  11   4.613  -3.220   6.228
  119   2H6     A  11          2H6         A  11   5.373  -2.075   5.148
  120    H2     A  11           H2         A  11   2.441  -0.298   9.012
  121   1H5*    G  12          1H5*        G  12   9.261  -1.316  13.210
  122   2H5*    G  12          2H5*        G  12   9.086  -0.440  11.680
  123    H4*    G  12           H4*        G  12   6.935   0.211  13.528
  124    H3*    G  12           H3*        G  12   7.384  -2.696  12.843
  125    H2*    G  12           H2*        G  12   5.065  -2.927  12.411
  126   2HO*    G  12          2HO*        G  12   4.676  -0.365  13.570
  127    H1*    G  12           H1*        G  12   4.736  -0.428  11.200
  128    H8     G  12           H8         G  12   7.707  -1.371   9.469
  129    H1     G  12           H1         G  12   2.963  -5.492   8.126
  130   1H2     G  12          1H2         G  12   1.176  -4.946   9.444
  131   2H2     G  12          2H2         G  12   1.599  -4.494  11.080
  132   1H5*    G  13          1H5*        G  13   4.612  -3.040  15.907
  133   2H5*    G  13          2H5*        G  13   5.108  -4.092  17.249
  134    H4*    G  13           H4*        G  13   2.984  -4.879  16.418
  135    H3*    G  13           H3*        G  13   5.313  -6.578  15.515
  136    H2*    G  13           H2*        G  13   3.817  -7.946  14.339
  137   2HO*    G  13          2HO*        G  13   2.204  -8.348  15.761
  138    H1*    G  13           H1*        G  13   2.088  -5.947  13.490
  139    H8     G  13           H8         G  13   5.545  -4.701  12.906
  140    H1     G  13           H1         G  13   3.722  -9.169   8.662
  141   1H2     G  13          1H2         G  13   1.676  -9.915   9.233
  142   2H2     G  13          2H2         G  13   1.300  -9.969  10.941
  143   1H5*    G  14          1H5*        G  14   2.214  -8.707  17.411
  144   2H5*    G  14          2H5*        G  14   2.643  -9.999  18.555
  145    H4*    G  14           H4*        G  14   1.013 -10.856  16.948
  146    H3*    G  14           H3*        G  14   3.834 -11.870  16.509
  147    H2*    G  14           H2*        G  14   3.007 -13.219  14.745
  148   2HO*    G  14          2HO*        G  14   0.537 -12.800  16.012
  149    H1*    G  14           H1*        G  14   1.211 -11.324  13.766
  150    H8     G  14           H8         G  14   4.359  -9.489  14.519
  151    H1     G  14           H1         G  14   4.763 -13.116   9.213
  152   1H2     G  14          1H2         G  14   3.169 -14.719   9.331
  153   2H2     G  14          2H2         G  14   1.654 -14.241  10.064
  154   1H5*    C  15          1H5*        C  15   1.572 -14.911  16.302
  155   2H5*    C  15          2H5*        C  15   1.852 -16.264  17.426
  156    H4*    C  15           H4*        C  15   1.742 -17.290  15.297
  157    H3*    C  15           H3*        C  15   4.626 -16.784  16.086
  158    H2*    C  15           H2*        C  15   5.302 -17.818  14.076
  159   2HO*    C  15          2HO*        C  15   3.312 -18.815  12.851
  160    H1*    C  15           H1*        C  15   3.100 -16.925  12.558
  161   1H4     C  15          1H4         C  15   8.001 -13.427  10.588
  162   2H4     C  15          2H4         C  15   8.223 -12.736  12.185
  163    H5     C  15           H5         C  15   6.420 -12.950  13.854
  164    H6     C  15           H6         C  15   4.557 -14.318  14.567
  165   2H    ASP   2          2H        ASP   2  10.206 -11.074  -0.946
  166   1H    ASP   2          1H        ASP   2  10.137 -12.761  -1.138
  167   3H    ASP   2          3H        ASP   2  11.401 -12.056  -0.249
  168    HA   ASP   2           HA       ASP   2   9.929 -12.906   1.375
  169   1HB   ASP   2          1HB       ASP   2   9.256  -9.984   0.935
  170   2HB   ASP   2          2HB       ASP   2   9.319 -10.837   2.474
  171    H    ALA   3           H        ALA   3   7.549 -11.722   2.210
  172    HA   ALA   3           HA       ALA   3   5.611 -12.698   0.136
  173   1HB   ALA   3          1HB       ALA   3   5.896 -13.993   2.279
  174   2HB   ALA   3          2HB       ALA   3   5.344 -12.565   3.156
  175   3HB   ALA   3          3HB       ALA   3   4.256 -13.390   2.039
  176    H    GLN   4           H        GLN   4   6.436 -10.088   2.337
  177    HA   GLN   4           HA       GLN   4   3.921  -8.671   2.126
  178   1HB   GLN   4          1HB       GLN   4   5.565  -8.333   3.941
  179   2HB   GLN   4          2HB       GLN   4   6.748  -7.762   2.771
  180   1HG   GLN   4          1HG       GLN   4   5.081  -5.955   2.130
  181   2HG   GLN   4          2HG       GLN   4   4.137  -6.436   3.537
  182   1HE2  GLN   4          2HE2      GLN   4   4.708  -4.078   4.172
  183   2HE2  GLN   4          1HE2      GLN   4   6.168  -3.832   4.998
  184    H    THR   5           H        THR   5   7.117  -8.026   0.694
  185    HA   THR   5           HA       THR   5   6.420  -5.977  -1.092
  186    HB   THR   5           HB       THR   5   8.231  -8.363  -1.612
  187    HG1  THR   5           HG1      THR   5   9.642  -7.402  -0.353
  188   1HG2  THR   5          1HG2      THR   5   7.884  -5.648  -2.835
  189   2HG2  THR   5          2HG2      THR   5   9.469  -6.427  -2.860
  190   3HG2  THR   5          3HG2      THR   5   8.087  -7.210  -3.631
  191    H    ARG   6           H        ARG   6   5.913  -9.445  -1.294
  192    HA   ARG   6           HA       ARG   6   4.780  -9.512  -3.972
  193   1HB   ARG   6          1HB       ARG   6   5.404 -11.270  -1.771
  194   2HB   ARG   6          2HB       ARG   6   3.736 -11.555  -2.279
  195   1HG   ARG   6          1HG       ARG   6   4.448 -11.918  -4.581
  196   2HG   ARG   6          2HG       ARG   6   6.110 -11.492  -4.175
  197   1HD   ARG   6          1HD       ARG   6   5.704 -13.987  -4.293
  198   2HD   ARG   6          2HD       ARG   6   6.299 -13.447  -2.712
  199    HE   ARG   6           HE       ARG   6   4.190 -13.978  -1.793
  200   1HH1  ARG   6          1HH1      ARG   6   4.013 -13.722  -5.252
  201   2HH1  ARG   6          2HH1      ARG   6   2.372 -14.264  -5.325
  202   1HH2  ARG   6          1HH2      ARG   6   2.058 -14.681  -1.902
  203   2HH2  ARG   6          2HH2      ARG   6   1.270 -14.804  -3.439
  204    H    ARG   7           H        ARG   7   3.519  -9.512  -0.656
  205    HA   ARG   7           HA       ARG   7   0.764  -9.578  -1.247
  206   1HB   ARG   7          1HB       ARG   7   1.519  -9.901   0.983
  207   2HB   ARG   7          2HB       ARG   7   2.466  -8.419   0.954
  208   1HG   ARG   7          1HG       ARG   7   0.148  -7.237   0.630
  209   2HG   ARG   7          2HG       ARG   7  -0.507  -8.745   1.261
  210   1HD   ARG   7          1HD       ARG   7   0.037  -8.125   3.370
  211   2HD   ARG   7          2HD       ARG   7   1.731  -7.898   2.895
  212    HE   ARG   7           HE       ARG   7  -0.285  -5.799   3.068
  213   1HH1  ARG   7          1HH1      ARG   7   2.625  -6.856   1.522
  214   2HH1  ARG   7          2HH1      ARG   7   3.126  -5.260   1.115
  215   1HH2  ARG   7          1HH2      ARG   7   0.369  -3.725   2.537
  216   2HH2  ARG   7          2HH2      ARG   7   1.857  -3.487   1.685
  217    H    ARG   8           H        ARG   8   3.074  -6.917  -1.275
  218    HA   ARG   8           HA       ARG   8   1.329  -4.674  -1.401
  219   1HB   ARG   8          1HB       ARG   8   3.973  -5.020  -1.383
  220   2HB   ARG   8          2HB       ARG   8   3.782  -4.893  -3.129
  221   1HG   ARG   8          1HG       ARG   8   4.175  -2.668  -2.420
  222   2HG   ARG   8          2HG       ARG   8   2.430  -2.754  -2.654
  223   1HD   ARG   8          1HD       ARG   8   3.067  -1.634  -0.496
  224   2HD   ARG   8          2HD       ARG   8   2.096  -3.096  -0.239
  225    HE   ARG   8           HE       ARG   8   3.995  -4.115   0.726
  226   1HH1  ARG   8          1HH1      ARG   8   4.899  -1.370  -1.194
  227   2HH1  ARG   8          2HH1      ARG   8   6.565  -1.449  -0.735
  228   1HH2  ARG   8          1HH2      ARG   8   6.163  -4.209   1.317
  229   2HH2  ARG   8          2HH2      ARG   8   7.278  -3.047   0.679
  230    H    GLU   9           H        GLU   9   2.408  -6.913  -3.922
  231    HA   GLU   9           HA       GLU   9   1.125  -5.559  -6.110
  232   1HB   GLU   9          1HB       GLU   9   1.651  -8.520  -5.631
  233   2HB   GLU   9          2HB       GLU   9   1.342  -7.782  -7.203
  234   1HG   GLU   9          1HG       GLU   9   3.502  -6.456  -5.724
  235   2HG   GLU   9          2HG       GLU   9   3.845  -8.150  -6.073
  236    H    ARG  10           H        ARG  10   0.081  -7.743  -3.599
  237    HA   ARG  10           HA       ARG  10  -2.615  -8.129  -4.634
  238   1HB   ARG  10          1HB       ARG  10  -0.907  -9.041  -2.482
  239   2HB   ARG  10          2HB       ARG  10  -2.471  -8.551  -1.831
  240   1HG   ARG  10          1HG       ARG  10  -3.641 -10.135  -3.086
  241   2HG   ARG  10          2HG       ARG  10  -2.364 -10.261  -4.296
  242   1HD   ARG  10          1HD       ARG  10  -0.913 -11.425  -2.682
  243   2HD   ARG  10          2HD       ARG  10  -2.164 -11.268  -1.434
  244    HE   ARG  10           HE       ARG  10  -3.378 -12.989  -2.506
  245   1HH1  ARG  10          1HH1      ARG  10  -0.972 -11.649  -4.620
  246   2HH1  ARG  10          2HH1      ARG  10  -1.247 -12.819  -5.865
  247   1HH2  ARG  10          1HH2      ARG  10  -3.726 -14.502  -4.131
  248   2HH2  ARG  10          2HH2      ARG  10  -2.797 -14.425  -5.591
  249    H    ARG  11           H        ARG  11  -0.890  -5.633  -3.001
  250    HA   ARG  11           HA       ARG  11  -3.320  -4.467  -1.788
  251   1HB   ARG  11          1HB       ARG  11  -0.425  -3.587  -1.985
  252   2HB   ARG  11          2HB       ARG  11  -1.680  -2.692  -1.138
  253   1HG   ARG  11          1HG       ARG  11  -0.740  -5.503  -0.485
  254   2HG   ARG  11          2HG       ARG  11  -0.425  -4.052   0.458
  255   1HD   ARG  11          1HD       ARG  11  -2.498  -4.079   1.409
  256   2HD   ARG  11          2HD       ARG  11  -3.291  -4.571  -0.094
  257    HE   ARG  11           HE       ARG  11  -2.388  -6.870   0.305
  258   1HH1  ARG  11          1HH1      ARG  11  -2.460  -4.604   2.945
  259   2HH1  ARG  11          2HH1      ARG  11  -2.427  -5.842   4.150
  260   1HH2  ARG  11          1HH2      ARG  11  -2.347  -8.454   1.876
  261   2HH2  ARG  11          2HH2      ARG  11  -2.364  -8.011   3.548
  262    H    ALA  12           H        ALA  12  -2.053  -4.585  -4.892
  263    HA   ALA  12           HA       ALA  12  -2.100  -1.905  -5.837
  264   1HB   ALA  12          1HB       ALA  12  -3.140  -4.475  -7.107
  265   2HB   ALA  12          2HB       ALA  12  -2.758  -2.999  -7.992
  266   3HB   ALA  12          3HB       ALA  12  -1.476  -3.894  -7.175
  267    H    GLU  13           H        GLU  13  -4.679  -4.030  -4.788
  268    HA   GLU  13           HA       GLU  13  -6.859  -2.411  -5.853
  269   1HB   GLU  13          1HB       GLU  13  -6.614  -4.629  -3.794
  270   2HB   GLU  13          2HB       GLU  13  -8.161  -3.926  -4.264
  271   1HG   GLU  13          1HG       GLU  13  -6.698  -4.570  -6.647
  272   2HG   GLU  13          2HG       GLU  13  -6.700  -5.984  -5.592
  273    H    LYS  14           H        LYS  14  -4.995  -2.651  -2.852
  274    HA   LYS  14           HA       LYS  14  -6.692  -0.737  -1.403
  275   1HB   LYS  14          1HB       LYS  14  -3.926  -1.926  -0.937
  276   2HB   LYS  14          2HB       LYS  14  -4.816  -0.971   0.252
  277   1HG   LYS  14          1HG       LYS  14  -6.158  -3.347  -0.983
  278   2HG   LYS  14          2HG       LYS  14  -4.963  -3.608   0.289
  279   1HD   LYS  14          1HD       LYS  14  -6.249  -1.862   1.652
  280   2HD   LYS  14          2HD       LYS  14  -7.531  -2.019   0.450
  281   1HE   LYS  14          1HE       LYS  14  -6.713  -4.661   1.226
  282   2HE   LYS  14          2HE       LYS  14  -7.044  -3.716   2.691
  283   1HZ   LYS  14          1HZ       LYS  14  -9.120  -2.968   1.695
  284   2HZ   LYS  14          2HZ       LYS  14  -8.813  -3.899   0.307
  285   3HZ   LYS  14          3HZ       LYS  14  -9.088  -4.661   1.801
  286    H    GLN  15           H        GLN  15  -3.752  -0.818  -3.277
  287    HA   GLN  15           HA       GLN  15  -2.868   1.892  -2.817
  288   1HB   GLN  15          1HB       GLN  15  -2.172  -0.529  -4.295
  289   2HB   GLN  15          2HB       GLN  15  -1.886   0.904  -5.269
  290   1HG   GLN  15          1HG       GLN  15  -0.296   1.754  -3.798
  291   2HG   GLN  15          2HG       GLN  15  -0.976   0.890  -2.419
  292   1HE2  GLN  15          2HE2      GLN  15  -0.845  -1.634  -2.689
  293   2HE2  GLN  15          1HE2      GLN  15   0.614  -2.239  -3.314
  294    H    ALA  16           H        ALA  16  -4.520   0.253  -5.522
  295    HA   ALA  16           HA       ALA  16  -4.922   2.665  -7.066
  296   1HB   ALA  16          1HB       ALA  16  -4.965   0.317  -7.929
  297   2HB   ALA  16          2HB       ALA  16  -6.459   0.038  -7.035
  298   3HB   ALA  16          3HB       ALA  16  -6.429   1.202  -8.359
  299    H    GLN  17           H        GLN  17  -6.657   1.171  -4.392
  300    HA   GLN  17           HA       GLN  17  -9.083   2.786  -4.801
  301   1HB   GLN  17          1HB       GLN  17  -7.974   0.883  -2.739
  302   2HB   GLN  17          2HB       GLN  17  -9.380   1.867  -2.343
  303   1HG   GLN  17          1HG       GLN  17  -9.195   0.090  -4.789
  304   2HG   GLN  17          2HG       GLN  17  -9.975  -0.383  -3.279
  305   1HE2  GLN  17          2HE2      GLN  17 -11.370   1.889  -2.531
  306   2HE2  GLN  17          1HE2      GLN  17 -12.498   2.314  -3.726
  307    H    TRP  18           H        TRP  18  -6.140   2.824  -2.896
  308    HA   TRP  18           HA       TRP  18  -6.794   5.199  -1.339
  309   1HB   TRP  18          1HB       TRP  18  -5.182   3.519  -0.565
  310   2HB   TRP  18          2HB       TRP  18  -4.238   3.710  -2.030
  311    HD1  TRP  18           HD1      TRP  18  -4.837   5.344   1.333
  312    HE1  TRP  18           HE1      TRP  18  -3.229   7.354   1.571
  313    HE3  TRP  18           HE3      TRP  18  -2.972   5.516  -3.348
  314    HZ2  TRP  18           HZ2      TRP  18  -1.372   8.821  -0.044
  315    HZ3  TRP  18           HZ3      TRP  18  -1.306   7.176  -3.997
  316    HH2  TRP  18           HH2      TRP  18  -0.485   8.816  -2.371
  317    H    LYS  19           H        LYS  19  -4.726   4.449  -4.101
  318    HA   LYS  19           HA       LYS  19  -3.733   7.047  -4.660
  319   1HB   LYS  19          1HB       LYS  19  -4.293   4.576  -6.322
  320   2HB   LYS  19          2HB       LYS  19  -3.538   6.009  -7.005
  321   1HG   LYS  19          1HG       LYS  19  -1.734   5.866  -5.323
  322   2HG   LYS  19          2HG       LYS  19  -2.467   4.400  -4.678
  323   1HD   LYS  19          1HD       LYS  19  -1.969   3.148  -6.592
  324   2HD   LYS  19          2HD       LYS  19  -1.801   4.583  -7.603
  325   1HE   LYS  19          1HE       LYS  19   0.211   5.173  -6.051
  326   2HE   LYS  19          2HE       LYS  19   0.153   3.457  -5.601
  327   1HZ   LYS  19          1HZ       LYS  19   0.188   4.458  -8.399
  328   2HZ   LYS  19          2HZ       LYS  19   1.559   3.887  -7.575
  329   3HZ   LYS  19          3HZ       LYS  19   0.268   2.836  -7.899
  330    H    ALA  20           H        ALA  20  -6.697   5.369  -5.559
  331    HA   ALA  20           HA       ALA  20  -7.646   7.252  -7.462
  332   1HB   ALA  20          1HB       ALA  20  -8.835   5.206  -5.626
  333   2HB   ALA  20          2HB       ALA  20  -9.908   6.267  -6.538
  334   3HB   ALA  20          3HB       ALA  20  -8.779   5.212  -7.389
  335    H    ALA  21           H        ALA  21  -7.647   7.218  -3.953
  336    HA   ALA  21           HA       ALA  21  -9.069   9.847  -3.968
  337   1HB   ALA  21          1HB       ALA  21  -9.095   7.468  -2.129
  338   2HB   ALA  21          2HB       ALA  21  -9.545   9.057  -1.512
  339   3HB   ALA  21          3HB       ALA  21 -10.464   8.331  -2.830
  340    H    ASN  22           H        ASN  22  -6.192   9.253  -4.237
  341    HA   ASN  22           HA       ASN  22  -5.254  11.140  -2.173
  342   1HB   ASN  22          1HB       ASN  22  -4.256   8.295  -2.433
  343   2HB   ASN  22          2HB       ASN  22  -3.391   9.555  -1.553
  344   1HD2  ASN  22          2HD2      ASN  22  -5.542   7.088  -1.080
  345   2HD2  ASN  22          1HD2      ASN  22  -6.324   7.645   0.319
  346    HA   PRO  23           HA       PRO  23  -3.079  11.121  -6.361
  347   1HB   PRO  23          1HB       PRO  23  -4.278  13.349  -7.421
  348   2HB   PRO  23          2HB       PRO  23  -4.893  11.707  -7.696
  349   1HG   PRO  23          1HG       PRO  23  -5.849  13.792  -5.805
  350   2HG   PRO  23          2HG       PRO  23  -6.774  12.623  -6.761
  351   1HD   PRO  23          1HD       PRO  23  -6.245  12.319  -4.100
  352   2HD   PRO  23          2HD       PRO  23  -6.522  10.958  -5.200
  353    H    LEU  24           H        LEU  24  -4.166  13.372  -3.954
  354    HA   LEU  24           HA       LEU  24  -2.345  15.527  -4.282
  355   1HB   LEU  24          1HB       LEU  24  -3.201  16.162  -2.196
  356   2HB   LEU  24          2HB       LEU  24  -4.427  15.002  -2.690
  357    HG   LEU  24           HG       LEU  24  -2.025  14.179  -1.032
  358   1HD1  LEU  24          1HD1      LEU  24  -3.692  16.043  -0.105
  359   2HD1  LEU  24          2HD1      LEU  24  -4.689  14.627   0.229
  360   3HD1  LEU  24          3HD1      LEU  24  -3.076  14.755   0.930
  361   1HD2  LEU  24          1HD2      LEU  24  -3.909  12.652  -2.327
  362   2HD2  LEU  24          2HD2      LEU  24  -3.052  12.131  -0.877
  363   3HD2  LEU  24          3HD2      LEU  24  -4.659  12.851  -0.748
  364    H    LEU  25           H        LEU  25  -2.041  12.378  -2.785
  365    HA   LEU  25           HA       LEU  25   0.809  12.876  -2.076
  366   1HB   LEU  25          1HB       LEU  25  -1.450  11.135  -1.197
  367   2HB   LEU  25          2HB       LEU  25   0.153  10.396  -1.145
  368    HG   LEU  25           HG       LEU  25  -0.054  13.148  -0.040
  369   1HD1  LEU  25          1HD1      LEU  25  -2.059  11.471   0.702
  370   2HD1  LEU  25          2HD1      LEU  25  -0.813  10.996   1.856
  371   3HD1  LEU  25          3HD1      LEU  25  -1.353  12.674   1.781
  372   1HD2  LEU  25          1HD2      LEU  25   1.908  11.312  -0.127
  373   2HD2  LEU  25          2HD2      LEU  25   1.766  12.466   1.200
  374   3HD2  LEU  25          3HD2      LEU  25   1.151  10.824   1.390
  375    H    VAL  26           H        VAL  26  -0.165  12.663  -4.754
  376    HA   VAL  26           HA       VAL  26   1.348  10.293  -5.683
  377    HB   VAL  26           HB       VAL  26  -1.544  10.697  -5.566
  378   1HG1  VAL  26          1HG1      VAL  26  -0.265  10.239  -8.265
  379   2HG1  VAL  26          2HG1      VAL  26  -1.874   9.622  -7.887
  380   3HG1  VAL  26          3HG1      VAL  26  -1.561  11.358  -7.832
  381   1HG2  VAL  26          1HG2      VAL  26   0.431   8.488  -6.027
  382   2HG2  VAL  26          2HG2      VAL  26  -0.751   8.683  -4.730
  383   3HG2  VAL  26          3HG2      VAL  26  -1.282   8.193  -6.341
  384    H    GLY  27           H        GLY  27   2.856  11.315  -6.898
  385   1HA   GLY  27          1HA       GLY  27   3.833  12.867  -8.390
  386   2HA   GLY  27          2HA       GLY  27   2.479  12.390  -9.412
  387    H    VAL  28           H        VAL  28   3.766  14.917  -7.387
  388    HA   VAL  28           HA       VAL  28   1.591  16.558  -6.809
  389    HB   VAL  28           HB       VAL  28   4.309  17.292  -7.954
  390   1HG1  VAL  28          1HG1      VAL  28   2.097  18.968  -7.446
  391   2HG1  VAL  28          2HG1      VAL  28   3.177  19.182  -6.068
  392   3HG1  VAL  28          3HG1      VAL  28   3.769  19.466  -7.704
  393   1HG2  VAL  28          1HG2      VAL  28   3.769  15.904  -5.665
  394   2HG2  VAL  28          2HG2      VAL  28   5.165  16.963  -5.863
  395   3HG2  VAL  28          3HG2      VAL  28   3.710  17.561  -5.066
  396    H    SER  29           H        SER  29   0.373  18.100  -7.985
  397    HA   SER  29           HA       SER  29  -0.726  18.989  -9.867
  398   1HB   SER  29          1HB       SER  29   1.807  18.322 -11.373
  399   2HB   SER  29          2HB       SER  29   0.721  19.686 -11.621
  400    HG   SER  29           HG       SER  29   2.864  19.780 -10.269
  401    H    ALA  30           H        ALA  30  -1.264  16.329  -9.284
  402    HA   ALA  30           HA       ALA  30  -1.753  15.207 -12.010
  403   1HB   ALA  30          1HB       ALA  30   0.276  14.197 -10.853
  404   2HB   ALA  30          2HB       ALA  30  -0.820  13.600  -9.606
  405   3HB   ALA  30          3HB       ALA  30  -0.982  13.033 -11.268
  406    H    LYS  31           H        LYS  31  -3.677  16.598 -10.658
  407    HA   LYS  31           HA       LYS  31  -5.409  14.492  -9.409
  408   1HB   LYS  31          1HB       LYS  31  -5.374  17.512  -9.081
  409   2HB   LYS  31          2HB       LYS  31  -6.429  16.399  -8.209
  410   1HG   LYS  31          1HG       LYS  31  -4.726  15.619  -6.864
  411   2HG   LYS  31          2HG       LYS  31  -3.491  15.867  -8.098
  412   1HD   LYS  31          1HD       LYS  31  -4.881  18.232  -6.866
  413   2HD   LYS  31          2HD       LYS  31  -3.538  17.457  -6.024
  414   1HE   LYS  31          1HE       LYS  31  -2.008  17.945  -7.780
  415   2HE   LYS  31          2HE       LYS  31  -3.316  18.321  -8.919
  416   1HZ   LYS  31          1HZ       LYS  31  -4.000  20.111  -7.351
  417   2HZ   LYS  31          2HZ       LYS  31  -2.571  19.834  -6.475
  418   3HZ   LYS  31          3HZ       LYS  31  -2.494  20.379  -8.082
  419    HA   PRO  32           HA       PRO  32  -7.788  15.260 -13.125
  420   1HB   PRO  32          1HB       PRO  32  -9.777  13.456 -12.602
  421   2HB   PRO  32          2HB       PRO  32  -8.180  12.983 -13.216
  422   1HG   PRO  32          1HG       PRO  32  -9.262  12.841 -10.452
  423   2HG   PRO  32          2HG       PRO  32  -8.192  11.720 -11.307
  424   1HD   PRO  32          1HD       PRO  32  -7.334  13.536  -9.444
  425   2HD   PRO  32          2HD       PRO  32  -6.312  12.883 -10.743
  426    H    VAL  33           H        VAL  33 -10.062  16.000 -13.570
  427    HA   VAL  33           HA       VAL  33 -11.456  17.107 -11.164
  428    HB   VAL  33           HB       VAL  33 -11.650  19.254 -12.410
  429   1HG1  VAL  33          1HG1      VAL  33  -9.528  18.369 -10.986
  430   2HG1  VAL  33          2HG1      VAL  33  -8.731  18.703 -12.523
  431   3HG1  VAL  33          3HG1      VAL  33  -9.603  19.987 -11.685
  432   1HG2  VAL  33          1HG2      VAL  33 -11.487  18.241 -14.686
  433   2HG2  VAL  33          2HG2      VAL  33 -10.361  19.580 -14.467
  434   3HG2  VAL  33          3HG2      VAL  33  -9.779  17.917 -14.392
  435    H    ASN  34           H        ASN  34 -13.568  18.327 -12.295
  436    HA   ASN  34           HA       ASN  34 -14.722  16.508 -14.358
  437   1HB   ASN  34          1HB       ASN  34 -15.414  16.764 -11.486
  438   2HB   ASN  34          2HB       ASN  34 -16.789  16.752 -12.591
  439   1HD2  ASN  34          2HD2      ASN  34 -17.112  14.553 -11.380
  440   2HD2  ASN  34          1HD2      ASN  34 -16.350  13.196 -12.059
  441    H    ARG  35           H        ARG  35 -14.097  18.895 -15.237
  442    HA   ARG  35           HA       ARG  35 -16.673  20.344 -15.423
  443   1HB   ARG  35          1HB       ARG  35 -15.453  22.494 -14.835
  444   2HB   ARG  35          2HB       ARG  35 -15.657  21.373 -13.490
  445   1HG   ARG  35          1HG       ARG  35 -13.379  20.581 -13.723
  446   2HG   ARG  35          2HG       ARG  35 -13.158  21.515 -15.202
  447   1HD   ARG  35          1HD       ARG  35 -13.994  22.990 -12.729
  448   2HD   ARG  35          2HD       ARG  35 -12.301  22.478 -12.877
  449    HE   ARG  35           HE       ARG  35 -13.288  23.680 -15.331
  450   1HH1  ARG  35          2HH1      ARG  35 -12.018  24.314 -12.164
  451   2HH1  ARG  35          1HH1      ARG  35 -11.370  25.857 -12.604
  452   1HH2  ARG  35          1HH2      ARG  35 -12.441  25.687 -15.893
  453   2HH2  ARG  35          2HH2      ARG  35 -11.608  26.631 -14.705
  454    HA   PRO  36           HA       PRO  36 -14.021  20.216 -19.257
  455   1HB   PRO  36          1HB       PRO  36 -15.911  19.089 -20.885
  456   2HB   PRO  36          2HB       PRO  36 -14.779  18.129 -19.912
  457   1HG   PRO  36          1HG       PRO  36 -17.633  18.793 -19.389
  458   2HG   PRO  36          2HG       PRO  36 -16.751  17.286 -19.094
  459   1HD   PRO  36          1HD       PRO  36 -17.341  19.094 -17.139
  460   2HD   PRO  36          2HD       PRO  36 -15.939  18.004 -17.079
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  11.847 -16.499   0.320
    2   2H5*    G   1          2H5*        G   1  12.195 -15.480   1.732
    3    H4*    G   1           H4*        G   1  11.050 -18.295   1.803
    4    H3*    G   1           H3*        G   1   9.802 -15.557   2.244
    5    H2*    G   1           H2*        G   1   8.359 -16.532   3.849
    6   2HO*    G   1          2HO*        G   1   7.705 -18.520   3.710
    7    H1*    G   1           H1*        G   1  10.299 -18.230   4.901
    8    H8     G   1           H8         G   1  11.831 -14.857   4.420
    9    H1     G   1           H1         G   1   7.744 -15.110   9.372
   10   1H2     G   1          1H2         G   1   6.379 -16.892   9.081
   11   2H2     G   1          2H2         G   1   7.073 -18.296   8.302
   12   1H5*    C   2          1H5*        C   2   5.928 -16.765   0.890
   13   2H5*    C   2          2H5*        C   2   7.086 -16.389   2.185
   14    H4*    C   2           H4*        C   2   4.821 -18.252   2.805
   15    H3*    C   2           H3*        C   2   4.563 -15.260   2.388
   16    H2*    C   2           H2*        C   2   3.251 -15.079   4.326
   17   2HO*    C   2          2HO*        C   2   3.012 -17.912   4.345
   18    H1*    C   2           H1*        C   2   4.592 -17.005   5.833
   19   1H4     C   2          1H4         C   2   6.756 -11.446   7.968
   20   2H4     C   2          2H4         C   2   7.921 -11.377   6.668
   21    H5     C   2           H5         C   2   7.706 -12.811   4.699
   22    H6     C   2           H6         C   2   6.928 -15.007   3.959
   23   1H5*    C   3          1H5*        C   3   0.334 -13.533   1.339
   24   2H5*    C   3          2H5*        C   3   1.548 -12.374   1.911
   25    H4*    C   3           H4*        C   3  -0.207 -14.220   3.533
   26    H3*    C   3           H3*        C   3   0.346 -11.252   3.420
   27    H2*    C   3           H2*        C   3   0.023 -11.053   5.728
   28   2HO*    C   3          2HO*        C   3  -0.668 -13.551   6.444
   29    H1*    C   3           H1*        C   3   1.206 -13.465   6.441
   30   1H4     C   3          1H4         C   3   5.597  -8.931   7.372
   31   2H4     C   3          2H4         C   3   5.938  -8.878   5.657
   32    H5     C   3           H5         C   3   5.049 -10.639   4.188
   33    H6     C   3           H6         C   3   3.264 -12.241   3.884
   34   1H5*    C   4          1H5*        C   4  -4.174 -10.196   4.573
   35   2H5*    C   4          2H5*        C   4  -2.423  -9.985   4.401
   36    H4*    C   4           H4*        C   4  -4.046  -9.725   6.949
   37    H3*    C   4           H3*        C   4  -2.644  -7.723   5.149
   38    H2*    C   4           H2*        C   4  -2.018  -6.466   7.007
   39   2HO*    C   4          2HO*        C   4  -3.370  -6.220   8.579
   40    H1*    C   4           H1*        C   4  -1.544  -8.613   8.711
   41   1H4     C   4          1H4         C   4   3.773  -6.211   5.876
   42   2H4     C   4          2H4         C   4   4.169  -7.900   5.675
   43    H5     C   4           H5         C   4   1.860  -8.817   4.653
   44    H6     C   4           H6         C   4  -0.339  -9.312   5.412
   45   1H5*    U   5          1H5*        U   5  -4.918  -4.389   6.207
   46   2H5*    U   5          2H5*        U   5  -3.621  -5.579   6.312
   47    H4*    U   5           H4*        U   5  -4.064  -3.984   8.773
   48    H3*    U   5           H3*        U   5  -2.998  -2.744   6.203
   49    H2*    U   5           H2*        U   5  -1.374  -1.628   7.484
   50   2HO*    U   5          2HO*        U   5  -2.551  -2.356   9.933
   51    H1*    U   5           H1*        U   5  -1.063  -3.677   9.389
   52    H3     U   5           H3         U   5   2.805  -2.493   7.179
   53    H5     U   5           H5         U   5   1.106  -5.640   5.003
   54    H6     U   5           H6         U   5  -0.933  -5.262   6.235
   55   1H5*    G   6          1H5*        G   6  -2.306  -0.232   7.496
   56   2H5*    G   6          2H5*        G   6  -2.694   1.246   8.391
   57    H4*    G   6           H4*        G   6  -1.895   2.619   6.716
   58    H3*    G   6           H3*        G   6  -2.589   0.379   4.781
   59    H2*    G   6           H2*        G   6  -0.972   1.192   3.310
   60   2HO*    G   6          2HO*        G   6  -0.454   3.257   3.146
   61    H1*    G   6           H1*        G   6   0.821   2.092   5.288
   62    H8     G   6           H8         G   6  -0.811  -1.401   5.148
   63    H1     G   6           H1         G   6   5.126  -1.014   2.708
   64   1H2     G   6          1H2         G   6   5.684   1.146   2.457
   65   2H2     G   6          2H2         G   6   4.935   2.319   3.526
   66   1H5*    A   7          1H5*        A   7  -4.523   1.554   0.771
   67   2H5*    A   7          2H5*        A   7  -3.483   0.114   0.786
   68    H4*    A   7           H4*        A   7  -2.783   1.579  -1.010
   69    H3*    A   7           H3*        A   7  -0.899   1.626   1.376
   70    H2*    A   7           H2*        A   7   0.494   3.103   0.150
   71   2HO*    A   7          2HO*        A   7  -0.541   3.305  -2.235
   72    H1*    A   7           H1*        A   7  -1.600   4.381  -1.192
   73    H8     A   7           H8         A   7  -2.486   4.506   2.392
   74   1H6     A   7          1H6         A   7   1.740   8.935   3.201
   75   2H6     A   7          2H6         A   7   0.161   8.400   3.731
   76    H2     A   7           H2         A   7   2.242   7.277  -0.955
   77   1H5*    A   8          1H5*        A   8   1.017   0.803  -1.650
   78   2H5*    A   8          2H5*        A   8   2.370  -0.313  -1.935
   79    H4*    A   8           H4*        A   8   3.238   1.893  -2.211
   80    H3*    A   8           H3*        A   8   3.884   0.705   0.507
   81    H2*    A   8           H2*        A   8   5.107   2.646   1.079
   82   2HO*    A   8          2HO*        A   8   5.130   4.265  -0.892
   83    H1*    A   8           H1*        A   8   3.362   4.440  -0.179
   84    H8     A   8           H8         A   8   1.254   1.978   1.639
   85   1H6     A   8          1H6         A   8   2.043   5.370   6.675
   86   2H6     A   8          2H6         A   8   1.779   3.687   6.278
   87    H2     A   8           H2         A   8   5.232   6.599   3.677
   88   1H5*    A   9          2H5*        A   9   8.504  -0.380  -2.368
   89   2H5*    A   9          1H5*        A   9   7.450   0.424  -1.187
   90    H4*    A   9           H4*        A   9   9.578   1.576  -2.607
   91    H3*    A   9           H3*        A   9   7.267   2.737  -1.031
   92    H2*    A   9           H2*        A   9   7.929   4.905  -1.710
   93   2HO*    A   9          2HO*        A   9   9.917   5.340  -2.600
   94    H1*    A   9           H1*        A   9   8.639   4.171  -4.310
   95    H8     A   9           H8         A   9   6.162   5.244  -1.906
   96   1H6     A   9          1H6         A   9   2.043   5.312  -4.642
   97   2H6     A   9          2H6         A   9   1.963   5.455  -6.384
   98    H2     A   9           H2         A   9   5.385   2.857  -7.812
   99   1H5*    A  10          1H5*        A  10   9.943   1.200   3.913
  100   2H5*    A  10          2H5*        A  10   8.327   1.667   3.348
  101    H4*    A  10           H4*        A  10  10.320   3.862   3.591
  102    H3*    A  10           H3*        A  10   9.239   2.304   5.941
  103    H2*    A  10           H2*        A  10   8.744   4.282   7.106
  104   2HO*    A  10          2HO*        A  10   9.834   6.082   6.861
  105    H1*    A  10           H1*        A  10   7.902   5.774   4.910
  106    H8     A  10           H8         A  10   6.150   2.865   3.993
  107   1H6     A  10          1H6         A  10   2.418   3.305   8.932
  108   2H6     A  10          2H6         A  10   2.540   2.716   7.289
  109    H2     A  10           H2         A  10   5.919   6.037   9.571
  110   1H5*    A  11          1H5*        A  11  10.346   4.879   9.118
  111   2H5*    A  11          2H5*        A  11  11.081   3.561  10.060
  112    H4*    A  11           H4*        A  11   8.704   4.471  10.715
  113    H3*    A  11           H3*        A  11   9.475   1.549  10.490
  114    H2*    A  11           H2*        A  11   7.270   0.919  11.024
  115   2HO*    A  11          2HO*        A  11   7.273   3.313  12.352
  116    H1*    A  11           H1*        A  11   5.988   2.981   9.665
  117    H8     A  11           H8         A  11   8.787   1.482   7.598
  118   1H6     A  11          1H6         A  11   5.095  -3.095   6.132
  119   2H6     A  11          2H6         A  11   5.796  -1.853   5.125
  120    H2     A  11           H2         A  11   2.834  -0.429   9.102
  121   1H5*    G  12          1H5*        G  12   8.858  -1.453  13.711
  122   2H5*    G  12          2H5*        G  12   8.846  -0.633  12.139
  123    H4*    G  12           H4*        G  12   6.637   0.248  13.819
  124    H3*    G  12           H3*        G  12   6.951  -2.716  13.287
  125    H2*    G  12           H2*        G  12   4.674  -2.860  12.686
  126   2HO*    G  12          2HO*        G  12   3.765  -0.383  13.133
  127    H1*    G  12           H1*        G  12   4.531  -0.382  11.396
  128    H8     G  12           H8         G  12   7.544  -1.425   9.850
  129    H1     G  12           H1         G  12   2.809  -5.453   8.240
  130   1H2     G  12          1H2         G  12   0.981  -4.950   9.455
  131   2H2     G  12          2H2         G  12   1.249  -4.361  11.080
  132   1H5*    G  13          1H5*        G  13   3.821  -2.947  15.886
  133   2H5*    G  13          2H5*        G  13   4.226  -3.857  17.357
  134    H4*    G  13           H4*        G  13   2.253  -4.857  16.471
  135    H3*    G  13           H3*        G  13   4.732  -6.404  15.727
  136    H2*    G  13           H2*        G  13   3.425  -7.933  14.549
  137   2HO*    G  13          2HO*        G  13   0.917  -7.099  15.017
  138    H1*    G  13           H1*        G  13   1.569  -6.113  13.556
  139    H8     G  13           H8         G  13   5.063  -4.763  13.181
  140    H1     G  13           H1         G  13   3.440  -9.068   8.691
  141   1H2     G  13          1H2         G  13   1.220  -9.668   9.125
  142   2H2     G  13          2H2         G  13   1.026 -10.062  10.818
  143   1H5*    G  14          1H5*        G  14   3.249  -9.928  17.941
  144   2H5*    G  14          2H5*        G  14   3.393  -8.943  16.477
  145    H4*    G  14           H4*        G  14   1.126 -10.904  16.715
  146    H3*    G  14           H3*        G  14   4.016 -11.569  16.112
  147    H2*    G  14           H2*        G  14   3.305 -13.026  14.397
  148   2HO*    G  14          2HO*        G  14   1.418 -14.003  14.387
  149    H1*    G  14           H1*        G  14   1.202 -11.439  13.503
  150    H8     G  14           H8         G  14   4.006  -9.094  14.041
  151    H1     G  14           H1         G  14   4.864 -12.825   8.863
  152   1H2     G  14          1H2         G  14   2.988 -14.201   8.725
  153   2H2     G  14          2H2         G  14   2.651 -14.926  10.281
  154   1H5*    C  15          1H5*        C  15   2.059 -14.878  16.207
  155   2H5*    C  15          2H5*        C  15   2.602 -16.204  17.262
  156    H4*    C  15           H4*        C  15   2.342 -17.161  15.090
  157    H3*    C  15           H3*        C  15   5.246 -16.516  15.681
  158    H2*    C  15           H2*        C  15   5.821 -17.443  13.590
  159   2HO*    C  15          2HO*        C  15   4.501 -19.368  13.916
  160    H1*    C  15           H1*        C  15   3.463 -16.633  12.276
  161   1H4     C  15          1H4         C  15   8.091 -12.909  10.072
  162   2H4     C  15          2H4         C  15   8.282 -12.134  11.634
  163    H5     C  15           H5         C  15   6.618 -12.494  13.407
  164    H6     C  15           H6         C  15   4.900 -13.976  14.220
  165   2H    ASP   2          2H        ASP   2   9.727  -9.806  -0.766
  166   1H    ASP   2          1H        ASP   2   9.541 -11.175  -1.757
  167   3H    ASP   2          3H        ASP   2  11.005 -10.913  -0.941
  168    HA   ASP   2           HA       ASP   2   9.932 -12.554   0.335
  169   1HB   ASP   2          1HB       ASP   2   9.208  -9.882   1.564
  170   2HB   ASP   2          2HB       ASP   2   9.660 -11.359   2.410
  171    H    ALA   3           H        ALA   3   7.822 -12.183   2.113
  172    HA   ALA   3           HA       ALA   3   5.522 -12.810   0.428
  173   1HB   ALA   3          1HB       ALA   3   5.867 -12.426   3.416
  174   2HB   ALA   3          2HB       ALA   3   4.455 -13.149   2.645
  175   3HB   ALA   3          3HB       ALA   3   6.021 -13.953   2.546
  176    H    GLN   4           H        GLN   4   6.532 -10.077   2.445
  177    HA   GLN   4           HA       GLN   4   4.031  -8.647   2.258
  178   1HB   GLN   4          1HB       GLN   4   5.973  -8.367   3.916
  179   2HB   GLN   4          2HB       GLN   4   6.811  -7.501   2.630
  180   1HG   GLN   4          1HG       GLN   4   4.960  -5.886   2.491
  181   2HG   GLN   4          2HG       GLN   4   4.098  -6.754   3.763
  182   1HE2  GLN   4          2HE2      GLN   4   5.655  -3.971   3.492
  183   2HE2  GLN   4          1HE2      GLN   4   6.508  -3.908   4.959
  184    H    THR   5           H        THR   5   7.149  -8.213   0.574
  185    HA   THR   5           HA       THR   5   6.379  -6.207  -1.254
  186    HB   THR   5           HB       THR   5   8.114  -8.659  -1.732
  187    HG1  THR   5           HG1      THR   5   9.762  -7.350  -0.951
  188   1HG2  THR   5          1HG2      THR   5   7.727  -6.040  -3.143
  189   2HG2  THR   5          2HG2      THR   5   9.299  -6.844  -3.201
  190   3HG2  THR   5          3HG2      THR   5   7.865  -7.663  -3.823
  191    H    ARG   6           H        ARG   6   5.791  -9.671  -1.233
  192    HA   ARG   6           HA       ARG   6   4.495  -9.852  -3.829
  193   1HB   ARG   6          1HB       ARG   6   5.179 -11.501  -1.544
  194   2HB   ARG   6          2HB       ARG   6   3.503 -11.797  -2.022
  195   1HG   ARG   6          1HG       ARG   6   4.492 -11.905  -4.449
  196   2HG   ARG   6          2HG       ARG   6   6.026 -12.187  -3.627
  197   1HD   ARG   6          1HD       ARG   6   3.533 -13.807  -3.023
  198   2HD   ARG   6          2HD       ARG   6   4.745 -14.307  -4.220
  199    HE   ARG   6           HE       ARG   6   5.100 -14.346  -1.330
  200   1HH1  ARG   6          1HH1      ARG   6   6.672 -13.943  -4.401
  201   2HH1  ARG   6          2HH1      ARG   6   8.218 -14.439  -3.806
  202   1HH2  ARG   6          1HH2      ARG   6   7.115 -14.991  -0.569
  203   2HH2  ARG   6          2HH2      ARG   6   8.469 -15.030  -1.648
  204    H    ARG   7           H        ARG   7   3.438  -9.612  -0.449
  205    HA   ARG   7           HA       ARG   7   0.653  -9.680  -0.881
  206   1HB   ARG   7          1HB       ARG   7   1.527  -9.887   1.315
  207   2HB   ARG   7          2HB       ARG   7   2.493  -8.427   1.149
  208   1HG   ARG   7          1HG       ARG   7   0.135  -7.256   0.876
  209   2HG   ARG   7          2HG       ARG   7  -0.440  -8.698   1.711
  210   1HD   ARG   7          1HD       ARG   7   0.244  -7.817   3.677
  211   2HD   ARG   7          2HD       ARG   7   1.908  -7.766   3.070
  212    HE   ARG   7           HE       ARG   7   0.017  -5.516   3.063
  213   1HH1  ARG   7          1HH1      ARG   7   2.885  -6.926   1.718
  214   2HH1  ARG   7          2HH1      ARG   7   3.505  -5.417   1.165
  215   1HH2  ARG   7          1HH2      ARG   7   0.830  -3.561   2.342
  216   2HH2  ARG   7          2HH2      ARG   7   2.349  -3.517   1.514
  217    H    ARG   8           H        ARG   8   2.980  -7.048  -1.177
  218    HA   ARG   8           HA       ARG   8   1.250  -4.799  -1.357
  219   1HB   ARG   8          1HB       ARG   8   3.886  -5.160  -1.430
  220   2HB   ARG   8          2HB       ARG   8   3.627  -5.169  -3.172
  221   1HG   ARG   8          1HG       ARG   8   4.044  -2.900  -2.701
  222   2HG   ARG   8          2HG       ARG   8   2.286  -2.985  -2.775
  223   1HD   ARG   8          1HD       ARG   8   3.085  -1.707  -0.775
  224   2HD   ARG   8          2HD       ARG   8   2.179  -3.160  -0.314
  225    HE   ARG   8           HE       ARG   8   4.186  -4.077   0.522
  226   1HH1  ARG   8          1HH1      ARG   8   4.832  -1.451  -1.652
  227   2HH1  ARG   8          2HH1      ARG   8   6.535  -1.467  -1.348
  228   1HH2  ARG   8          1HH2      ARG   8   6.400  -4.087   0.909
  229   2HH2  ARG   8          2HH2      ARG   8   7.419  -2.950   0.093
  230    H    GLU   9           H        GLU   9   2.219  -7.170  -3.806
  231    HA   GLU   9           HA       GLU   9   0.834  -5.938  -5.999
  232   1HB   GLU   9          1HB       GLU   9   1.498  -8.830  -5.329
  233   2HB   GLU   9          2HB       GLU   9   0.913  -8.304  -6.907
  234   1HG   GLU   9          1HG       GLU   9   3.085  -6.597  -6.160
  235   2HG   GLU   9          2HG       GLU   9   3.596  -8.268  -5.922
  236    H    ARG  10           H        ARG  10  -0.109  -7.968  -3.329
  237    HA   ARG  10           HA       ARG  10  -2.843  -8.408  -4.239
  238   1HB   ARG  10          1HB       ARG  10  -1.051  -9.176  -2.083
  239   2HB   ARG  10          2HB       ARG  10  -2.619  -8.696  -1.437
  240   1HG   ARG  10          1HG       ARG  10  -3.761 -10.370  -2.609
  241   2HG   ARG  10          2HG       ARG  10  -2.472 -10.546  -3.802
  242   1HD   ARG  10          1HD       ARG  10  -1.175 -11.881  -2.408
  243   2HD   ARG  10          2HD       ARG  10  -1.849 -11.165  -0.930
  244    HE   ARG  10           HE       ARG  10  -2.996 -13.396  -2.398
  245   1HH1  ARG  10          1HH1      ARG  10  -3.692 -10.601  -0.462
  246   2HH1  ARG  10          2HH1      ARG  10  -5.203 -11.224   0.105
  247   1HH2  ARG  10          1HH2      ARG  10  -4.963 -14.196  -1.656
  248   2HH2  ARG  10          2HH2      ARG  10  -5.921 -13.249  -0.567
  249    H    ARG  11           H        ARG  11  -1.057  -5.838  -2.796
  250    HA   ARG  11           HA       ARG  11  -3.461  -4.606  -1.581
  251   1HB   ARG  11          1HB       ARG  11  -0.553  -3.781  -1.818
  252   2HB   ARG  11          2HB       ARG  11  -1.785  -2.861  -0.960
  253   1HG   ARG  11          1HG       ARG  11  -0.910  -5.692  -0.319
  254   2HG   ARG  11          2HG       ARG  11  -0.520  -4.253   0.618
  255   1HD   ARG  11          1HD       ARG  11  -2.536  -4.292   1.676
  256   2HD   ARG  11          2HD       ARG  11  -3.410  -4.558   0.160
  257    HE   ARG  11           HE       ARG  11  -2.106  -6.961   0.574
  258   1HH1  ARG  11          1HH1      ARG  11  -4.223  -4.957   2.461
  259   2HH1  ARG  11          2HH1      ARG  11  -4.898  -6.290   3.335
  260   1HH2  ARG  11          1HH2      ARG  11  -2.991  -8.685   1.716
  261   2HH2  ARG  11          2HH2      ARG  11  -4.204  -8.389   2.916
  262    H    ALA  12           H        ALA  12  -2.253  -4.855  -4.686
  263    HA   ALA  12           HA       ALA  12  -2.224  -2.194  -5.706
  264   1HB   ALA  12          1HB       ALA  12  -3.338  -4.777  -6.888
  265   2HB   ALA  12          2HB       ALA  12  -2.938  -3.335  -7.822
  266   3HB   ALA  12          3HB       ALA  12  -1.664  -4.231  -6.996
  267    H    GLU  13           H        GLU  13  -4.842  -4.219  -4.565
  268    HA   GLU  13           HA       GLU  13  -6.994  -2.577  -5.654
  269   1HB   GLU  13          1HB       GLU  13  -6.873  -4.655  -3.434
  270   2HB   GLU  13          2HB       GLU  13  -8.358  -4.034  -4.156
  271   1HG   GLU  13          1HG       GLU  13  -6.417  -5.005  -6.139
  272   2HG   GLU  13          2HG       GLU  13  -6.981  -6.260  -5.035
  273    H    LYS  14           H        LYS  14  -5.102  -2.784  -2.664
  274    HA   LYS  14           HA       LYS  14  -6.733  -0.791  -1.250
  275   1HB   LYS  14          1HB       LYS  14  -3.963  -1.982  -0.785
  276   2HB   LYS  14          2HB       LYS  14  -4.857  -1.018   0.393
  277   1HG   LYS  14          1HG       LYS  14  -6.000  -3.539  -0.814
  278   2HG   LYS  14          2HG       LYS  14  -5.019  -3.560   0.653
  279   1HD   LYS  14          1HD       LYS  14  -6.598  -1.895   1.664
  280   2HD   LYS  14          2HD       LYS  14  -7.620  -2.057   0.235
  281   1HE   LYS  14          1HE       LYS  14  -7.583  -4.604   0.737
  282   2HE   LYS  14          2HE       LYS  14  -7.012  -4.128   2.348
  283   1HZ   LYS  14          1HZ       LYS  14  -9.434  -3.059   0.995
  284   2HZ   LYS  14          2HZ       LYS  14  -9.441  -4.196   2.254
  285   3HZ   LYS  14          3HZ       LYS  14  -8.880  -2.617   2.540
  286    H    GLN  15           H        GLN  15  -3.794  -0.985  -3.128
  287    HA   GLN  15           HA       GLN  15  -2.877   1.727  -2.773
  288   1HB   GLN  15          1HB       GLN  15  -2.221  -0.753  -4.171
  289   2HB   GLN  15          2HB       GLN  15  -1.915   0.642  -5.192
  290   1HG   GLN  15          1HG       GLN  15  -0.308   1.516  -3.754
  291   2HG   GLN  15          2HG       GLN  15  -1.001   0.714  -2.345
  292   1HE2  GLN  15          2HE2      GLN  15  -1.003  -1.875  -2.706
  293   2HE2  GLN  15          1HE2      GLN  15   0.482  -2.502  -3.238
  294    H    ALA  16           H        ALA  16  -4.564   0.020  -5.417
  295    HA   ALA  16           HA       ALA  16  -4.947   2.375  -7.042
  296   1HB   ALA  16          1HB       ALA  16  -6.475  -0.251  -6.851
  297   2HB   ALA  16          2HB       ALA  16  -6.595   0.888  -8.192
  298   3HB   ALA  16          3HB       ALA  16  -5.073   0.054  -7.877
  299    H    GLN  17           H        GLN  17  -6.696   0.999  -4.309
  300    HA   GLN  17           HA       GLN  17  -9.085   2.660  -4.706
  301   1HB   GLN  17          1HB       GLN  17  -7.948   0.824  -2.600
  302   2HB   GLN  17          2HB       GLN  17  -9.317   1.855  -2.198
  303   1HG   GLN  17          1HG       GLN  17 -10.663   0.883  -3.934
  304   2HG   GLN  17          2HG       GLN  17  -9.282   0.013  -4.598
  305   1HE2  GLN  17          2HE2      GLN  17 -10.652   0.359  -1.268
  306   2HE2  GLN  17          1HE2      GLN  17 -10.682  -1.308  -0.953
  307    H    TRP  18           H        TRP  18  -6.127   2.704  -2.818
  308    HA   TRP  18           HA       TRP  18  -6.714   5.160  -1.370
  309   1HB   TRP  18          1HB       TRP  18  -5.137   3.468  -0.542
  310   2HB   TRP  18          2HB       TRP  18  -4.193   3.594  -2.012
  311    HD1  TRP  18           HD1      TRP  18  -4.768   5.372   1.289
  312    HE1  TRP  18           HE1      TRP  18  -3.106   7.347   1.447
  313    HE3  TRP  18           HE3      TRP  18  -2.895   5.305  -3.391
  314    HZ2  TRP  18           HZ2      TRP  18  -1.215   8.695  -0.216
  315    HZ3  TRP  18           HZ3      TRP  18  -1.196   6.901  -4.099
  316    HH2  TRP  18           HH2      TRP  18  -0.333   8.584  -2.543
  317    H    LYS  19           H        LYS  19  -4.678   4.252  -4.110
  318    HA   LYS  19           HA       LYS  19  -3.633   6.809  -4.768
  319   1HB   LYS  19          1HB       LYS  19  -4.221   4.276  -6.326
  320   2HB   LYS  19          2HB       LYS  19  -3.445   5.668  -7.067
  321   1HG   LYS  19          1HG       LYS  19  -1.691   5.579  -5.281
  322   2HG   LYS  19          2HG       LYS  19  -2.409   4.074  -4.716
  323   1HD   LYS  19          1HD       LYS  19  -1.648   2.873  -6.512
  324   2HD   LYS  19          2HD       LYS  19  -1.813   4.235  -7.622
  325   1HE   LYS  19          1HE       LYS  19   0.386   4.719  -7.397
  326   2HE   LYS  19          2HE       LYS  19   0.204   4.846  -5.636
  327   1HZ   LYS  19          1HZ       LYS  19   0.168   2.368  -5.587
  328   2HZ   LYS  19          2HZ       LYS  19   0.614   2.373  -7.227
  329   3HZ   LYS  19          3HZ       LYS  19   1.660   3.028  -6.065
  330    H    ALA  20           H        ALA  20  -6.627   5.149  -5.593
  331    HA   ALA  20           HA       ALA  20  -7.560   6.914  -7.599
  332   1HB   ALA  20          1HB       ALA  20  -8.698   4.992  -5.637
  333   2HB   ALA  20          2HB       ALA  20  -9.827   6.101  -6.413
  334   3HB   ALA  20          3HB       ALA  20  -8.848   5.012  -7.394
  335    H    ALA  21           H        ALA  21  -7.478   7.170  -4.102
  336    HA   ALA  21           HA       ALA  21  -8.764   9.859  -4.305
  337   1HB   ALA  21          1HB       ALA  21  -8.962   7.597  -2.341
  338   2HB   ALA  21          2HB       ALA  21  -9.266   9.244  -1.786
  339   3HB   ALA  21          3HB       ALA  21 -10.261   8.546  -3.066
  340    H    ASN  22           H        ASN  22  -5.916   9.010  -4.473
  341    HA   ASN  22           HA       ASN  22  -4.854  11.027  -2.603
  342   1HB   ASN  22          1HB       ASN  22  -4.037   8.110  -2.516
  343   2HB   ASN  22          2HB       ASN  22  -3.196   9.411  -1.679
  344   1HD2  ASN  22          2HD2      ASN  22  -5.437   7.049  -1.165
  345   2HD2  ASN  22          1HD2      ASN  22  -6.311   7.743   0.115
  346    HA   PRO  23           HA       PRO  23  -2.571  10.292  -6.666
  347   1HB   PRO  23          1HB       PRO  23  -3.520  12.456  -8.053
  348   2HB   PRO  23          2HB       PRO  23  -4.283  10.856  -8.137
  349   1HG   PRO  23          1HG       PRO  23  -5.092  13.257  -6.586
  350   2HG   PRO  23          2HG       PRO  23  -6.094  12.046  -7.401
  351   1HD   PRO  23          1HD       PRO  23  -5.635  12.090  -4.702
  352   2HD   PRO  23          2HD       PRO  23  -6.054  10.625  -5.604
  353    H    LEU  24           H        LEU  24  -3.506  12.983  -4.653
  354    HA   LEU  24           HA       LEU  24  -1.467  14.875  -5.210
  355   1HB   LEU  24          1HB       LEU  24  -2.271  15.865  -3.243
  356   2HB   LEU  24          2HB       LEU  24  -3.599  14.767  -3.593
  357    HG   LEU  24           HG       LEU  24  -1.288  13.961  -1.803
  358   1HD1  LEU  24          1HD1      LEU  24  -2.740  16.079  -1.145
  359   2HD1  LEU  24          2HD1      LEU  24  -3.914  14.846  -0.686
  360   3HD1  LEU  24          3HD1      LEU  24  -2.316  14.861   0.058
  361   1HD2  LEU  24          1HD2      LEU  24  -3.332  12.467  -2.908
  362   2HD2  LEU  24          2HD2      LEU  24  -2.485  12.045  -1.421
  363   3HD2  LEU  24          3HD2      LEU  24  -4.017  12.920  -1.350
  364    H    LEU  25           H        LEU  25  -1.483  11.936  -3.304
  365    HA   LEU  25           HA       LEU  25   1.391  12.250  -2.600
  366   1HB   LEU  25          1HB       LEU  25  -1.016  10.769  -1.621
  367   2HB   LEU  25          2HB       LEU  25   0.539   9.955  -1.424
  368    HG   LEU  25           HG       LEU  25   0.318  12.831  -0.611
  369   1HD1  LEU  25          1HD1      LEU  25  -0.755  10.451   0.924
  370   2HD1  LEU  25          2HD1      LEU  25  -0.332  11.979   1.696
  371   3HD1  LEU  25          3HD1      LEU  25  -1.616  11.928   0.489
  372   1HD2  LEU  25          1HD2      LEU  25   2.383  11.119  -0.624
  373   2HD2  LEU  25          2HD2      LEU  25   2.207  12.351   0.626
  374   3HD2  LEU  25          3HD2      LEU  25   1.703  10.691   0.945
  375    H    VAL  26           H        VAL  26   0.397  11.835  -5.261
  376    HA   VAL  26           HA       VAL  26   1.841   9.370  -5.985
  377    HB   VAL  26           HB       VAL  26  -1.061   9.706  -5.755
  378   1HG1  VAL  26          1HG1      VAL  26   0.089   9.017  -8.471
  379   2HG1  VAL  26          2HG1      VAL  26  -1.498   8.450  -7.951
  380   3HG1  VAL  26          3HG1      VAL  26  -1.180  10.181  -8.079
  381   1HG2  VAL  26          1HG2      VAL  26   0.810   7.408  -6.412
  382   2HG2  VAL  26          2HG2      VAL  26   0.170   7.834  -4.822
  383   3HG2  VAL  26          3HG2      VAL  26  -0.914   7.217  -6.073
  384    H    GLY  27           H        GLY  27   3.233  10.259  -7.459
  385   1HA   GLY  27          1HA       GLY  27   3.969  11.389  -9.393
  386   2HA   GLY  27          2HA       GLY  27   2.285  11.408  -9.924
  387    H    VAL  28           H        VAL  28   0.873  13.021  -8.619
  388    HA   VAL  28           HA       VAL  28   1.861  15.677  -8.964
  389    HB   VAL  28           HB       VAL  28  -0.413  14.589  -7.273
  390   1HG1  VAL  28          1HG1      VAL  28   0.465  17.091  -7.079
  391   2HG1  VAL  28          2HG1      VAL  28  -0.423  17.280  -8.590
  392   3HG1  VAL  28          3HG1      VAL  28  -1.263  16.744  -7.136
  393   1HG2  VAL  28          1HG2      VAL  28  -0.098  14.209  -9.936
  394   2HG2  VAL  28          2HG2      VAL  28  -1.677  14.442  -9.185
  395   3HG2  VAL  28          3HG2      VAL  28  -0.857  15.801  -9.954
  396    H    SER  29           H        SER  29   2.535  17.218  -7.390
  397    HA   SER  29           HA       SER  29   3.731  17.916  -5.480
  398   1HB   SER  29          1HB       SER  29   1.646  15.982  -4.465
  399   2HB   SER  29          2HB       SER  29   2.704  16.853  -3.358
  400    HG   SER  29           HG       SER  29   1.037  18.015  -5.348
  401    H    ALA  30           H        ALA  30   4.756  16.720  -3.304
  402    HA   ALA  30           HA       ALA  30   6.565  15.372  -2.605
  403   1HB   ALA  30          1HB       ALA  30   4.582  13.664  -4.036
  404   2HB   ALA  30          2HB       ALA  30   6.138  12.929  -3.653
  405   3HB   ALA  30          3HB       ALA  30   5.129  13.583  -2.361
  406    H    LYS  31           H        LYS  31   7.457  16.981  -4.597
  407    HA   LYS  31           HA       LYS  31   9.114  15.140  -6.286
  408   1HB   LYS  31          1HB       LYS  31   7.611  17.669  -7.008
  409   2HB   LYS  31          2HB       LYS  31   8.877  16.996  -8.036
  410   1HG   LYS  31          1HG       LYS  31   6.791  15.092  -7.112
  411   2HG   LYS  31          2HG       LYS  31   6.275  16.307  -8.282
  412   1HD   LYS  31          1HD       LYS  31   7.607  15.464  -9.954
  413   2HD   LYS  31          2HD       LYS  31   8.853  14.920  -8.830
  414   1HE   LYS  31          1HE       LYS  31   7.470  13.023  -8.143
  415   2HE   LYS  31          2HE       LYS  31   6.139  13.593  -9.169
  416   1HZ   LYS  31          1HZ       LYS  31   8.870  13.061 -10.198
  417   2HZ   LYS  31          2HZ       LYS  31   7.632  11.897 -10.227
  418   3HZ   LYS  31          3HZ       LYS  31   7.457  13.340 -11.101
  419    HA   PRO  32           HA       PRO  32  11.685  18.220  -3.975
  420   1HB   PRO  32          1HB       PRO  32  13.270  16.426  -2.661
  421   2HB   PRO  32          2HB       PRO  32  11.713  16.986  -2.021
  422   1HG   PRO  32          1HG       PRO  32  12.415  14.412  -3.293
  423   2HG   PRO  32          2HG       PRO  32  11.206  14.771  -2.053
  424   1HD   PRO  32          1HD       PRO  32  10.698  14.358  -4.766
  425   2HD   PRO  32          2HD       PRO  32   9.580  15.092  -3.598
  426    H    VAL  33           H        VAL  33  12.293  18.298  -6.424
  427    HA   VAL  33           HA       VAL  33  15.080  17.266  -6.712
  428    HB   VAL  33           HB       VAL  33  14.497  16.535  -9.016
  429   1HG1  VAL  33          1HG1      VAL  33  14.106  15.161  -6.758
  430   2HG1  VAL  33          2HG1      VAL  33  12.430  15.230  -7.301
  431   3HG1  VAL  33          3HG1      VAL  33  13.661  14.498  -8.331
  432   1HG2  VAL  33          1HG2      VAL  33  11.740  17.450  -8.153
  433   2HG2  VAL  33          2HG2      VAL  33  12.669  18.003  -9.546
  434   3HG2  VAL  33          3HG2      VAL  33  12.006  16.368  -9.521
  435    H    ASN  34           H        ASN  34  16.427  18.722  -7.796
  436    HA   ASN  34           HA       ASN  34  15.670  21.466  -8.027
  437   1HB   ASN  34          1HB       ASN  34  17.867  21.614  -9.231
  438   2HB   ASN  34          2HB       ASN  34  17.972  20.693  -7.731
  439   1HD2  ASN  34          2HD2      ASN  34  18.057  20.429 -11.259
  440   2HD2  ASN  34          1HD2      ASN  34  18.583  18.816 -11.302
  441    H    ARG  35           H        ARG  35  14.756  22.598  -9.723
  442    HA   ARG  35           HA       ARG  35  14.022  21.047 -12.167
  443   1HB   ARG  35          1HB       ARG  35  13.011  23.622 -10.919
  444   2HB   ARG  35          2HB       ARG  35  12.367  22.923 -12.403
  445   1HG   ARG  35          1HG       ARG  35  12.458  21.483  -9.736
  446   2HG   ARG  35          2HG       ARG  35  11.034  22.303 -10.376
  447   1HD   ARG  35          1HD       ARG  35  12.482  19.964 -11.674
  448   2HD   ARG  35          2HD       ARG  35  10.875  19.923 -10.924
  449    HE   ARG  35           HE       ARG  35  11.501  21.040 -13.546
  450   1HH1  ARG  35          1HH1      ARG  35   9.420  21.209 -10.771
  451   2HH1  ARG  35          2HH1      ARG  35   8.108  21.913 -11.654
  452   1HH2  ARG  35          1HH2      ARG  35   9.789  21.954 -14.680
  453   2HH2  ARG  35          2HH2      ARG  35   8.314  22.332 -13.854
  454    HA   PRO  36           HA       PRO  36  17.338  23.688 -13.841
  455   1HB   PRO  36          1HB       PRO  36  17.849  22.091 -16.004
  456   2HB   PRO  36          2HB       PRO  36  18.540  21.790 -14.398
  457   1HG   PRO  36          1HG       PRO  36  16.224  20.486 -15.735
  458   2HG   PRO  36          2HG       PRO  36  17.480  19.778 -14.708
  459   1HD   PRO  36          1HD       PRO  36  14.965  20.351 -13.829
  460   2HD   PRO  36          2HD       PRO  36  16.394  20.332 -12.774
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  11.137 -16.603   0.275
    2   2H5*    G   1          2H5*        G   1  11.723 -15.396   1.440
    3    H4*    G   1           H4*        G   1  11.632 -18.296   2.232
    4    H3*    G   1           H3*        G   1   9.267 -16.385   2.116
    5    H2*    G   1           H2*        G   1   8.527 -17.232   4.202
    6   2HO*    G   1          2HO*        G   1   8.933 -19.230   4.867
    7    H1*    G   1           H1*        G   1  11.082 -17.679   5.241
    8    H8     G   1           H8         G   1  10.766 -14.233   3.769
    9    H1     G   1           H1         G   1   8.129 -14.872   9.593
   10   1H2     G   1          1H2         G   1   7.670 -17.129   9.884
   11   2H2     G   1          2H2         G   1   8.995 -18.146   9.363
   12   1H5*    C   2          1H5*        C   2   6.001 -15.989   0.884
   13   2H5*    C   2          2H5*        C   2   7.341 -16.238   2.021
   14    H4*    C   2           H4*        C   2   5.185 -18.087   2.586
   15    H3*    C   2           H3*        C   2   4.501 -15.150   2.350
   16    H2*    C   2           H2*        C   2   3.305 -15.233   4.367
   17   2HO*    C   2          2HO*        C   2   3.335 -18.052   4.006
   18    H1*    C   2           H1*        C   2   5.003 -17.026   5.683
   19   1H4     C   2          1H4         C   2   6.105 -11.023   7.630
   20   2H4     C   2          2H4         C   2   7.673 -11.168   6.867
   21    H5     C   2           H5         C   2   7.317 -12.327   4.557
   22    H6     C   2           H6         C   2   7.067 -14.716   3.931
   23   1H5*    C   3          1H5*        C   3   0.178 -13.830   1.587
   24   2H5*    C   3          2H5*        C   3   1.346 -12.574   2.035
   25    H4*    C   3           H4*        C   3  -0.117 -14.505   3.839
   26    H3*    C   3           H3*        C   3   0.092 -11.499   3.588
   27    H2*    C   3           H2*        C   3  -0.101 -11.257   5.916
   28   2HO*    C   3          2HO*        C   3  -1.844 -13.003   5.896
   29    H1*    C   3           H1*        C   3   1.387 -13.506   6.616
   30   1H4     C   3          1H4         C   3   5.213  -8.405   7.071
   31   2H4     C   3          2H4         C   3   5.610  -8.552   5.374
   32    H5     C   3           H5         C   3   4.943 -10.574   4.148
   33    H6     C   3           H6         C   3   3.139 -12.198   3.894
   34   1H5*    C   4          1H5*        C   4  -3.723 -11.547   5.634
   35   2H5*    C   4          2H5*        C   4  -4.684 -10.251   4.885
   36    H4*    C   4           H4*        C   4  -4.156  -9.912   7.333
   37    H3*    C   4           H3*        C   4  -3.158  -7.852   5.314
   38    H2*    C   4           H2*        C   4  -2.308  -6.610   7.107
   39   2HO*    C   4          2HO*        C   4  -2.915  -7.119   9.299
   40    H1*    C   4           H1*        C   4  -1.599  -8.810   8.710
   41   1H4     C   4          1H4         C   4   3.978  -6.959   6.407
   42   2H4     C   4          2H4         C   4   3.382  -6.945   4.766
   43    H5     C   4           H5         C   4   1.543  -8.689   4.466
   44    H6     C   4           H6         C   4  -0.540  -9.411   5.372
   45   1H5*    U   5          1H5*        U   5  -5.150  -5.876   8.293
   46   2H5*    U   5          2H5*        U   5  -6.312  -4.666   7.697
   47    H4*    U   5           H4*        U   5  -4.904  -3.536   9.243
   48    H3*    U   5           H3*        U   5  -4.055  -2.951   6.395
   49    H2*    U   5           H2*        U   5  -2.411  -1.503   7.269
   50   2HO*    U   5          2HO*        U   5  -2.911  -1.467   9.891
   51    H1*    U   5           H1*        U   5  -1.937  -3.012   9.600
   52    H3     U   5           H3         U   5   1.964  -2.464   7.351
   53    H5     U   5           H5         U   5   0.130  -5.764   5.576
   54    H6     U   5           H6         U   5  -1.958  -5.023   6.586
   55   1H5*    G   6          1H5*        G   6  -2.108   0.293   7.996
   56   2H5*    G   6          2H5*        G   6  -3.290   1.619   7.970
   57    H4*    G   6           H4*        G   6  -1.888   2.656   6.543
   58    H3*    G   6           H3*        G   6  -2.767   0.377   4.729
   59    H2*    G   6           H2*        G   6  -1.165   1.078   3.160
   60   2HO*    G   6          2HO*        G   6  -0.270   3.369   4.322
   61    H1*    G   6           H1*        G   6   0.737   1.943   5.056
   62    H8     G   6           H8         G   6  -1.117  -1.458   4.975
   63    H1     G   6           H1         G   6   4.871  -1.458   2.619
   64   1H2     G   6          1H2         G   6   5.574   0.679   2.389
   65   2H2     G   6          2H2         G   6   4.909   1.867   3.496
   66   1H5*    A   7          1H5*        A   7  -4.515   1.823   0.584
   67   2H5*    A   7          2H5*        A   7  -3.604   0.300   0.604
   68    H4*    A   7           H4*        A   7  -2.722   1.713  -1.146
   69    H3*    A   7           H3*        A   7  -0.923   1.592   1.299
   70    H2*    A   7           H2*        A   7   0.626   2.959   0.135
   71   2HO*    A   7          2HO*        A   7   0.419   3.305  -2.130
   72    H1*    A   7           H1*        A   7  -1.313   4.420  -1.256
   73    H8     A   7           H8         A   7  -2.332   4.567   2.286
   74   1H6     A   7          1H6         A   7   0.540   8.636   3.521
   75   2H6     A   7          2H6         A   7   2.227   8.191   3.645
   76    H2     A   7           H2         A   7   2.758   6.982  -0.800
   77   1H5*    A   8          1H5*        A   8   1.120   0.586  -1.704
   78   2H5*    A   8          2H5*        A   8   2.396  -0.651  -1.781
   79    H4*    A   8           H4*        A   8   3.412   1.498  -2.163
   80    H3*    A   8           H3*        A   8   3.890   0.389   0.620
   81    H2*    A   8           H2*        A   8   5.168   2.285   1.188
   82   2HO*    A   8          2HO*        A   8   5.946   2.198  -1.298
   83    H1*    A   8           H1*        A   8   3.614   4.131  -0.229
   84    H8     A   8           H8         A   8   1.335   1.794   1.616
   85   1H6     A   8          1H6         A   8   1.176   4.147   5.887
   86   2H6     A   8          2H6         A   8   2.300   5.232   6.675
   87    H2     A   8           H2         A   8   5.195   6.571   3.517
   88   1H5*    A   9          2H5*        A   9   8.425  -1.253  -2.063
   89   2H5*    A   9          1H5*        A   9   7.434  -0.284  -0.954
   90    H4*    A   9           H4*        A   9   9.695   0.561  -2.398
   91    H3*    A   9           H3*        A   9   7.520   2.040  -0.895
   92    H2*    A   9           H2*        A   9   8.423   4.085  -1.666
   93   2HO*    A   9          2HO*        A   9  10.514   3.600  -3.067
   94    H1*    A   9           H1*        A   9   9.059   3.157  -4.223
   95    H8     A   9           H8         A   9   6.698   4.601  -1.889
   96   1H6     A   9          1H6         A   9   2.892   5.574  -6.240
   97   2H6     A   9          2H6         A   9   2.368   4.597  -4.887
   98    H2     A   9           H2         A   9   5.727   2.111  -7.723
   99   1H5*    A  10          1H5*        A  10   9.875   0.873   4.237
  100   2H5*    A  10          2H5*        A  10   8.259   1.255   3.610
  101    H4*    A  10           H4*        A  10  10.204   3.509   3.803
  102    H3*    A  10           H3*        A  10   8.994   2.080   6.171
  103    H2*    A  10           H2*        A  10   8.414   4.118   7.182
  104   2HO*    A  10          2HO*        A  10  10.577   5.023   5.812
  105    H1*    A  10           H1*        A  10   7.689   5.462   4.854
  106    H8     A  10           H8         A  10   6.069   2.414   4.071
  107   1H6     A  10          1H6         A  10   1.747   3.522   8.274
  108   2H6     A  10          2H6         A  10   2.465   2.136   7.485
  109    H2     A  10           H2         A  10   5.354   6.081   9.291
  110   1H5*    A  11          1H5*        A  11   9.871   4.449   8.691
  111   2H5*    A  11          2H5*        A  11  10.548   3.548  10.066
  112    H4*    A  11           H4*        A  11   8.204   4.418  10.423
  113    H3*    A  11           H3*        A  11   8.753   1.440  10.536
  114    H2*    A  11           H2*        A  11   6.473   1.058  11.023
  115   2HO*    A  11          2HO*        A  11   6.474   3.777  11.751
  116    H1*    A  11           H1*        A  11   5.449   3.036   9.377
  117    H8     A  11           H8         A  11   8.167   1.182   7.546
  118   1H6     A  11          1H6         A  11   3.799  -2.566   5.550
  119   2H6     A  11          2H6         A  11   5.426  -2.857   6.114
  120    H2     A  11           H2         A  11   2.103  -0.252   9.106
  121   1H5*    G  12          1H5*        G  12   8.709  -1.443  13.512
  122   2H5*    G  12          2H5*        G  12   8.589  -0.578  11.970
  123    H4*    G  12           H4*        G  12   6.419   0.131  13.783
  124    H3*    G  12           H3*        G  12   6.816  -2.782  13.093
  125    H2*    G  12           H2*        G  12   4.511  -2.966  12.583
  126   2HO*    G  12          2HO*        G  12   3.061  -1.859  13.615
  127    H1*    G  12           H1*        G  12   4.256  -0.444  11.393
  128    H8     G  12           H8         G  12   7.244  -1.362   9.725
  129    H1     G  12           H1         G  12   2.557  -5.463   8.154
  130   1H2     G  12          1H2         G  12   0.942  -5.383   9.637
  131   2H2     G  12          2H2         G  12   0.908  -4.181  10.908
  132   1H5*    G  13          1H5*        G  13   4.338  -3.364  16.403
  133   2H5*    G  13          2H5*        G  13   4.996  -4.452  17.643
  134    H4*    G  13           H4*        G  13   2.972  -5.439  16.798
  135    H3*    G  13           H3*        G  13   5.465  -6.688  15.611
  136    H2*    G  13           H2*        G  13   4.130  -8.156  14.390
  137   2HO*    G  13          2HO*        G  13   1.739  -8.103  14.839
  138    H1*    G  13           H1*        G  13   2.040  -6.352  13.906
  139    H8     G  13           H8         G  13   5.263  -4.663  13.085
  140    H1     G  13           H1         G  13   3.466  -8.998   8.692
  141   1H2     G  13          1H2         G  13   1.434  -9.881   9.424
  142   2H2     G  13          2H2         G  13   1.547 -10.340  11.108
  143   1H5*    G  14          1H5*        G  14   0.976  -9.396  16.510
  144   2H5*    G  14          2H5*        G  14   1.149 -10.147  18.112
  145    H4*    G  14           H4*        G  14   0.956 -12.077  16.887
  146    H3*    G  14           H3*        G  14   3.858 -11.329  16.437
  147    H2*    G  14           H2*        G  14   4.041 -13.255  15.062
  148   2HO*    G  14          2HO*        G  14   1.508 -14.020  16.101
  149    H1*    G  14           H1*        G  14   1.531 -12.960  13.876
  150    H8     G  14           H8         G  14   3.644  -9.802  14.356
  151    H1     G  14           H1         G  14   4.799 -13.039   8.913
  152   1H2     G  14          1H2         G  14   3.885 -15.072   9.078
  153   2H2     G  14          2H2         G  14   2.460 -15.261  10.077
  154   1H5*    C  15          1H5*        C  15   3.540 -15.323  17.071
  155   2H5*    C  15          2H5*        C  15   4.582 -15.888  18.400
  156    H4*    C  15           H4*        C  15   5.009 -17.425  16.667
  157    H3*    C  15           H3*        C  15   7.097 -15.229  16.641
  158    H2*    C  15           H2*        C  15   8.156 -16.333  14.844
  159   2HO*    C  15          2HO*        C  15   8.148 -18.432  15.780
  160    H1*    C  15           H1*        C  15   5.776 -17.318  13.695
  161   1H4     C  15          1H4         C  15   7.450 -12.652   9.781
  162   2H4     C  15          2H4         C  15   7.588 -11.497  11.101
  163    H5     C  15           H5         C  15   6.521 -12.020  13.269
  164    H6     C  15           H6         C  15   5.829 -13.818  14.734
  165   2H    ASP   2          2H        ASP   2   9.400 -13.607  -1.394
  166   1H    ASP   2          1H        ASP   2   9.469 -14.643  -0.054
  167   3H    ASP   2          3H        ASP   2  10.763 -13.594  -0.380
  168    HA   ASP   2           HA       ASP   2   9.561 -12.605   1.401
  169   1HB   ASP   2          1HB       ASP   2   8.732 -11.345  -1.229
  170   2HB   ASP   2          2HB       ASP   2   8.970 -10.515   0.306
  171    H    ALA   3           H        ALA   3   7.252 -11.054   1.076
  172    HA   ALA   3           HA       ALA   3   4.973 -12.722   0.317
  173   1HB   ALA   3          1HB       ALA   3   5.843 -13.716   2.448
  174   2HB   ALA   3          2HB       ALA   3   5.532 -12.173   3.243
  175   3HB   ALA   3          3HB       ALA   3   4.193 -13.114   2.586
  176    H    GLN   4           H        GLN   4   6.104  -9.969   2.263
  177    HA   GLN   4           HA       GLN   4   3.598  -8.531   2.161
  178   1HB   GLN   4          1HB       GLN   4   5.498  -8.204   3.791
  179   2HB   GLN   4          2HB       GLN   4   6.438  -7.501   2.478
  180   1HG   GLN   4          1HG       GLN   4   4.859  -5.698   2.214
  181   2HG   GLN   4          2HG       GLN   4   3.734  -6.448   3.344
  182   1HE2  GLN   4          2HE2      GLN   4   5.369  -3.800   3.425
  183   2HE2  GLN   4          1HE2      GLN   4   6.108  -3.843   4.951
  184    H    THR   5           H        THR   5   6.682  -8.055   0.434
  185    HA   THR   5           HA       THR   5   5.861  -6.103  -1.429
  186    HB   THR   5           HB       THR   5   7.655  -8.535  -1.798
  187    HG1  THR   5           HG1      THR   5   8.193  -5.859  -1.026
  188   1HG2  THR   5          1HG2      THR   5   7.260  -6.013  -3.401
  189   2HG2  THR   5          2HG2      THR   5   8.755  -6.945  -3.489
  190   3HG2  THR   5          3HG2      THR   5   7.226  -7.684  -3.964
  191    H    ARG   6           H        ARG   6   5.251  -9.547  -1.249
  192    HA   ARG   6           HA       ARG   6   3.971  -9.860  -3.842
  193   1HB   ARG   6          1HB       ARG   6   4.665 -11.391  -1.485
  194   2HB   ARG   6          2HB       ARG   6   2.981 -11.700  -1.917
  195   1HG   ARG   6          1HG       ARG   6   3.645 -12.274  -4.207
  196   2HG   ARG   6          2HG       ARG   6   5.328 -11.897  -3.838
  197   1HD   ARG   6          1HD       ARG   6   4.817 -14.366  -3.728
  198   2HD   ARG   6          2HD       ARG   6   5.410 -13.714  -2.188
  199    HE   ARG   6           HE       ARG   6   3.263 -14.072  -1.269
  200   1HH1  ARG   6          1HH1      ARG   6   3.156 -14.112  -4.740
  201   2HH1  ARG   6          2HH1      ARG   6   1.493 -14.587  -4.798
  202   1HH2  ARG   6          1HH2      ARG   6   1.105 -14.687  -1.359
  203   2HH2  ARG   6          2HH2      ARG   6   0.337 -14.911  -2.895
  204    H    ARG   7           H        ARG   7   2.883  -9.524  -0.473
  205    HA   ARG   7           HA       ARG   7   0.104  -9.561  -0.960
  206   1HB   ARG   7          1HB       ARG   7   1.031  -9.730   1.264
  207   2HB   ARG   7          2HB       ARG   7   1.826  -8.162   1.109
  208   1HG   ARG   7          1HG       ARG   7  -0.500  -7.150   0.816
  209   2HG   ARG   7          2HG       ARG   7  -1.145  -8.713   1.313
  210   1HD   ARG   7          1HD       ARG   7  -0.437  -8.453   3.496
  211   2HD   ARG   7          2HD       ARG   7   0.955  -7.456   3.042
  212    HE   ARG   7           HE       ARG   7  -0.458  -5.575   3.170
  213   1HH1  ARG   7          1HH1      ARG   7  -2.312  -8.473   2.809
  214   2HH1  ARG   7          2HH1      ARG   7  -3.825  -7.658   2.977
  215   1HH2  ARG   7          1HH2      ARG   7  -2.386  -4.519   3.387
  216   2HH2  ARG   7          2HH2      ARG   7  -3.868  -5.404   3.306
  217    H    ARG   8           H        ARG   8   2.479  -6.972  -1.212
  218    HA   ARG   8           HA       ARG   8   0.793  -4.709  -1.445
  219   1HB   ARG   8          1HB       ARG   8   3.470  -5.275  -1.592
  220   2HB   ARG   8          2HB       ARG   8   3.122  -4.935  -3.285
  221   1HG   ARG   8          1HG       ARG   8   3.689  -2.828  -2.367
  222   2HG   ARG   8          2HG       ARG   8   1.928  -2.819  -2.429
  223   1HD   ARG   8          1HD       ARG   8   2.819  -1.999  -0.230
  224   2HD   ARG   8          2HD       ARG   8   1.819  -3.453  -0.049
  225    HE   ARG   8           HE       ARG   8   3.761  -4.633   0.589
  226   1HH1  ARG   8          1HH1      ARG   8   4.578  -1.735  -1.121
  227   2HH1  ARG   8          2HH1      ARG   8   6.279  -1.926  -0.875
  228   1HH2  ARG   8          1HH2      ARG   8   5.979  -4.875   0.905
  229   2HH2  ARG   8          2HH2      ARG   8   7.069  -3.693   0.265
  230    H    GLU   9           H        GLU   9   1.725  -7.155  -3.832
  231    HA   GLU   9           HA       GLU   9   0.461  -5.907  -6.092
  232   1HB   GLU   9          1HB       GLU   9   0.953  -8.819  -5.355
  233   2HB   GLU   9          2HB       GLU   9   0.477  -8.276  -6.963
  234   1HG   GLU   9          1HG       GLU   9   2.682  -6.666  -6.185
  235   2HG   GLU   9          2HG       GLU   9   3.109  -8.332  -5.794
  236    H    ARG  10           H        ARG  10  -0.623  -7.890  -3.424
  237    HA   ARG  10           HA       ARG  10  -3.361  -8.182  -4.380
  238   1HB   ARG  10          1HB       ARG  10  -1.650  -9.138  -2.271
  239   2HB   ARG  10          2HB       ARG  10  -3.120  -8.479  -1.551
  240   1HG   ARG  10          1HG       ARG  10  -4.492 -10.028  -2.592
  241   2HG   ARG  10          2HG       ARG  10  -3.386 -10.248  -3.948
  242   1HD   ARG  10          1HD       ARG  10  -1.814 -11.473  -2.471
  243   2HD   ARG  10          2HD       ARG  10  -2.951 -11.282  -1.121
  244    HE   ARG  10           HE       ARG  10  -3.271 -13.119  -3.363
  245   1HH1  ARG  10          1HH1      ARG  10  -4.898 -11.154  -1.007
  246   2HH1  ARG  10          2HH1      ARG  10  -6.340 -12.109  -1.036
  247   1HH2  ARG  10          1HH2      ARG  10  -5.150 -14.352  -3.390
  248   2HH2  ARG  10          2HH2      ARG  10  -6.483 -13.911  -2.376
  249    H    ARG  11           H        ARG  11  -1.473  -5.707  -2.947
  250    HA   ARG  11           HA       ARG  11  -3.849  -4.349  -1.798
  251   1HB   ARG  11          1HB       ARG  11  -0.881  -3.719  -1.832
  252   2HB   ARG  11          2HB       ARG  11  -2.107  -2.741  -1.023
  253   1HG   ARG  11          1HG       ARG  11  -1.382  -5.627  -0.389
  254   2HG   ARG  11          2HG       ARG  11  -1.081  -4.231   0.626
  255   1HD   ARG  11          1HD       ARG  11  -3.171  -4.370   1.506
  256   2HD   ARG  11          2HD       ARG  11  -3.898  -4.372  -0.102
  257    HE   ARG  11           HE       ARG  11  -2.583  -6.894   0.519
  258   1HH1  ARG  11          1HH1      ARG  11  -5.491  -5.023   0.848
  259   2HH1  ARG  11          2HH1      ARG  11  -6.504  -6.412   1.032
  260   1HH2  ARG  11          1HH2      ARG  11  -3.916  -8.691   0.759
  261   2HH2  ARG  11          2HH2      ARG  11  -5.620  -8.477   0.982
  262    H    ALA  12           H        ALA  12  -2.540  -4.671  -4.825
  263    HA   ALA  12           HA       ALA  12  -2.222  -2.010  -5.811
  264   1HB   ALA  12          1HB       ALA  12  -3.464  -4.492  -7.075
  265   2HB   ALA  12          2HB       ALA  12  -2.917  -3.078  -7.975
  266   3HB   ALA  12          3HB       ALA  12  -1.752  -4.068  -7.096
  267    H    GLU  13           H        GLU  13  -5.045  -3.835  -4.836
  268    HA   GLU  13           HA       GLU  13  -7.006  -2.026  -6.016
  269   1HB   GLU  13          1HB       GLU  13  -7.108  -4.155  -3.845
  270   2HB   GLU  13          2HB       GLU  13  -8.534  -3.366  -4.519
  271   1HG   GLU  13          1HG       GLU  13  -7.364  -4.135  -6.815
  272   2HG   GLU  13          2HG       GLU  13  -6.728  -5.389  -5.749
  273    H    LYS  14           H        LYS  14  -5.273  -2.376  -2.950
  274    HA   LYS  14           HA       LYS  14  -6.806  -0.264  -1.600
  275   1HB   LYS  14          1HB       LYS  14  -4.160  -1.656  -1.009
  276   2HB   LYS  14          2HB       LYS  14  -5.051  -0.646   0.131
  277   1HG   LYS  14          1HG       LYS  14  -6.414  -2.989  -1.163
  278   2HG   LYS  14          2HG       LYS  14  -5.351  -3.241   0.222
  279   1HD   LYS  14          1HD       LYS  14  -6.865  -1.099   1.054
  280   2HD   LYS  14          2HD       LYS  14  -8.033  -2.034   0.118
  281   1HE   LYS  14          1HE       LYS  14  -6.255  -3.471   2.074
  282   2HE   LYS  14          2HE       LYS  14  -7.689  -2.610   2.666
  283   1HZ   LYS  14          1HZ       LYS  14  -7.676  -4.566   0.428
  284   2HZ   LYS  14          2HZ       LYS  14  -8.209  -4.902   2.006
  285   3HZ   LYS  14          3HZ       LYS  14  -9.039  -3.769   1.055
  286    H    GLN  15           H        GLN  15  -3.820  -0.701  -3.350
  287    HA   GLN  15           HA       GLN  15  -2.681   1.917  -2.939
  288   1HB   GLN  15          1HB       GLN  15  -2.209  -0.597  -4.355
  289   2HB   GLN  15          2HB       GLN  15  -1.717   0.782  -5.322
  290   1HG   GLN  15          1HG       GLN  15  -0.112   1.465  -3.777
  291   2HG   GLN  15          2HG       GLN  15  -0.945   0.685  -2.434
  292   1HE2  GLN  15          2HE2      GLN  15  -1.130  -1.858  -2.790
  293   2HE2  GLN  15          1HE2      GLN  15   0.289  -2.618  -3.327
  294    H    ALA  16           H        ALA  16  -4.409   0.396  -5.669
  295    HA   ALA  16           HA       ALA  16  -4.498   2.809  -7.265
  296   1HB   ALA  16          1HB       ALA  16  -4.746   0.436  -8.066
  297   2HB   ALA  16          2HB       ALA  16  -6.320   0.372  -7.274
  298   3HB   ALA  16          3HB       ALA  16  -6.055   1.481  -8.619
  299    H    GLN  17           H        GLN  17  -6.487   1.542  -4.648
  300    HA   GLN  17           HA       GLN  17  -8.711   3.397  -5.188
  301   1HB   GLN  17          1HB       GLN  17  -7.905   1.432  -3.041
  302   2HB   GLN  17          2HB       GLN  17  -9.229   2.555  -2.747
  303   1HG   GLN  17          1HG       GLN  17  -9.107   0.778  -5.192
  304   2HG   GLN  17          2HG       GLN  17  -9.916   0.300  -3.700
  305   1HE2  GLN  17          2HE2      GLN  17 -10.100   2.465  -6.480
  306   2HE2  GLN  17          1HE2      GLN  17 -11.660   3.047  -6.154
  307    H    TRP  18           H        TRP  18  -5.843   3.172  -3.199
  308    HA   TRP  18           HA       TRP  18  -6.325   5.617  -1.679
  309   1HB   TRP  18          1HB       TRP  18  -4.939   3.778  -0.821
  310   2HB   TRP  18          2HB       TRP  18  -3.909   3.862  -2.236
  311    HD1  TRP  18           HD1      TRP  18  -4.509   5.583   1.084
  312    HE1  TRP  18           HE1      TRP  18  -2.715   7.420   1.390
  313    HE3  TRP  18           HE3      TRP  18  -2.410   5.510  -3.500
  314    HZ2  TRP  18           HZ2      TRP  18  -0.642   8.671  -0.141
  315    HZ3  TRP  18           HZ3      TRP  18  -0.554   6.987  -4.075
  316    HH2  TRP  18           HH2      TRP  18   0.346   8.554  -2.425
  317    H    LYS  19           H        LYS  19  -4.231   4.612  -4.341
  318    HA   LYS  19           HA       LYS  19  -2.936   7.084  -4.863
  319   1HB   LYS  19          1HB       LYS  19  -3.651   4.644  -6.504
  320   2HB   LYS  19          2HB       LYS  19  -2.751   5.987  -7.192
  321   1HG   LYS  19          1HG       LYS  19  -1.060   5.746  -5.378
  322   2HG   LYS  19          2HG       LYS  19  -1.917   4.312  -4.818
  323   1HD   LYS  19          1HD       LYS  19  -1.313   3.055  -6.670
  324   2HD   LYS  19          2HD       LYS  19  -1.135   4.474  -7.702
  325   1HE   LYS  19          1HE       LYS  19   1.106   3.847  -7.317
  326   2HE   LYS  19          2HE       LYS  19   0.843   5.070  -6.058
  327   1HZ   LYS  19          1HZ       LYS  19   0.420   2.146  -5.720
  328   2HZ   LYS  19          2HZ       LYS  19   1.763   3.009  -5.136
  329   3HZ   LYS  19          3HZ       LYS  19   0.216   3.332  -4.521
  330    H    ALA  20           H        ALA  20  -6.026   5.733  -5.884
  331    HA   ALA  20           HA       ALA  20  -6.653   7.673  -7.865
  332   1HB   ALA  20          1HB       ALA  20  -8.210   5.880  -6.028
  333   2HB   ALA  20          2HB       ALA  20  -9.047   6.979  -7.121
  334   3HB   ALA  20          3HB       ALA  20  -7.981   5.732  -7.771
  335    H    ALA  21           H        ALA  21  -6.834   7.720  -4.359
  336    HA   ALA  21           HA       ALA  21  -7.935  10.495  -4.501
  337   1HB   ALA  21          1HB       ALA  21  -9.433   8.761  -3.512
  338   2HB   ALA  21          2HB       ALA  21  -8.191   8.420  -2.306
  339   3HB   ALA  21          3HB       ALA  21  -8.985   9.995  -2.337
  340    H    ASN  22           H        ASN  22  -5.138   9.549  -4.561
  341    HA   ASN  22           HA       ASN  22  -4.110  11.369  -2.481
  342   1HB   ASN  22          1HB       ASN  22  -3.417   8.422  -2.600
  343   2HB   ASN  22          2HB       ASN  22  -2.539   9.611  -1.641
  344   1HD2  ASN  22          2HD2      ASN  22  -4.911   7.344  -1.359
  345   2HD2  ASN  22          1HD2      ASN  22  -5.795   7.996  -0.066
  346    HA   PRO  23           HA       PRO  23  -1.692  10.923  -6.505
  347   1HB   PRO  23          1HB       PRO  23  -2.459  13.294  -7.653
  348   2HB   PRO  23          2HB       PRO  23  -3.305  11.763  -7.954
  349   1HG   PRO  23          1HG       PRO  23  -4.035  14.003  -6.140
  350   2HG   PRO  23          2HG       PRO  23  -5.072  12.978  -7.146
  351   1HD   PRO  23          1HD       PRO  23  -4.761  12.635  -4.457
  352   2HD   PRO  23          2HD       PRO  23  -5.175  11.312  -5.563
  353    H    LEU  24           H        LEU  24  -2.565  13.451  -4.264
  354    HA   LEU  24           HA       LEU  24  -0.377  15.241  -4.481
  355   1HB   LEU  24          1HB       LEU  24  -1.245  16.070  -2.467
  356   2HB   LEU  24          2HB       LEU  24  -2.619  15.133  -3.038
  357    HG   LEU  24           HG       LEU  24  -0.524  13.965  -1.180
  358   1HD1  LEU  24          1HD1      LEU  24  -1.604  15.988  -0.182
  359   2HD1  LEU  24          2HD1      LEU  24  -3.171  15.212  -0.407
  360   3HD1  LEU  24          3HD1      LEU  24  -1.982  14.496   0.680
  361   1HD2  LEU  24          1HD2      LEU  24  -2.536  12.735  -2.615
  362   2HD2  LEU  24          2HD2      LEU  24  -1.854  12.104  -1.117
  363   3HD2  LEU  24          3HD2      LEU  24  -3.337  13.062  -1.083
  364    H    LEU  25           H        LEU  25  -0.688  12.137  -2.872
  365    HA   LEU  25           HA       LEU  25   2.135  12.238  -1.938
  366   1HB   LEU  25          1HB       LEU  25  -0.401  10.786  -1.284
  367   2HB   LEU  25          2HB       LEU  25   1.114   9.927  -0.990
  368    HG   LEU  25           HG       LEU  25   0.822  12.755  -0.021
  369   1HD1  LEU  25          1HD1      LEU  25  -1.160  11.157   0.668
  370   2HD1  LEU  25          2HD1      LEU  25   0.047  10.452   1.744
  371   3HD1  LEU  25          3HD1      LEU  25  -0.375  12.159   1.889
  372   1HD2  LEU  25          1HD2      LEU  25   2.932  11.154   0.005
  373   2HD2  LEU  25          2HD2      LEU  25   2.581  12.182   1.393
  374   3HD2  LEU  25          3HD2      LEU  25   2.136  10.476   1.424
  375    H    VAL  26           H        VAL  26   1.320  12.059  -4.696
  376    HA   VAL  26           HA       VAL  26   2.488   9.420  -5.422
  377    HB   VAL  26           HB       VAL  26  -0.180  10.556  -5.808
  378   1HG1  VAL  26          1HG1      VAL  26   1.384   9.655  -8.236
  379   2HG1  VAL  26          2HG1      VAL  26  -0.378   9.602  -8.169
  380   3HG1  VAL  26          3HG1      VAL  26   0.464  11.146  -8.023
  381   1HG2  VAL  26          1HG2      VAL  26   1.197   7.955  -5.674
  382   2HG2  VAL  26          2HG2      VAL  26  -0.372   8.443  -5.028
  383   3HG2  VAL  26          3HG2      VAL  26  -0.223   7.973  -6.723
  384    H    GLY  27           H        GLY  27   4.319   9.877  -6.550
  385   1HA   GLY  27          1HA       GLY  27   5.825  10.972  -7.987
  386   2HA   GLY  27          2HA       GLY  27   4.401  11.411  -8.932
  387    H    VAL  28           H        VAL  28   3.842  13.538  -8.973
  388    HA   VAL  28           HA       VAL  28   4.148  15.353  -6.749
  389    HB   VAL  28           HB       VAL  28   6.525  15.043  -7.316
  390   1HG1  VAL  28          1HG1      VAL  28   5.988  14.416  -9.739
  391   2HG1  VAL  28          2HG1      VAL  28   5.883  16.147 -10.059
  392   3HG1  VAL  28          3HG1      VAL  28   7.402  15.445  -9.500
  393   1HG2  VAL  28          1HG2      VAL  28   5.596  17.334  -6.693
  394   2HG2  VAL  28          2HG2      VAL  28   7.130  17.353  -7.565
  395   3HG2  VAL  28          3HG2      VAL  28   5.628  17.720  -8.413
  396    H    SER  29           H        SER  29   3.633  17.639  -7.469
  397    HA   SER  29           HA       SER  29   2.127  19.062  -8.597
  398   1HB   SER  29          1HB       SER  29   4.160  18.691 -10.155
  399   2HB   SER  29          2HB       SER  29   3.109  17.601 -11.056
  400    HG   SER  29           HG       SER  29   2.023  19.260 -11.786
  401    H    ALA  30           H        ALA  30   1.115  16.557  -7.663
  402    HA   ALA  30           HA       ALA  30  -1.034  16.008  -9.683
  403   1HB   ALA  30          1HB       ALA  30   0.687  14.189  -9.136
  404   2HB   ALA  30          2HB       ALA  30   0.005  14.159  -7.511
  405   3HB   ALA  30          3HB       ALA  30  -0.997  13.727  -8.895
  406    H    LYS  31           H        LYS  31  -1.331  18.151  -7.978
  407    HA   LYS  31           HA       LYS  31  -3.290  17.141  -5.939
  408   1HB   LYS  31          1HB       LYS  31  -1.454  19.560  -5.837
  409   2HB   LYS  31          2HB       LYS  31  -2.557  19.053  -4.559
  410   1HG   LYS  31          1HG       LYS  31  -1.176  17.387  -3.854
  411   2HG   LYS  31          2HG       LYS  31  -0.699  16.950  -5.492
  412   1HD   LYS  31          1HD       LYS  31   1.248  17.849  -4.384
  413   2HD   LYS  31          2HD       LYS  31   0.700  19.048  -5.556
  414   1HE   LYS  31          1HE       LYS  31   0.300  20.573  -3.924
  415   2HE   LYS  31          2HE       LYS  31  -0.605  19.391  -2.958
  416   1HZ   LYS  31          1HZ       LYS  31   1.514  18.381  -2.315
  417   2HZ   LYS  31          2HZ       LYS  31   2.353  19.583  -3.172
  418   3HZ   LYS  31          3HZ       LYS  31   1.425  20.002  -1.816
  419    HA   PRO  32           HA       PRO  32  -6.080  19.794  -8.113
  420   1HB   PRO  32          1HB       PRO  32  -8.033  20.037  -6.211
  421   2HB   PRO  32          2HB       PRO  32  -7.795  18.559  -7.165
  422   1HG   PRO  32          1HG       PRO  32  -7.002  19.154  -4.368
  423   2HG   PRO  32          2HG       PRO  32  -7.554  17.635  -5.089
  424   1HD   PRO  32          1HD       PRO  32  -4.925  18.233  -4.521
  425   2HD   PRO  32          2HD       PRO  32  -5.452  17.028  -5.715
  426    H    VAL  33           H        VAL  33  -7.210  21.990  -7.738
  427    HA   VAL  33           HA       VAL  33  -5.920  23.632  -5.610
  428    HB   VAL  33           HB       VAL  33  -5.274  25.285  -7.377
  429   1HG1  VAL  33          1HG1      VAL  33  -3.844  23.247  -6.523
  430   2HG1  VAL  33          2HG1      VAL  33  -4.082  22.642  -8.162
  431   3HG1  VAL  33          3HG1      VAL  33  -3.281  24.191  -7.901
  432   1HG2  VAL  33          1HG2      VAL  33  -7.061  23.985  -8.959
  433   2HG2  VAL  33          2HG2      VAL  33  -5.751  24.978  -9.598
  434   3HG2  VAL  33          3HG2      VAL  33  -5.563  23.227  -9.499
  435    H    ASN  34           H        ASN  34  -7.109  25.584  -5.159
  436    HA   ASN  34           HA       ASN  34  -9.883  25.602  -6.298
  437   1HB   ASN  34          1HB       ASN  34  -8.666  25.947  -3.608
  438   2HB   ASN  34          2HB       ASN  34 -10.035  26.998  -3.974
  439   1HD2  ASN  34          2HD2      ASN  34 -12.006  25.753  -4.969
  440   2HD2  ASN  34          1HD2      ASN  34 -12.344  24.228  -4.307
  441    H    ARG  35           H        ARG  35  -8.128  26.921  -7.891
  442    HA   ARG  35           HA       ARG  35  -7.659  29.684  -7.130
  443   1HB   ARG  35          1HB       ARG  35  -7.163  27.852  -9.342
  444   2HB   ARG  35          2HB       ARG  35  -7.628  29.447  -9.930
  445   1HG   ARG  35          1HG       ARG  35  -5.609  30.282  -9.395
  446   2HG   ARG  35          2HG       ARG  35  -5.789  29.741  -7.727
  447   1HD   ARG  35          1HD       ARG  35  -3.824  28.640  -8.613
  448   2HD   ARG  35          2HD       ARG  35  -5.103  27.411  -8.546
  449    HE   ARG  35           HE       ARG  35  -5.306  28.725 -11.056
  450   1HH1  ARG  35          1HH1      ARG  35  -3.134  26.666  -9.296
  451   2HH1  ARG  35          2HH1      ARG  35  -2.489  25.930 -10.723
  452   1HH2  ARG  35          1HH2      ARG  35  -4.460  27.761 -12.905
  453   2HH2  ARG  35          2HH2      ARG  35  -3.235  26.545 -12.756
  454    HA   PRO  36           HA       PRO  36 -11.409  30.611  -9.921
  455   1HB   PRO  36          1HB       PRO  36 -12.897  28.532 -10.891
  456   2HB   PRO  36          2HB       PRO  36 -11.486  29.189 -11.745
  457   1HG   PRO  36          1HG       PRO  36 -11.729  26.725 -10.109
  458   2HG   PRO  36          2HG       PRO  36 -10.773  27.026 -11.566
  459   1HD   PRO  36          1HD       PRO  36  -9.752  26.988  -9.015
  460   2HD   PRO  36          2HD       PRO  36  -9.003  27.830 -10.387
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  12.561 -15.196   3.028
    2   2H5*    G   1          2H5*        G   1  13.609 -16.599   2.722
    3    H4*    G   1           H4*        G   1  11.716 -18.109   2.857
    4    H3*    G   1           H3*        G   1  10.074 -15.563   3.051
    5    H2*    G   1           H2*        G   1   8.609 -16.624   4.574
    6   2HO*    G   1          2HO*        G   1   9.767 -19.044   3.626
    7    H1*    G   1           H1*        G   1  10.545 -18.105   5.908
    8    H8     G   1           H8         G   1  11.775 -14.599   5.364
    9    H1     G   1           H1         G   1   7.418 -15.091  10.057
   10   1H2     G   1          1H2         G   1   6.777 -17.264  10.216
   11   2H2     G   1          2H2         G   1   6.682 -18.143   8.706
   12   1H5*    C   2          1H5*        C   2   7.060 -18.458   2.463
   13   2H5*    C   2          2H5*        C   2   6.188 -18.002   0.981
   14    H4*    C   2           H4*        C   2   4.567 -18.375   2.741
   15    H3*    C   2           H3*        C   2   5.034 -15.439   2.118
   16    H2*    C   2           H2*        C   2   3.410 -14.875   3.727
   17   2HO*    C   2          2HO*        C   2   2.552 -17.552   3.417
   18    H1*    C   2           H1*        C   2   4.008 -16.968   5.506
   19   1H4     C   2          1H4         C   2   6.517 -11.844   8.246
   20   2H4     C   2          2H4         C   2   7.855 -11.847   7.121
   21    H5     C   2           H5         C   2   7.735 -13.117   5.028
   22    H6     C   2           H6         C   2   6.870 -15.206   4.077
   23   1H5*    C   3          1H5*        C   3   0.557 -13.641   1.247
   24   2H5*    C   3          2H5*        C   3   1.766 -12.425   1.693
   25    H4*    C   3           H4*        C   3   0.094 -14.179   3.490
   26    H3*    C   3           H3*        C   3   0.645 -11.221   3.213
   27    H2*    C   3           H2*        C   3   0.407 -10.918   5.519
   28   2HO*    C   3          2HO*        C   3  -0.229 -13.270   6.508
   29    H1*    C   3           H1*        C   3   1.609 -13.301   6.296
   30   1H4     C   3          1H4         C   3   6.066  -8.797   6.931
   31   2H4     C   3          2H4         C   3   6.295  -8.731   5.198
   32    H5     C   3           H5         C   3   5.291 -10.456   3.765
   33    H6     C   3           H6         C   3   3.534 -12.118   3.588
   34   1H5*    C   4          1H5*        C   4  -3.841 -10.233   4.636
   35   2H5*    C   4          2H5*        C   4  -2.093 -10.039   4.418
   36    H4*    C   4           H4*        C   4  -3.585  -9.914   7.057
   37    H3*    C   4           H3*        C   4  -2.416  -7.768   5.260
   38    H2*    C   4           H2*        C   4  -1.743  -6.551   7.131
   39   2HO*    C   4          2HO*        C   4  -2.817  -8.134   9.097
   40    H1*    C   4           H1*        C   4  -1.035  -8.747   8.690
   41   1H4     C   4          1H4         C   4   4.010  -5.999   5.693
   42   2H4     C   4          2H4         C   4   4.464  -7.664   5.422
   43    H5     C   4           H5         C   4   2.085  -8.527   4.408
   44    H6     C   4           H6         C   4  -0.026  -9.186   5.270
   45   1H5*    U   5          1H5*        U   5  -4.872  -4.664   6.509
   46   2H5*    U   5          2H5*        U   5  -3.447  -5.706   6.540
   47    H4*    U   5           H4*        U   5  -3.967  -4.069   8.981
   48    H3*    U   5           H3*        U   5  -2.981  -2.925   6.335
   49    H2*    U   5           H2*        U   5  -1.411  -1.652   7.530
   50   2HO*    U   5          2HO*        U   5  -2.460  -2.292  10.048
   51    H1*    U   5           H1*        U   5  -0.973  -3.570   9.548
   52    H3     U   5           H3         U   5   2.881  -2.455   7.333
   53    H5     U   5           H5         U   5   1.105  -5.490   5.050
   54    H6     U   5           H6         U   5  -0.884  -5.183   6.362
   55   1H5*    G   6          1H5*        G   6  -2.477  -0.242   7.559
   56   2H5*    G   6          2H5*        G   6  -3.033   1.217   8.395
   57    H4*    G   6           H4*        G   6  -2.270   2.609   6.738
   58    H3*    G   6           H3*        G   6  -2.845   0.338   4.806
   59    H2*    G   6           H2*        G   6  -1.251   1.198   3.332
   60   2HO*    G   6          2HO*        G   6  -0.633   3.534   4.628
   61    H1*    G   6           H1*        G   6   0.530   2.142   5.281
   62    H8     G   6           H8         G   6  -1.117  -1.348   5.222
   63    H1     G   6           H1         G   6   4.860  -1.065   2.873
   64   1H2     G   6          1H2         G   6   5.444   1.072   2.579
   65   2H2     G   6          2H2         G   6   4.683   2.292   3.583
   66   1H5*    A   7          1H5*        A   7  -4.749   1.777   0.684
   67   2H5*    A   7          2H5*        A   7  -3.760   0.304   0.729
   68    H4*    A   7           H4*        A   7  -2.973   1.721  -1.068
   69    H3*    A   7           H3*        A   7  -1.145   1.729   1.358
   70    H2*    A   7           H2*        A   7   0.322   3.151   0.162
   71   2HO*    A   7          2HO*        A   7   0.584   3.024  -1.923
   72    H1*    A   7           H1*        A   7  -1.689   4.484  -1.245
   73    H8     A   7           H8         A   7  -2.642   4.668   2.330
   74   1H6     A   7          1H6         A   7   0.237   9.163   3.166
   75   2H6     A   7          2H6         A   7   1.643   8.253   3.669
   76    H2     A   7           H2         A   7   2.238   7.218  -0.971
   77   1H5*    A   8          1H5*        A   8   0.779   0.702  -1.627
   78   2H5*    A   8          2H5*        A   8   2.074  -0.491  -1.873
   79    H4*    A   8           H4*        A   8   3.068   1.663  -2.146
   80    H3*    A   8           H3*        A   8   3.588   0.500   0.608
   81    H2*    A   8           H2*        A   8   4.938   2.384   1.119
   82   2HO*    A   8          2HO*        A   8   4.769   3.154  -1.613
   83    H1*    A   8           H1*        A   8   3.290   4.228  -0.205
   84    H8     A   8           H8         A   8   1.040   1.969   1.694
   85   1H6     A   8          1H6         A   8   2.463   5.144   6.826
   86   2H6     A   8          2H6         A   8   1.271   4.107   6.073
   87    H2     A   8           H2         A   8   5.326   6.368   3.593
   88   1H5*    A   9          2H5*        A   9   8.149  -1.019  -2.234
   89   2H5*    A   9          1H5*        A   9   7.164  -0.100  -1.075
   90    H4*    A   9           H4*        A   9   9.307   0.869  -2.599
   91    H3*    A   9           H3*        A   9   7.073   2.243  -1.082
   92    H2*    A   9           H2*        A   9   7.872   4.324  -1.887
   93   2HO*    A   9          2HO*        A   9   9.905   4.647  -2.242
   94    H1*    A   9           H1*        A   9   8.492   3.384  -4.444
   95    H8     A   9           H8         A   9   6.114   4.733  -2.065
   96   1H6     A   9          1H6         A   9   2.344   5.738  -5.757
   97   2H6     A   9          2H6         A   9   1.527   4.209  -5.524
   98    H2     A   9           H2         A   9   5.121   2.125  -7.843
   99   1H5*    A  10          1H5*        A  10   9.725   0.815   3.927
  100   2H5*    A  10          2H5*        A  10   8.126   1.361   3.393
  101    H4*    A  10           H4*        A  10  10.261   3.432   3.515
  102    H3*    A  10           H3*        A  10   9.127   2.019   5.925
  103    H2*    A  10           H2*        A  10   8.780   4.054   7.043
  104   2HO*    A  10          2HO*        A  10  10.479   5.216   5.084
  105    H1*    A  10           H1*        A  10   7.991   5.536   4.822
  106    H8     A  10           H8         A  10   6.037   2.738   4.000
  107   1H6     A  10          1H6         A  10   2.423   3.018   7.326
  108   2H6     A  10          2H6         A  10   2.509   3.369   9.037
  109    H2     A  10           H2         A  10   6.141   5.982   9.539
  110   1H5*    A  11          1H5*        A  11  10.497   4.872   9.138
  111   2H5*    A  11          2H5*        A  11  11.284   3.528   9.997
  112    H4*    A  11           H4*        A  11   8.942   4.410  10.803
  113    H3*    A  11           H3*        A  11   9.707   1.500  10.455
  114    H2*    A  11           H2*        A  11   7.535   0.847  11.083
  115   2HO*    A  11          2HO*        A  11   6.112   2.197  12.142
  116    H1*    A  11           H1*        A  11   6.175   2.934   9.850
  117    H8     A  11           H8         A  11   8.910   1.464   7.661
  118   1H6     A  11          1H6         A  11   5.156  -3.052   6.221
  119   2H6     A  11          2H6         A  11   5.794  -1.789   5.196
  120    H2     A  11           H2         A  11   2.980  -0.407   9.284
  121   1H5*    G  12          1H5*        G  12   9.372  -1.617  13.600
  122   2H5*    G  12          2H5*        G  12   9.242  -0.749  12.060
  123    H4*    G  12           H4*        G  12   7.115  -0.018  13.925
  124    H3*    G  12           H3*        G  12   7.467  -2.926  13.160
  125    H2*    G  12           H2*        G  12   5.162  -3.089  12.678
  126   2HO*    G  12          2HO*        G  12   3.704  -1.422  13.296
  127    H1*    G  12           H1*        G  12   4.889  -0.540  11.569
  128    H8     G  12           H8         G  12   7.846  -1.381   9.812
  129    H1     G  12           H1         G  12   3.150  -5.446   8.182
  130   1H2     G  12          1H2         G  12   1.311  -4.918   9.510
  131   2H2     G  12          2H2         G  12   1.787  -4.755  11.186
  132   1H5*    G  13          1H5*        G  13   4.878  -3.463  16.346
  133   2H5*    G  13          2H5*        G  13   5.329  -4.739  17.495
  134    H4*    G  13           H4*        G  13   3.210  -5.269  16.392
  135    H3*    G  13           H3*        G  13   5.571  -6.933  15.449
  136    H2*    G  13           H2*        G  13   4.144  -8.114  14.045
  137   2HO*    G  13          2HO*        G  13   1.778  -6.985  14.983
  138    H1*    G  13           H1*        G  13   2.467  -5.950  13.419
  139    H8     G  13           H8         G  13   5.920  -4.751  12.868
  140    H1     G  13           H1         G  13   4.004  -8.963   8.407
  141   1H2     G  13          1H2         G  13   1.947  -9.714   8.977
  142   2H2     G  13          2H2         G  13   1.649  -9.908  10.690
  143   1H5*    G  14          1H5*        G  14   0.468  -8.575  15.984
  144   2H5*    G  14          2H5*        G  14   0.363  -9.397  17.557
  145    H4*    G  14           H4*        G  14  -0.280 -11.115  16.131
  146    H3*    G  14           H3*        G  14   2.746 -11.287  16.218
  147    H2*    G  14           H2*        G  14   2.582 -13.160  14.767
  148   2HO*    G  14          2HO*        G  14  -0.223 -13.165  14.862
  149    H1*    G  14           H1*        G  14   0.524 -12.098  13.210
  150    H8     G  14           H8         G  14   3.334  -9.706  14.195
  151    H1     G  14           H1         G  14   4.450 -13.122   8.859
  152   1H2     G  14          1H2         G  14   2.614 -14.394   8.445
  153   2H2     G  14          2H2         G  14   1.811 -15.043   9.857
  154   1H5*    C  15          1H5*        C  15   1.046 -15.017  16.341
  155   2H5*    C  15          2H5*        C  15   1.740 -16.031  17.627
  156    H4*    C  15           H4*        C  15   1.818 -17.291  15.564
  157    H3*    C  15           H3*        C  15   4.520 -16.163  16.366
  158    H2*    C  15           H2*        C  15   5.463 -17.261  14.503
  159   2HO*    C  15          2HO*        C  15   3.384 -18.680  13.549
  160    H1*    C  15           H1*        C  15   3.207 -16.960  12.840
  161   1H4     C  15          1H4         C  15   7.458 -12.825  10.621
  162   2H4     C  15          2H4         C  15   7.512 -11.965  12.148
  163    H5     C  15           H5         C  15   5.756 -12.363  13.830
  164    H6     C  15           H6         C  15   4.195 -13.993  14.677
  165   2H    ASP   2          2H        ASP   2   9.924 -12.617  -2.449
  166   1H    ASP   2          1H        ASP   2   9.924 -14.012  -1.483
  167   3H    ASP   2          3H        ASP   2  11.314 -13.040  -1.566
  168    HA   ASP   2           HA       ASP   2  10.340 -12.472   0.487
  169   1HB   ASP   2          1HB       ASP   2   9.310 -10.486  -1.556
  170   2HB   ASP   2          2HB       ASP   2   9.858 -10.146   0.083
  171    H    ALA   3           H        ALA   3   8.121 -10.837   0.888
  172    HA   ALA   3           HA       ALA   3   5.732 -12.376   0.020
  173   1HB   ALA   3          1HB       ALA   3   6.701 -12.024   2.869
  174   2HB   ALA   3          2HB       ALA   3   5.085 -12.594   2.453
  175   3HB   ALA   3          3HB       ALA   3   6.500 -13.544   1.998
  176    H    GLN   4           H        GLN   4   7.020  -9.655   1.916
  177    HA   GLN   4           HA       GLN   4   4.508  -8.237   2.058
  178   1HB   GLN   4          1HB       GLN   4   6.697  -8.032   3.458
  179   2HB   GLN   4          2HB       GLN   4   7.280  -7.023   2.134
  180   1HG   GLN   4          1HG       GLN   4   4.732  -6.030   2.664
  181   2HG   GLN   4          2HG       GLN   4   5.390  -6.371   4.257
  182   1HE2  GLN   4          2HE2      GLN   4   5.138  -3.883   2.142
  183   2HE2  GLN   4          1HE2      GLN   4   6.579  -3.053   2.474
  184    H    THR   5           H        THR   5   7.431  -7.664   0.081
  185    HA   THR   5           HA       THR   5   6.348  -5.677  -1.637
  186    HB   THR   5           HB       THR   5   8.300  -7.959  -2.135
  187    HG1  THR   5           HG1      THR   5   9.237  -6.674  -0.705
  188   1HG2  THR   5          1HG2      THR   5   7.519  -5.574  -3.801
  189   2HG2  THR   5          2HG2      THR   5   9.121  -6.297  -3.948
  190   3HG2  THR   5          3HG2      THR   5   7.683  -7.258  -4.297
  191    H    ARG   6           H        ARG   6   5.944  -9.151  -1.487
  192    HA   ARG   6           HA       ARG   6   4.567  -9.489  -4.021
  193   1HB   ARG   6          1HB       ARG   6   5.379 -11.014  -1.675
  194   2HB   ARG   6          2HB       ARG   6   3.740 -11.441  -2.178
  195   1HG   ARG   6          1HG       ARG   6   4.560 -12.640  -3.904
  196   2HG   ARG   6          2HG       ARG   6   5.394 -11.214  -4.524
  197   1HD   ARG   6          1HD       ARG   6   7.289 -12.428  -4.079
  198   2HD   ARG   6          2HD       ARG   6   7.006 -11.920  -2.402
  199    HE   ARG   6           HE       ARG   6   6.281 -14.114  -1.920
  200   1HH1  ARG   6          1HH1      ARG   6   6.220 -13.502  -5.337
  201   2HH1  ARG   6          2HH1      ARG   6   5.808 -15.133  -5.741
  202   1HH2  ARG   6          1HH2      ARG   6   5.745 -16.232  -2.457
  203   2HH2  ARG   6          2HH2      ARG   6   5.539 -16.672  -4.120
  204    H    ARG   7           H        ARG   7   3.584  -9.194  -0.602
  205    HA   ARG   7           HA       ARG   7   0.797  -9.427  -1.044
  206   1HB   ARG   7          1HB       ARG   7   1.751  -9.555   1.164
  207   2HB   ARG   7          2HB       ARG   7   2.463  -7.949   1.012
  208   1HG   ARG   7          1HG       ARG   7   0.043  -7.094   0.732
  209   2HG   ARG   7          2HG       ARG   7  -0.454  -8.678   1.326
  210   1HD   ARG   7          1HD       ARG   7   0.387  -8.292   3.448
  211   2HD   ARG   7          2HD       ARG   7   1.616  -7.158   2.874
  212    HE   ARG   7           HE       ARG   7   0.001  -5.436   3.015
  213   1HH1  ARG   7          1HH1      ARG   7  -1.484  -8.574   3.000
  214   2HH1  ARG   7          2HH1      ARG   7  -3.071  -7.956   3.298
  215   1HH2  ARG   7          1HH2      ARG   7  -2.073  -4.644   3.402
  216   2HH2  ARG   7          2HH2      ARG   7  -3.405  -5.745   3.524
  217    H    ARG   8           H        ARG   8   2.994  -6.690  -1.328
  218    HA   ARG   8           HA       ARG   8   1.168  -4.530  -1.523
  219   1HB   ARG   8          1HB       ARG   8   3.880  -4.967  -1.743
  220   2HB   ARG   8          2HB       ARG   8   3.466  -4.605  -3.412
  221   1HG   ARG   8          1HG       ARG   8   4.110  -2.578  -2.091
  222   2HG   ARG   8          2HG       ARG   8   2.491  -2.477  -2.772
  223   1HD   ARG   8          1HD       ARG   8   2.940  -1.840  -0.215
  224   2HD   ARG   8          2HD       ARG   8   1.457  -2.684  -0.686
  225    HE   ARG   8           HE       ARG   8   3.676  -4.497  -0.101
  226   1HH1  ARG   8          1HH1      ARG   8   1.028  -2.679   1.194
  227   2HH1  ARG   8          2HH1      ARG   8   0.847  -3.702   2.572
  228   1HH2  ARG   8          1HH2      ARG   8   3.428  -5.815   1.687
  229   2HH2  ARG   8          2HH2      ARG   8   2.197  -5.464   2.851
  230    H    GLU   9           H        GLU   9   2.243  -6.864  -3.962
  231    HA   GLU   9           HA       GLU   9   0.825  -5.706  -6.171
  232   1HB   GLU   9          1HB       GLU   9   1.521  -8.592  -5.505
  233   2HB   GLU   9          2HB       GLU   9   1.042  -8.022  -7.103
  234   1HG   GLU   9          1HG       GLU   9   3.132  -6.313  -6.232
  235   2HG   GLU   9          2HG       GLU   9   3.651  -7.960  -5.878
  236    H    ARG  10           H        ARG  10  -0.056  -7.777  -3.503
  237    HA   ARG  10           HA       ARG  10  -2.772  -8.293  -4.432
  238   1HB   ARG  10          1HB       ARG  10  -0.963  -9.070  -2.310
  239   2HB   ARG  10          2HB       ARG  10  -2.520  -8.609  -1.625
  240   1HG   ARG  10          1HG       ARG  10  -3.680 -10.259  -2.824
  241   2HG   ARG  10          2HG       ARG  10  -2.393 -10.425  -4.019
  242   1HD   ARG  10          1HD       ARG  10  -0.985 -11.611  -2.490
  243   2HD   ARG  10          2HD       ARG  10  -2.002 -11.167  -1.105
  244    HE   ARG  10           HE       ARG  10  -3.504 -12.882  -1.720
  245   1HH1  ARG  10          1HH1      ARG  10  -1.376 -12.087  -4.347
  246   2HH1  ARG  10          2HH1      ARG  10  -1.943 -13.378  -5.350
  247   1HH2  ARG  10          1HH2      ARG  10  -4.231 -14.556  -3.033
  248   2HH2  ARG  10          2HH2      ARG  10  -3.550 -14.768  -4.612
  249    H    ARG  11           H        ARG  11  -1.076  -5.688  -2.978
  250    HA   ARG  11           HA       ARG  11  -3.534  -4.551  -1.768
  251   1HB   ARG  11          1HB       ARG  11  -0.639  -3.656  -1.893
  252   2HB   ARG  11          2HB       ARG  11  -1.920  -2.799  -1.037
  253   1HG   ARG  11          1HG       ARG  11  -0.961  -5.623  -0.465
  254   2HG   ARG  11          2HG       ARG  11  -0.686  -4.217   0.547
  255   1HD   ARG  11          1HD       ARG  11  -2.723  -4.455   1.527
  256   2HD   ARG  11          2HD       ARG  11  -3.527  -4.549  -0.043
  257    HE   ARG  11           HE       ARG  11  -2.038  -6.965   0.443
  258   1HH1  ARG  11          1HH1      ARG  11  -4.926  -5.257   1.335
  259   2HH1  ARG  11          2HH1      ARG  11  -5.802  -6.698   1.720
  260   1HH2  ARG  11          1HH2      ARG  11  -3.186  -8.833   0.948
  261   2HH2  ARG  11          2HH2      ARG  11  -4.822  -8.713   1.503
  262    H    ALA  12           H        ALA  12  -2.289  -4.718  -4.841
  263    HA   ALA  12           HA       ALA  12  -2.256  -2.033  -5.804
  264   1HB   ALA  12          1HB       ALA  12  -1.669  -4.079  -7.100
  265   2HB   ALA  12          2HB       ALA  12  -3.363  -4.572  -7.083
  266   3HB   ALA  12          3HB       ALA  12  -2.876  -3.119  -7.956
  267    H    GLU  13           H        GLU  13  -4.870  -4.105  -4.745
  268    HA   GLU  13           HA       GLU  13  -7.025  -2.470  -5.837
  269   1HB   GLU  13          1HB       GLU  13  -6.712  -4.764  -3.903
  270   2HB   GLU  13          2HB       GLU  13  -8.263  -3.934  -4.032
  271   1HG   GLU  13          1HG       GLU  13  -8.545  -4.550  -6.288
  272   2HG   GLU  13          2HG       GLU  13  -6.832  -4.911  -6.497
  273    H    LYS  14           H        LYS  14  -5.164  -2.689  -2.833
  274    HA   LYS  14           HA       LYS  14  -6.835  -0.738  -1.409
  275   1HB   LYS  14          1HB       LYS  14  -4.068  -1.924  -0.941
  276   2HB   LYS  14          2HB       LYS  14  -4.946  -0.946   0.236
  277   1HG   LYS  14          1HG       LYS  14  -6.214  -3.406  -0.946
  278   2HG   LYS  14          2HG       LYS  14  -5.102  -3.536   0.419
  279   1HD   LYS  14          1HD       LYS  14  -6.718  -1.482   1.240
  280   2HD   LYS  14          2HD       LYS  14  -7.857  -2.477   0.333
  281   1HE   LYS  14          1HE       LYS  14  -6.908  -4.478   1.661
  282   2HE   LYS  14          2HE       LYS  14  -6.196  -3.261   2.737
  283   1HZ   LYS  14          1HZ       LYS  14  -9.061  -3.399   1.950
  284   2HZ   LYS  14          2HZ       LYS  14  -8.436  -3.876   3.457
  285   3HZ   LYS  14          3HZ       LYS  14  -8.367  -2.247   2.991
  286    H    GLN  15           H        GLN  15  -3.873  -0.873  -3.247
  287    HA   GLN  15           HA       GLN  15  -2.987   1.842  -2.868
  288   1HB   GLN  15          1HB       GLN  15  -2.315  -0.618  -4.295
  289   2HB   GLN  15          2HB       GLN  15  -2.005   0.792  -5.292
  290   1HG   GLN  15          1HG       GLN  15  -0.400   1.636  -3.836
  291   2HG   GLN  15          2HG       GLN  15  -1.116   0.834  -2.438
  292   1HE2  GLN  15          2HE2      GLN  15  -1.036  -1.688  -2.591
  293   2HE2  GLN  15          1HE2      GLN  15   0.406  -2.357  -3.191
  294    H    ALA  16           H        ALA  16  -4.636   0.158  -5.554
  295    HA   ALA  16           HA       ALA  16  -4.998   2.526  -7.161
  296   1HB   ALA  16          1HB       ALA  16  -5.113   0.107  -7.889
  297   2HB   ALA  16          2HB       ALA  16  -6.666  -0.016  -7.061
  298   3HB   ALA  16          3HB       ALA  16  -6.485   1.072  -8.437
  299    H    GLN  17           H        GLN  17  -6.793   1.140  -4.461
  300    HA   GLN  17           HA       GLN  17  -9.160   2.818  -4.909
  301   1HB   GLN  17          1HB       GLN  17  -8.104   0.915  -2.832
  302   2HB   GLN  17          2HB       GLN  17  -9.439   1.981  -2.400
  303   1HG   GLN  17          1HG       GLN  17  -9.492   0.284  -4.900
  304   2HG   GLN  17          2HG       GLN  17 -10.080  -0.315  -3.349
  305   1HE2  GLN  17          2HE2      GLN  17 -11.863   0.036  -5.562
  306   2HE2  GLN  17          1HE2      GLN  17 -12.935   1.299  -5.192
  307    H    TRP  18           H        TRP  18  -6.218   2.848  -3.000
  308    HA   TRP  18           HA       TRP  18  -6.833   5.287  -1.521
  309   1HB   TRP  18          1HB       TRP  18  -5.284   3.597  -0.665
  310   2HB   TRP  18          2HB       TRP  18  -4.316   3.700  -2.121
  311    HD1  TRP  18           HD1      TRP  18  -4.898   5.478   1.170
  312    HE1  TRP  18           HE1      TRP  18  -3.223   7.439   1.352
  313    HE3  TRP  18           HE3      TRP  18  -2.969   5.414  -3.490
  314    HZ2  TRP  18           HZ2      TRP  18  -1.297   8.778  -0.286
  315    HZ3  TRP  18           HZ3      TRP  18  -1.240   6.989  -4.172
  316    HH2  TRP  18           HH2      TRP  18  -0.382   8.656  -2.597
  317    H    LYS  19           H        LYS  19  -4.757   4.387  -4.231
  318    HA   LYS  19           HA       LYS  19  -3.679   6.935  -4.860
  319   1HB   LYS  19          1HB       LYS  19  -4.302   4.432  -6.451
  320   2HB   LYS  19          2HB       LYS  19  -3.498   5.818  -7.170
  321   1HG   LYS  19          1HG       LYS  19  -1.724   5.672  -5.443
  322   2HG   LYS  19          2HG       LYS  19  -2.497   4.225  -4.802
  323   1HD   LYS  19          1HD       LYS  19  -0.910   3.303  -6.241
  324   2HD   LYS  19          2HD       LYS  19  -2.334   3.376  -7.281
  325   1HE   LYS  19          1HE       LYS  19  -1.439   5.024  -8.606
  326   2HE   LYS  19          2HE       LYS  19  -0.632   5.818  -7.239
  327   1HZ   LYS  19          1HZ       LYS  19   0.861   3.848  -7.131
  328   2HZ   LYS  19          2HZ       LYS  19   0.185   3.304  -8.592
  329   3HZ   LYS  19          3HZ       LYS  19   1.045   4.768  -8.544
  330    H    ALA  20           H        ALA  20  -6.688   5.320  -5.725
  331    HA   ALA  20           HA       ALA  20  -7.574   7.166  -7.692
  332   1HB   ALA  20          1HB       ALA  20  -8.822   5.215  -5.796
  333   2HB   ALA  20          2HB       ALA  20  -9.868   6.283  -6.733
  334   3HB   ALA  20          3HB       ALA  20  -8.776   5.170  -7.558
  335    H    ALA  21           H        ALA  21  -7.585   7.248  -4.185
  336    HA   ALA  21           HA       ALA  21  -8.932   9.915  -4.285
  337   1HB   ALA  21          1HB       ALA  21  -9.125   7.532  -2.512
  338   2HB   ALA  21          2HB       ALA  21  -9.265   9.107  -1.731
  339   3HB   ALA  21          3HB       ALA  21 -10.390   8.655  -3.013
  340    H    ASN  22           H        ASN  22  -6.074   9.220  -4.540
  341    HA   ASN  22           HA       ASN  22  -5.056  11.170  -2.577
  342   1HB   ASN  22          1HB       ASN  22  -4.160   8.277  -2.677
  343   2HB   ASN  22          2HB       ASN  22  -3.277   9.552  -1.839
  344   1HD2  ASN  22          2HD2      ASN  22  -5.514   7.168  -1.309
  345   2HD2  ASN  22          1HD2      ASN  22  -6.299   7.806   0.054
  346    HA   PRO  23           HA       PRO  23  -2.909  10.788  -6.767
  347   1HB   PRO  23          1HB       PRO  23  -3.956  13.046  -7.920
  348   2HB   PRO  23          2HB       PRO  23  -4.691  11.440  -8.114
  349   1HG   PRO  23          1HG       PRO  23  -5.464  13.669  -6.301
  350   2HG   PRO  23          2HG       PRO  23  -6.488  12.543  -7.208
  351   1HD   PRO  23          1HD       PRO  23  -5.972  12.287  -4.546
  352   2HD   PRO  23          2HD       PRO  23  -6.329  10.907  -5.598
  353    H    LEU  24           H        LEU  24  -3.813  13.278  -4.505
  354    HA   LEU  24           HA       LEU  24  -1.807  15.238  -4.970
  355   1HB   LEU  24          1HB       LEU  24  -2.582  16.075  -2.922
  356   2HB   LEU  24          2HB       LEU  24  -3.908  14.992  -3.325
  357    HG   LEU  24           HG       LEU  24  -1.552  14.093  -1.638
  358   1HD1  LEU  24          1HD1      LEU  24  -2.986  16.120  -0.776
  359   2HD1  LEU  24          2HD1      LEU  24  -4.192  14.874  -0.454
  360   3HD1  LEU  24          3HD1      LEU  24  -2.606  14.786   0.312
  361   1HD2  LEU  24          1HD2      LEU  24  -3.607  12.655  -2.822
  362   2HD2  LEU  24          2HD2      LEU  24  -2.689  12.121  -1.416
  363   3HD2  LEU  24          3HD2      LEU  24  -4.234  12.949  -1.203
  364    H    LEU  25           H        LEU  25  -1.758  12.168  -3.291
  365    HA   LEU  25           HA       LEU  25   1.130  12.465  -2.628
  366   1HB   LEU  25          1HB       LEU  25  -1.228  10.839  -1.718
  367   2HB   LEU  25          2HB       LEU  25   0.382  10.143  -1.514
  368    HG   LEU  25           HG       LEU  25  -0.213  12.952  -0.596
  369   1HD1  LEU  25          1HD1      LEU  25  -1.716  10.944   0.359
  370   2HD1  LEU  25          2HD1      LEU  25  -0.283  10.699   1.358
  371   3HD1  LEU  25          3HD1      LEU  25  -1.133  12.246   1.395
  372   1HD2  LEU  25          1HD2      LEU  25   2.135  11.721  -0.824
  373   2HD2  LEU  25          2HD2      LEU  25   1.793  12.764   0.556
  374   3HD2  LEU  25          3HD2      LEU  25   1.656  11.013   0.718
  375    H    VAL  26           H        VAL  26   0.078  12.204  -5.282
  376    HA   VAL  26           HA       VAL  26   1.474   9.757  -6.174
  377    HB   VAL  26           HB       VAL  26  -1.417  10.207  -5.934
  378   1HG1  VAL  26          1HG1      VAL  26  -0.261   9.574  -8.657
  379   2HG1  VAL  26          2HG1      VAL  26  -1.878   9.056  -8.181
  380   3HG1  VAL  26          3HG1      VAL  26  -1.485  10.777  -8.232
  381   1HG2  VAL  26          1HG2      VAL  26   0.415   7.881  -6.558
  382   2HG2  VAL  26          2HG2      VAL  26  -0.399   8.246  -5.034
  383   3HG2  VAL  26          3HG2      VAL  26  -1.338   7.704  -6.427
  384    H    GLY  27           H        GLY  27   2.859  10.634  -7.668
  385   1HA   GLY  27          1HA       GLY  27   3.531  11.779  -9.631
  386   2HA   GLY  27          2HA       GLY  27   1.832  12.159  -9.930
  387    H    VAL  28           H        VAL  28   1.021  13.638  -7.860
  388    HA   VAL  28           HA       VAL  28   1.947  16.246  -8.234
  389    HB   VAL  28           HB       VAL  28   0.583  14.737  -6.014
  390   1HG1  VAL  28          1HG1      VAL  28   1.888  16.517  -4.885
  391   2HG1  VAL  28          2HG1      VAL  28   1.188  17.711  -5.979
  392   3HG1  VAL  28          3HG1      VAL  28   0.157  16.857  -4.831
  393   1HG2  VAL  28          1HG2      VAL  28  -0.154  16.718  -8.151
  394   2HG2  VAL  28          2HG2      VAL  28  -0.880  15.152  -7.789
  395   3HG2  VAL  28          3HG2      VAL  28  -1.186  16.531  -6.733
  396    H    SER  29           H        SER  29   3.062  17.603  -6.416
  397    HA   SER  29           HA       SER  29   5.744  16.835  -6.084
  398   1HB   SER  29          1HB       SER  29   5.640  18.636  -4.259
  399   2HB   SER  29          2HB       SER  29   5.106  19.116  -5.867
  400    HG   SER  29           HG       SER  29   3.233  19.505  -5.020
  401    H    ALA  30           H        ALA  30   5.476  14.561  -5.351
  402    HA   ALA  30           HA       ALA  30   5.965  14.246  -2.535
  403   1HB   ALA  30          1HB       ALA  30   3.488  14.708  -2.575
  404   2HB   ALA  30          2HB       ALA  30   3.281  13.277  -3.581
  405   3HB   ALA  30          3HB       ALA  30   3.876  13.114  -1.929
  406    H    LYS  31           H        LYS  31   7.197  13.500  -4.940
  407    HA   LYS  31           HA       LYS  31   7.074  10.513  -4.752
  408   1HB   LYS  31          1HB       LYS  31   7.458  10.604  -7.289
  409   2HB   LYS  31          2HB       LYS  31   5.857  11.084  -6.732
  410   1HG   LYS  31          1HG       LYS  31   6.128  13.228  -7.429
  411   2HG   LYS  31          2HG       LYS  31   7.781  13.309  -6.814
  412   1HD   LYS  31          1HD       LYS  31   8.184  13.420  -9.095
  413   2HD   LYS  31          2HD       LYS  31   8.267  11.676  -8.846
  414   1HE   LYS  31          1HE       LYS  31   5.737  11.652  -9.366
  415   2HE   LYS  31          2HE       LYS  31   5.987  13.290 -10.002
  416   1HZ   LYS  31          1HZ       LYS  31   7.637  10.943 -10.766
  417   2HZ   LYS  31          2HZ       LYS  31   6.326  11.512 -11.684
  418   3HZ   LYS  31          3HZ       LYS  31   7.688  12.496 -11.453
  419    HA   PRO  32           HA       PRO  32  11.391  11.938  -4.226
  420   1HB   PRO  32          1HB       PRO  32  12.100   9.932  -2.505
  421   2HB   PRO  32          2HB       PRO  32  11.302  11.426  -1.972
  422   1HG   PRO  32          1HG       PRO  32  10.148   8.722  -2.427
  423   2HG   PRO  32          2HG       PRO  32   9.774   9.915  -1.173
  424   1HD   PRO  32          1HD       PRO  32   8.221   9.493  -3.382
  425   2HD   PRO  32          2HD       PRO  32   8.290  11.035  -2.500
  426    H    VAL  33           H        VAL  33  13.198  11.123  -5.325
  427    HA   VAL  33           HA       VAL  33  12.977   8.360  -6.474
  428    HB   VAL  33           HB       VAL  33  13.984   9.406  -8.551
  429   1HG1  VAL  33          1HG1      VAL  33  11.273   9.953  -7.457
  430   2HG1  VAL  33          2HG1      VAL  33  11.737  10.861  -8.895
  431   3HG1  VAL  33          3HG1      VAL  33  11.743   9.098  -8.926
  432   1HG2  VAL  33          1HG2      VAL  33  14.595  11.501  -6.956
  433   2HG2  VAL  33          2HG2      VAL  33  14.396  11.660  -8.700
  434   3HG2  VAL  33          3HG2      VAL  33  13.068  12.080  -7.619
  435    H    ASN  34           H        ASN  34  14.575   9.734  -4.191
  436    HA   ASN  34           HA       ASN  34  16.781   9.670  -3.350
  437   1HB   ASN  34          1HB       ASN  34  16.123   7.266  -4.805
  438   2HB   ASN  34          2HB       ASN  34  17.844   7.600  -4.989
  439   1HD2  ASN  34          2HD2      ASN  34  15.362   7.627  -2.356
  440   2HD2  ASN  34          1HD2      ASN  34  16.399   6.976  -1.180
  441    H    ARG  35           H        ARG  35  16.498  11.681  -5.192
  442    HA   ARG  35           HA       ARG  35  19.187  11.760  -6.439
  443   1HB   ARG  35          1HB       ARG  35  16.879  10.995  -7.843
  444   2HB   ARG  35          2HB       ARG  35  17.132  12.680  -8.295
  445   1HG   ARG  35          1HG       ARG  35  19.611  11.989  -8.641
  446   2HG   ARG  35          2HG       ARG  35  18.992  10.337  -8.656
  447   1HD   ARG  35          1HD       ARG  35  17.942  12.554 -10.449
  448   2HD   ARG  35          2HD       ARG  35  19.120  11.328 -10.958
  449    HE   ARG  35           HE       ARG  35  16.275  10.875 -10.532
  450   1HH1  ARG  35          1HH1      ARG  35  19.449   9.473 -10.386
  451   2HH1  ARG  35          2HH1      ARG  35  18.870   7.856 -10.593
  452   1HH2  ARG  35          1HH2      ARG  35  15.536   8.769 -10.800
  453   2HH2  ARG  35          2HH2      ARG  35  16.668   7.458 -10.827
  454    HA   PRO  36           HA       PRO  36  17.279  15.763  -4.797
  455   1HB   PRO  36          1HB       PRO  36  18.834  16.064  -2.565
  456   2HB   PRO  36          2HB       PRO  36  17.281  15.205  -2.550
  457   1HG   PRO  36          1HG       PRO  36  20.046  14.113  -2.620
  458   2HG   PRO  36          2HG       PRO  36  18.617  13.515  -1.764
  459   1HD   PRO  36          1HD       PRO  36  19.553  12.433  -4.091
  460   2HD   PRO  36          2HD       PRO  36  17.853  12.357  -3.579
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  11.955 -14.783   1.384
    2   2H5*    G   1          2H5*        G   1  13.260 -15.952   1.693
    3    H4*    G   1           H4*        G   1  11.347 -17.720   1.732
    4    H3*    G   1           H3*        G   1   9.823 -15.123   2.136
    5    H2*    G   1           H2*        G   1   8.493 -16.192   3.774
    6   2HO*    G   1          2HO*        G   1   8.666 -18.491   4.097
    7    H1*    G   1           H1*        G   1  10.566 -17.715   4.845
    8    H8     G   1           H8         G   1  11.598 -14.126   4.219
    9    H1     G   1           H1         G   1   8.036 -14.973   9.498
   10   1H2     G   1          1H2         G   1   7.327 -17.063   9.601
   11   2H2     G   1          2H2         G   1   7.487 -18.155   8.244
   12   1H5*    C   2          1H5*        C   2   6.112 -16.737   0.616
   13   2H5*    C   2          2H5*        C   2   7.123 -16.160   1.959
   14    H4*    C   2           H4*        C   2   4.932 -18.172   2.446
   15    H3*    C   2           H3*        C   2   4.649 -15.171   2.122
   16    H2*    C   2           H2*        C   2   3.222 -15.084   3.992
   17   2HO*    C   2          2HO*        C   2   2.184 -16.869   4.820
   18    H1*    C   2           H1*        C   2   4.509 -17.046   5.497
   19   1H4     C   2          1H4         C   2   6.544 -11.608   8.016
   20   2H4     C   2          2H4         C   2   7.645 -11.357   6.683
   21    H5     C   2           H5         C   2   7.447 -12.638   4.611
   22    H6     C   2           H6         C   2   6.785 -14.831   3.734
   23   1H5*    C   3          1H5*        C   3   0.129 -13.863   1.682
   24   2H5*    C   3          2H5*        C   3   1.270 -12.561   2.058
   25    H4*    C   3           H4*        C   3  -0.031 -14.529   3.941
   26    H3*    C   3           H3*        C   3   0.128 -11.517   3.712
   27    H2*    C   3           H2*        C   3   0.083 -11.304   6.046
   28   2HO*    C   3          2HO*        C   3  -1.629 -12.719   6.483
   29    H1*    C   3           H1*        C   3   1.628 -13.552   6.625
   30   1H4     C   3          1H4         C   3   5.606  -8.595   6.965
   31   2H4     C   3          2H4         C   3   5.637  -8.456   5.222
   32    H5     C   3           H5         C   3   4.722 -10.276   3.845
   33    H6     C   3           H6         C   3   3.121 -12.092   3.782
   34   1H5*    C   4          1H5*        C   4  -3.913 -11.418   5.909
   35   2H5*    C   4          2H5*        C   4  -4.543  -9.929   5.171
   36    H4*    C   4           H4*        C   4  -3.957 -10.001   7.743
   37    H3*    C   4           H3*        C   4  -3.159  -7.747   5.845
   38    H2*    C   4           H2*        C   4  -2.141  -6.664   7.665
   39   2HO*    C   4          2HO*        C   4  -2.803  -6.856   9.695
   40    H1*    C   4           H1*        C   4  -1.316  -9.001   9.004
   41   1H4     C   4          1H4         C   4   3.525  -5.985   5.991
   42   2H4     C   4          2H4         C   4   3.950  -7.616   5.534
   43    H5     C   4           H5         C   4   1.631  -8.617   4.698
   44    H6     C   4           H6         C   4  -0.440  -9.317   5.600
   45   1H5*    U   5          1H5*        U   5  -4.755  -4.088   5.162
   46   2H5*    U   5          2H5*        U   5  -3.727  -5.436   5.688
   47    H4*    U   5           H4*        U   5  -4.808  -3.961   7.965
   48    H3*    U   5           H3*        U   5  -3.251  -2.467   5.840
   49    H2*    U   5           H2*        U   5  -1.924  -1.466   7.500
   50   2HO*    U   5          2HO*        U   5  -2.643  -1.017   9.440
   51    H1*    U   5           H1*        U   5  -1.821  -3.644   9.214
   52    H3     U   5           H3         U   5   2.225  -2.361   7.287
   53    H5     U   5           H5         U   5   0.758  -5.658   5.159
   54    H6     U   5           H6         U   5  -1.410  -5.141   6.095
   55   1H5*    G   6          1H5*        G   6  -1.898   1.190   8.459
   56   2H5*    G   6          2H5*        G   6  -3.358   2.072   7.954
   57    H4*    G   6           H4*        G   6  -1.705   3.128   6.690
   58    H3*    G   6           H3*        G   6  -2.726   0.781   5.045
   59    H2*    G   6           H2*        G   6  -1.204   1.354   3.352
   60   2HO*    G   6          2HO*        G   6  -0.260   3.705   4.426
   61    H1*    G   6           H1*        G   6   0.831   2.256   5.081
   62    H8     G   6           H8         G   6  -1.122  -1.105   5.265
   63    H1     G   6           H1         G   6   4.839  -1.398   2.868
   64   1H2     G   6          1H2         G   6   5.609   0.673   2.535
   65   2H2     G   6          2H2         G   6   4.921   1.996   3.457
   66   1H5*    A   7          1H5*        A   7  -4.552   2.257   0.840
   67   2H5*    A   7          2H5*        A   7  -3.723   0.692   0.957
   68    H4*    A   7           H4*        A   7  -2.830   1.903  -0.937
   69    H3*    A   7           H3*        A   7  -0.960   1.879   1.459
   70    H2*    A   7           H2*        A   7   0.612   3.079   0.157
   71   2HO*    A   7          2HO*        A   7  -0.019   3.316  -2.217
   72    H1*    A   7           H1*        A   7  -1.285   4.507  -1.316
   73    H8     A   7           H8         A   7  -2.174   5.026   2.232
   74   1H6     A   7          1H6         A   7   1.350   9.419   2.597
   75   2H6     A   7          2H6         A   7   2.181   8.155   3.476
   76    H2     A   7           H2         A   7   2.895   6.892  -1.239
   77   1H5*    A   8          1H5*        A   8   0.852   0.493  -1.479
   78   2H5*    A   8          2H5*        A   8   2.027  -0.834  -1.592
   79    H4*    A   8           H4*        A   8   3.228   1.169  -2.049
   80    H3*    A   8           H3*        A   8   3.625   0.230   0.807
   81    H2*    A   8           H2*        A   8   5.104   2.046   1.178
   82   2HO*    A   8          2HO*        A   8   5.822   3.347  -0.598
   83    H1*    A   8           H1*        A   8   3.669   3.884  -0.381
   84    H8     A   8           H8         A   8   1.281   1.950   1.773
   85   1H6     A   8          1H6         A   8   1.891   4.437   6.028
   86   2H6     A   8          2H6         A   8   2.290   6.138   6.125
   87    H2     A   8           H2         A   8   5.565   6.580   3.013
   88   1H5*    A   9          2H5*        A   9   8.139  -1.783  -1.696
   89   2H5*    A   9          1H5*        A   9   7.212  -0.641  -0.704
   90    H4*    A   9           H4*        A   9   9.495  -0.095  -2.268
   91    H3*    A   9           H3*        A   9   7.447   1.653  -0.885
   92    H2*    A   9           H2*        A   9   8.397   3.557  -1.910
   93   2HO*    A   9          2HO*        A   9  10.519   2.138  -3.048
   94    H1*    A   9           H1*        A   9   8.926   2.330  -4.362
   95    H8     A   9           H8         A   9   6.680   4.120  -2.153
   96   1H6     A   9          1H6         A   9   2.595   4.431  -6.635
   97   2H6     A   9          2H6         A   9   2.470   4.226  -4.902
   98    H2     A   9           H2         A   9   5.479   1.027  -7.647
   99   1H5*    A  10          1H5*        A  10   9.854   0.896   4.208
  100   2H5*    A  10          2H5*        A  10   8.198   1.272   3.695
  101    H4*    A  10           H4*        A  10  10.198   3.503   3.860
  102    H3*    A  10           H3*        A  10   8.890   2.089   6.183
  103    H2*    A  10           H2*        A  10   8.348   4.131   7.207
  104   2HO*    A  10          2HO*        A  10   9.449   5.934   6.915
  105    H1*    A  10           H1*        A  10   7.719   5.523   4.879
  106    H8     A  10           H8         A  10   6.053   2.503   4.049
  107   1H6     A  10          1H6         A  10   1.812   3.456   8.481
  108   2H6     A  10          2H6         A  10   2.173   2.584   7.008
  109    H2     A  10           H2         A  10   5.265   6.216   9.228
  110   1H5*    A  11          1H5*        A  11   9.596   5.071   9.053
  111   2H5*    A  11          2H5*        A  11  10.364   4.010  10.255
  112    H4*    A  11           H4*        A  11   7.964   4.749  10.749
  113    H3*    A  11           H3*        A  11   8.761   1.828  10.649
  114    H2*    A  11           H2*        A  11   6.541   1.209  11.134
  115   2HO*    A  11          2HO*        A  11   5.570   2.337  12.605
  116    H1*    A  11           H1*        A  11   5.295   3.204   9.663
  117    H8     A  11           H8         A  11   8.184   1.615   7.785
  118   1H6     A  11          1H6         A  11   4.651  -3.030   6.402
  119   2H6     A  11          2H6         A  11   5.225  -1.808   5.294
  120    H2     A  11           H2         A  11   2.149  -0.221   9.077
  121   1H5*    G  12          1H5*        G  12   8.389  -1.114  13.844
  122   2H5*    G  12          2H5*        G  12   8.330  -0.271  12.288
  123    H4*    G  12           H4*        G  12   6.118   0.531  13.989
  124    H3*    G  12           H3*        G  12   6.523  -2.423  13.479
  125    H2*    G  12           H2*        G  12   4.255  -2.651  12.864
  126   2HO*    G  12          2HO*        G  12   3.567  -0.035  13.576
  127    H1*    G  12           H1*        G  12   4.018  -0.193  11.567
  128    H8     G  12           H8         G  12   7.018  -0.996   9.955
  129    H1     G  12           H1         G  12   2.551  -5.340   8.404
  130   1H2     G  12          1H2         G  12   0.825  -5.165   9.778
  131   2H2     G  12          2H2         G  12   0.993  -4.357  11.320
  132   1H5*    G  13          1H5*        G  13   6.390  -5.124  17.005
  133   2H5*    G  13          2H5*        G  13   6.229  -4.438  15.382
  134    H4*    G  13           H4*        G  13   3.838  -5.584  16.812
  135    H3*    G  13           H3*        G  13   5.998  -7.074  15.303
  136    H2*    G  13           H2*        G  13   4.398  -8.357  14.189
  137   2HO*    G  13          2HO*        G  13   2.082  -8.036  14.889
  138    H1*    G  13           H1*        G  13   2.500  -6.350  13.899
  139    H8     G  13           H8         G  13   5.686  -4.742  12.984
  140    H1     G  13           H1         G  13   3.745  -9.044   8.616
  141   1H2     G  13          1H2         G  13   1.819 -10.000   9.395
  142   2H2     G  13          2H2         G  13   1.832 -10.337  11.112
  143   1H5*    G  14          1H5*        G  14   1.320  -9.324  16.675
  144   2H5*    G  14          2H5*        G  14   1.648 -10.180  18.198
  145    H4*    G  14           H4*        G  14   0.960 -11.929  16.812
  146    H3*    G  14           H3*        G  14   3.960 -11.707  16.415
  147    H2*    G  14           H2*        G  14   3.804 -13.556  14.933
  148   2HO*    G  14          2HO*        G  14   1.520 -14.080  16.382
  149    H1*    G  14           H1*        G  14   1.408 -12.742  13.758
  150    H8     G  14           H8         G  14   3.957  -9.984  14.387
  151    H1     G  14           H1         G  14   4.789 -13.172   8.862
  152   1H2     G  14          1H2         G  14   2.980 -14.652   8.686
  153   2H2     G  14          2H2         G  14   2.798 -15.542  10.180
  154   1H5*    C  15          1H5*        C  15   2.716 -15.633  16.720
  155   2H5*    C  15          2H5*        C  15   3.750 -16.597  17.796
  156    H4*    C  15           H4*        C  15   3.502 -17.747  15.655
  157    H3*    C  15           H3*        C  15   6.239 -16.501  16.078
  158    H2*    C  15           H2*        C  15   6.913 -17.435  14.021
  159   2HO*    C  15          2HO*        C  15   6.330 -19.436  13.729
  160    H1*    C  15           H1*        C  15   4.397 -17.184  12.775
  161   1H4     C  15          1H4         C  15   8.057 -12.748  10.134
  162   2H4     C  15          2H4         C  15   8.258 -11.913  11.662
  163    H5     C  15           H5         C  15   6.818 -12.486  13.577
  164    H6     C  15           H6         C  15   5.476 -14.230  14.568
  165   2H    ASP   2          2H        ASP   2   9.704 -13.090  -1.730
  166   1H    ASP   2          1H        ASP   2   9.734 -14.233  -0.473
  167   3H    ASP   2          3H        ASP   2  11.070 -13.216  -0.731
  168    HA   ASP   2           HA       ASP   2   9.975 -12.264   1.108
  169   1HB   ASP   2          1HB       ASP   2   8.936 -10.875  -1.376
  170   2HB   ASP   2          2HB       ASP   2   9.354 -10.128   0.164
  171    H    ALA   3           H        ALA   3   7.649 -10.731   1.049
  172    HA   ALA   3           HA       ALA   3   5.342 -12.404   0.348
  173   1HB   ALA   3          1HB       ALA   3   6.326 -13.438   2.408
  174   2HB   ALA   3          2HB       ALA   3   6.069 -11.911   3.250
  175   3HB   ALA   3          3HB       ALA   3   4.688 -12.836   2.661
  176    H    GLN   4           H        GLN   4   6.565  -9.647   2.232
  177    HA   GLN   4           HA       GLN   4   4.026  -8.267   2.344
  178   1HB   GLN   4          1HB       GLN   4   6.268  -8.026   3.710
  179   2HB   GLN   4          2HB       GLN   4   6.742  -6.948   2.400
  180   1HG   GLN   4          1HG       GLN   4   4.056  -6.331   3.297
  181   2HG   GLN   4          2HG       GLN   4   5.182  -6.287   4.646
  182   1HE2  GLN   4          2HE2      GLN   4   4.879  -5.076   1.265
  183   2HE2  GLN   4          1HE2      GLN   4   5.731  -3.637   1.549
  184    H    THR   5           H        THR   5   6.947  -7.706   0.363
  185    HA   THR   5           HA       THR   5   5.863  -5.750  -1.383
  186    HB   THR   5           HB       THR   5   7.811  -8.039  -1.869
  187    HG1  THR   5           HG1      THR   5   8.261  -5.294  -1.325
  188   1HG2  THR   5          1HG2      THR   5   6.899  -7.116  -3.978
  189   2HG2  THR   5          2HG2      THR   5   7.383  -5.499  -3.466
  190   3HG2  THR   5          3HG2      THR   5   8.609  -6.728  -3.781
  191    H    ARG   6           H        ARG   6   5.464  -9.220  -1.184
  192    HA   ARG   6           HA       ARG   6   4.081  -9.588  -3.714
  193   1HB   ARG   6          1HB       ARG   6   4.914 -11.100  -1.361
  194   2HB   ARG   6          2HB       ARG   6   3.289 -11.557  -1.890
  195   1HG   ARG   6          1HG       ARG   6   4.752 -11.354  -4.269
  196   2HG   ARG   6          2HG       ARG   6   5.872 -12.121  -3.145
  197   1HD   ARG   6          1HD       ARG   6   3.014 -13.068  -3.537
  198   2HD   ARG   6          2HD       ARG   6   4.407 -13.761  -4.392
  199    HE   ARG   6           HE       ARG   6   4.798 -13.572  -1.502
  200   1HH1  ARG   6          1HH1      ARG   6   3.567 -15.476  -4.133
  201   2HH1  ARG   6          2HH1      ARG   6   3.709 -16.969  -3.270
  202   1HH2  ARG   6          1HH2      ARG   6   4.977 -15.514  -0.395
  203   2HH2  ARG   6          2HH2      ARG   6   4.504 -16.992  -1.164
  204    H    ARG   7           H        ARG   7   3.103  -9.308  -0.286
  205    HA   ARG   7           HA       ARG   7   0.313  -9.558  -0.757
  206   1HB   ARG   7          1HB       ARG   7   1.242  -9.720   1.466
  207   2HB   ARG   7          2HB       ARG   7   1.946  -8.107   1.346
  208   1HG   ARG   7          1HG       ARG   7  -0.439  -7.227   1.066
  209   2HG   ARG   7          2HG       ARG   7  -0.987  -8.831   1.542
  210   1HD   ARG   7          1HD       ARG   7  -0.269  -8.568   3.724
  211   2HD   ARG   7          2HD       ARG   7   1.030  -7.455   3.279
  212    HE   ARG   7           HE       ARG   7  -0.532  -5.688   3.424
  213   1HH1  ARG   7          1HH1      ARG   7  -2.126  -8.747   3.133
  214   2HH1  ARG   7          2HH1      ARG   7  -3.702  -8.081   3.356
  215   1HH2  ARG   7          1HH2      ARG   7  -2.573  -4.824   3.711
  216   2HH2  ARG   7          2HH2      ARG   7  -3.958  -5.861   3.683
  217    H    ARG   8           H        ARG   8   2.530  -6.849  -1.010
  218    HA   ARG   8           HA       ARG   8   0.753  -4.649  -1.153
  219   1HB   ARG   8          1HB       ARG   8   3.457  -5.183  -1.483
  220   2HB   ARG   8          2HB       ARG   8   2.977  -4.733  -3.113
  221   1HG   ARG   8          1HG       ARG   8   3.762  -2.808  -1.705
  222   2HG   ARG   8          2HG       ARG   8   2.146  -2.608  -2.371
  223   1HD   ARG   8          1HD       ARG   8   2.649  -2.096   0.209
  224   2HD   ARG   8          2HD       ARG   8   1.119  -2.834  -0.289
  225    HE   ARG   8           HE       ARG   8   3.255  -4.771   0.231
  226   1HH1  ARG   8          1HH1      ARG   8   0.618  -2.940   1.540
  227   2HH1  ARG   8          2HH1      ARG   8   0.366  -4.028   2.855
  228   1HH2  ARG   8          1HH2      ARG   8   2.914  -6.170   1.936
  229   2HH2  ARG   8          2HH2      ARG   8   1.656  -5.843   3.078
  230    H    GLU   9           H        GLU   9   1.712  -7.000  -3.616
  231    HA   GLU   9           HA       GLU   9   0.304  -5.801  -5.802
  232   1HB   GLU   9          1HB       GLU   9   0.861  -8.723  -5.148
  233   2HB   GLU   9          2HB       GLU   9   0.446  -8.104  -6.747
  234   1HG   GLU   9          1HG       GLU   9   2.688  -6.666  -5.522
  235   2HG   GLU   9          2HG       GLU   9   3.018  -8.383  -5.751
  236    H    ARG  10           H        ARG  10  -0.607  -7.885  -3.140
  237    HA   ARG  10           HA       ARG  10  -3.357  -8.296  -3.998
  238   1HB   ARG  10          1HB       ARG  10  -1.536  -9.128  -1.922
  239   2HB   ARG  10          2HB       ARG  10  -3.023  -8.550  -1.173
  240   1HG   ARG  10          1HG       ARG  10  -4.138 -10.399  -1.815
  241   2HG   ARG  10          2HG       ARG  10  -3.636 -10.177  -3.491
  242   1HD   ARG  10          1HD       ARG  10  -1.316 -11.097  -2.605
  243   2HD   ARG  10          2HD       ARG  10  -2.331 -11.801  -1.330
  244    HE   ARG  10           HE       ARG  10  -3.728 -12.381  -3.639
  245   1HH1  ARG  10          1HH1      ARG  10  -0.455 -12.860  -2.582
  246   2HH1  ARG  10          2HH1      ARG  10  -0.240 -14.296  -3.524
  247   1HH2  ARG  10          1HH2      ARG  10  -3.435 -14.246  -4.858
  248   2HH2  ARG  10          2HH2      ARG  10  -1.916 -15.077  -4.805
  249    H    ARG  11           H        ARG  11  -1.541  -5.731  -2.591
  250    HA   ARG  11           HA       ARG  11  -3.956  -4.448  -1.422
  251   1HB   ARG  11          1HB       ARG  11  -1.003  -3.740  -1.493
  252   2HB   ARG  11          2HB       ARG  11  -2.242  -2.795  -0.665
  253   1HG   ARG  11          1HG       ARG  11  -1.525  -5.690  -0.073
  254   2HG   ARG  11          2HG       ARG  11  -1.109  -4.312   0.930
  255   1HD   ARG  11          1HD       ARG  11  -3.154  -4.367   1.922
  256   2HD   ARG  11          2HD       ARG  11  -3.963  -4.321   0.351
  257    HE   ARG  11           HE       ARG  11  -2.750  -6.910   0.860
  258   1HH1  ARG  11          1HH1      ARG  11  -5.512  -4.896   1.469
  259   2HH1  ARG  11          2HH1      ARG  11  -6.578  -6.233   1.731
  260   1HH2  ARG  11          1HH2      ARG  11  -4.145  -8.639   1.203
  261   2HH2  ARG  11          2HH2      ARG  11  -5.810  -8.342   1.581
  262    H    ALA  12           H        ALA  12  -2.758  -4.779  -4.461
  263    HA   ALA  12           HA       ALA  12  -2.478  -2.137  -5.505
  264   1HB   ALA  12          1HB       ALA  12  -3.764  -4.643  -6.676
  265   2HB   ALA  12          2HB       ALA  12  -3.248  -3.246  -7.621
  266   3HB   ALA  12          3HB       ALA  12  -2.054  -4.223  -6.766
  267    H    GLU  13           H        GLU  13  -5.255  -3.940  -4.372
  268    HA   GLU  13           HA       GLU  13  -7.267  -2.173  -5.527
  269   1HB   GLU  13          1HB       GLU  13  -7.315  -4.182  -3.242
  270   2HB   GLU  13          2HB       GLU  13  -8.746  -3.470  -3.988
  271   1HG   GLU  13          1HG       GLU  13  -8.569  -4.752  -5.875
  272   2HG   GLU  13          2HG       GLU  13  -6.805  -4.729  -5.848
  273    H    LYS  14           H        LYS  14  -5.419  -2.438  -2.520
  274    HA   LYS  14           HA       LYS  14  -6.879  -0.285  -1.168
  275   1HB   LYS  14          1HB       LYS  14  -4.206  -1.664  -0.689
  276   2HB   LYS  14          2HB       LYS  14  -4.993  -0.582   0.461
  277   1HG   LYS  14          1HG       LYS  14  -6.310  -3.084  -0.618
  278   2HG   LYS  14          2HG       LYS  14  -5.377  -3.053   0.880
  279   1HD   LYS  14          1HD       LYS  14  -6.877  -1.385   1.831
  280   2HD   LYS  14          2HD       LYS  14  -7.766  -1.273   0.312
  281   1HE   LYS  14          1HE       LYS  14  -7.775  -4.014   0.908
  282   2HE   LYS  14          2HE       LYS  14  -8.073  -3.213   2.463
  283   1HZ   LYS  14          1HZ       LYS  14  -9.693  -1.770   1.285
  284   2HZ   LYS  14          2HZ       LYS  14  -9.510  -2.746  -0.093
  285   3HZ   LYS  14          3HZ       LYS  14 -10.153  -3.405   1.331
  286    H    GLN  15           H        GLN  15  -3.938  -0.755  -2.989
  287    HA   GLN  15           HA       GLN  15  -2.841   1.895  -2.764
  288   1HB   GLN  15          1HB       GLN  15  -2.389  -0.682  -4.082
  289   2HB   GLN  15          2HB       GLN  15  -1.945   0.660  -5.123
  290   1HG   GLN  15          1HG       GLN  15  -0.265   1.383  -3.700
  291   2HG   GLN  15          2HG       GLN  15  -1.078   0.747  -2.269
  292   1HE2  GLN  15          2HE2      GLN  15  -1.247  -1.763  -2.242
  293   2HE2  GLN  15          1HE2      GLN  15   0.112  -2.621  -2.794
  294    H    ALA  16           H        ALA  16  -4.631   0.215  -5.358
  295    HA   ALA  16           HA       ALA  16  -4.798   2.490  -7.108
  296   1HB   ALA  16          1HB       ALA  16  -6.578   0.045  -6.774
  297   2HB   ALA  16          2HB       ALA  16  -6.580   1.107  -8.182
  298   3HB   ALA  16          3HB       ALA  16  -5.149   0.148  -7.802
  299    H    GLN  17           H        GLN  17  -6.673   1.478  -4.301
  300    HA   GLN  17           HA       GLN  17  -8.881   3.338  -4.847
  301   1HB   GLN  17          1HB       GLN  17  -7.976   1.494  -2.644
  302   2HB   GLN  17          2HB       GLN  17  -9.227   2.685  -2.301
  303   1HG   GLN  17          1HG       GLN  17  -9.374   0.769  -4.639
  304   2HG   GLN  17          2HG       GLN  17 -10.082   0.418  -3.062
  305   1HE2  GLN  17          2HE2      GLN  17 -11.871   0.564  -5.157
  306   2HE2  GLN  17          1HE2      GLN  17 -12.762   2.007  -5.088
  307    H    TRP  18           H        TRP  18  -5.924   3.218  -2.967
  308    HA   TRP  18           HA       TRP  18  -6.296   5.806  -1.662
  309   1HB   TRP  18          1HB       TRP  18  -4.918   4.034  -0.681
  310   2HB   TRP  18          2HB       TRP  18  -3.950   3.938  -2.138
  311    HD1  TRP  18           HD1      TRP  18  -4.340   5.989   1.022
  312    HE1  TRP  18           HE1      TRP  18  -2.479   7.786   1.072
  313    HE3  TRP  18           HE3      TRP  18  -2.443   5.404  -3.623
  314    HZ2  TRP  18           HZ2      TRP  18  -0.436   8.807  -0.651
  315    HZ3  TRP  18           HZ3      TRP  18  -0.568   6.758  -4.400
  316    HH2  TRP  18           HH2      TRP  18   0.454   8.434  -2.946
  317    H    LYS  19           H        LYS  19  -4.331   4.508  -4.293
  318    HA   LYS  19           HA       LYS  19  -3.019   6.892  -5.108
  319   1HB   LYS  19          1HB       LYS  19  -3.849   4.329  -6.492
  320   2HB   LYS  19          2HB       LYS  19  -2.941   5.581  -7.324
  321   1HG   LYS  19          1HG       LYS  19  -1.329   5.427  -5.281
  322   2HG   LYS  19          2HG       LYS  19  -2.071   3.851  -5.035
  323   1HD   LYS  19          1HD       LYS  19  -1.316   4.385  -7.829
  324   2HD   LYS  19          2HD       LYS  19   0.051   4.341  -6.717
  325   1HE   LYS  19          1HE       LYS  19  -0.624   2.128  -5.910
  326   2HE   LYS  19          2HE       LYS  19  -2.069   2.174  -6.940
  327   1HZ   LYS  19          1HZ       LYS  19   0.711   2.468  -7.945
  328   2HZ   LYS  19          2HZ       LYS  19  -0.162   1.015  -7.989
  329   3HZ   LYS  19          3HZ       LYS  19  -0.704   2.357  -8.879
  330    H    ALA  20           H        ALA  20  -6.166   5.499  -5.858
  331    HA   ALA  20           HA       ALA  20  -6.886   7.193  -8.008
  332   1HB   ALA  20          1HB       ALA  20  -8.352   5.710  -5.843
  333   2HB   ALA  20          2HB       ALA  20  -9.242   6.685  -7.011
  334   3HB   ALA  20          3HB       ALA  20  -8.257   5.330  -7.563
  335    H    ALA  21           H        ALA  21  -6.806   7.702  -4.542
  336    HA   ALA  21           HA       ALA  21  -7.789  10.491  -4.970
  337   1HB   ALA  21          1HB       ALA  21  -9.078   8.604  -3.584
  338   2HB   ALA  21          2HB       ALA  21  -7.959   9.114  -2.322
  339   3HB   ALA  21          3HB       ALA  21  -9.068  10.282  -3.038
  340    H    ASN  22           H        ASN  22  -5.056   9.313  -5.012
  341    HA   ASN  22           HA       ASN  22  -3.787  11.333  -3.278
  342   1HB   ASN  22          1HB       ASN  22  -3.303   8.358  -2.967
  343   2HB   ASN  22          2HB       ASN  22  -2.337   9.618  -2.204
  344   1HD2  ASN  22          2HD2      ASN  22  -4.794   7.543  -1.551
  345   2HD2  ASN  22          1HD2      ASN  22  -5.618   8.416  -0.351
  346    HA   PRO  23           HA       PRO  23  -1.550  10.029  -7.222
  347   1HB   PRO  23          1HB       PRO  23  -2.247  12.152  -8.809
  348   2HB   PRO  23          2HB       PRO  23  -3.175  10.640  -8.774
  349   1HG   PRO  23          1HG       PRO  23  -3.748  13.240  -7.463
  350   2HG   PRO  23          2HG       PRO  23  -4.861  12.066  -8.182
  351   1HD   PRO  23          1HD       PRO  23  -4.417  12.323  -5.487
  352   2HD   PRO  23          2HD       PRO  23  -5.000  10.837  -6.256
  353    H    LEU  24           H        LEU  24  -2.218  12.924  -5.413
  354    HA   LEU  24           HA       LEU  24  -0.007  14.567  -6.096
  355   1HB   LEU  24          1HB       LEU  24  -0.745  15.802  -4.246
  356   2HB   LEU  24          2HB       LEU  24  -2.167  14.807  -4.532
  357    HG   LEU  24           HG       LEU  24   0.027  13.960  -2.614
  358   1HD1  LEU  24          1HD1      LEU  24  -1.248  16.248  -2.189
  359   2HD1  LEU  24          2HD1      LEU  24  -2.531  15.165  -1.650
  360   3HD1  LEU  24          3HD1      LEU  24  -0.949  15.114  -0.871
  361   1HD2  LEU  24          1HD2      LEU  24  -2.120  12.556  -3.640
  362   2HD2  LEU  24          2HD2      LEU  24  -1.342  12.199  -2.098
  363   3HD2  LEU  24          3HD2      LEU  24  -2.791  13.205  -2.149
  364    H    LEU  25           H        LEU  25  -0.327  11.827  -3.932
  365    HA   LEU  25           HA       LEU  25   2.540  11.951  -3.146
  366   1HB   LEU  25          1HB       LEU  25  -0.019  10.766  -2.175
  367   2HB   LEU  25          2HB       LEU  25   1.423   9.781  -1.909
  368    HG   LEU  25           HG       LEU  25   1.743  12.644  -1.241
  369   1HD1  LEU  25          1HD1      LEU  25  -0.373  10.935  -0.020
  370   2HD1  LEU  25          2HD1      LEU  25   0.611  11.903   1.078
  371   3HD1  LEU  25          3HD1      LEU  25  -0.311  12.688  -0.205
  372   1HD2  LEU  25          1HD2      LEU  25   3.200  10.423  -0.818
  373   2HD2  LEU  25          2HD2      LEU  25   3.246  11.795   0.288
  374   3HD2  LEU  25          3HD2      LEU  25   2.237  10.397   0.659
  375    H    VAL  26           H        VAL  26   1.652  11.483  -5.807
  376    HA   VAL  26           HA       VAL  26   2.845   8.836  -6.374
  377    HB   VAL  26           HB       VAL  26  -0.005   9.651  -6.425
  378   1HG1  VAL  26          1HG1      VAL  26   1.289   8.395  -8.856
  379   2HG1  VAL  26          2HG1      VAL  26  -0.421   8.178  -8.480
  380   3HG1  VAL  26          3HG1      VAL  26   0.217   9.795  -8.787
  381   1HG2  VAL  26          1HG2      VAL  26   1.422   6.973  -6.599
  382   2HG2  VAL  26          2HG2      VAL  26   0.871   7.757  -5.116
  383   3HG2  VAL  26          3HG2      VAL  26  -0.304   7.200  -6.309
  384    H    GLY  27           H        GLY  27   3.599   8.773  -8.615
  385   1HA   GLY  27          1HA       GLY  27   4.494  11.228  -9.711
  386   2HA   GLY  27          2HA       GLY  27   4.352   9.728 -10.634
  387    H    VAL  28           H        VAL  28   3.027  12.849 -10.195
  388    HA   VAL  28           HA       VAL  28   0.315  12.630 -10.803
  389    HB   VAL  28           HB       VAL  28   1.542  14.730 -10.384
  390   1HG1  VAL  28          1HG1      VAL  28   3.558  14.121 -11.727
  391   2HG1  VAL  28          2HG1      VAL  28   2.617  14.372 -13.198
  392   3HG1  VAL  28          3HG1      VAL  28   2.943  15.728 -12.118
  393   1HG2  VAL  28          1HG2      VAL  28  -0.233  14.342 -12.737
  394   2HG2  VAL  28          2HG2      VAL  28  -0.429  15.403 -11.340
  395   3HG2  VAL  28          3HG2      VAL  28   0.623  15.884 -12.669
  396    H    SER  29           H        SER  29  -0.876  12.210 -12.679
  397    HA   SER  29           HA       SER  29  -1.318  11.314 -14.808
  398   1HB   SER  29          1HB       SER  29   1.344  12.571 -15.515
  399   2HB   SER  29          2HB       SER  29  -0.036  12.316 -16.581
  400    HG   SER  29           HG       SER  29   0.446  14.287 -14.710
  401    H    ALA  30           H        ALA  30  -0.158   9.528 -13.012
  402    HA   ALA  30           HA       ALA  30   1.558   7.858 -14.822
  403   1HB   ALA  30          1HB       ALA  30   2.775   9.041 -12.924
  404   2HB   ALA  30          2HB       ALA  30   1.805   8.084 -11.803
  405   3HB   ALA  30          3HB       ALA  30   2.923   7.285 -12.909
  406    H    LYS  31           H        LYS  31  -1.111   7.435 -14.902
  407    HA   LYS  31           HA       LYS  31  -1.413   4.780 -13.692
  408   1HB   LYS  31          1HB       LYS  31  -3.566   5.593 -12.522
  409   2HB   LYS  31          2HB       LYS  31  -2.035   6.056 -11.781
  410   1HG   LYS  31          1HG       LYS  31  -2.418   8.261 -12.135
  411   2HG   LYS  31          2HG       LYS  31  -2.905   7.979 -13.808
  412   1HD   LYS  31          1HD       LYS  31  -4.927   8.690 -12.948
  413   2HD   LYS  31          2HD       LYS  31  -5.069   6.962 -12.623
  414   1HE   LYS  31          1HE       LYS  31  -5.462   7.632 -10.469
  415   2HE   LYS  31          2HE       LYS  31  -3.702   7.849 -10.393
  416   1HZ   LYS  31          1HZ       LYS  31  -4.048  10.098 -11.347
  417   2HZ   LYS  31          2HZ       LYS  31  -5.724   9.882 -11.171
  418   3HZ   LYS  31          3HZ       LYS  31  -4.719   9.914  -9.802
  419    HA   PRO  32           HA       PRO  32  -3.644   5.286 -17.653
  420   1HB   PRO  32          1HB       PRO  32  -3.185   2.730 -18.516
  421   2HB   PRO  32          2HB       PRO  32  -2.015   4.047 -18.733
  422   1HG   PRO  32          1HG       PRO  32  -2.057   1.869 -16.706
  423   2HG   PRO  32          2HG       PRO  32  -0.685   2.585 -17.566
  424   1HD   PRO  32          1HD       PRO  32  -1.338   3.199 -14.990
  425   2HD   PRO  32          2HD       PRO  32  -0.491   4.315 -16.083
  426    H    VAL  33           H        VAL  33  -5.466   3.784 -18.551
  427    HA   VAL  33           HA       VAL  33  -6.792   2.199 -16.397
  428    HB   VAL  33           HB       VAL  33  -8.879   3.493 -16.827
  429   1HG1  VAL  33          1HG1      VAL  33  -6.998   4.141 -15.126
  430   2HG1  VAL  33          2HG1      VAL  33  -6.712   5.490 -16.225
  431   3HG1  VAL  33          3HG1      VAL  33  -8.287   5.297 -15.457
  432   1HG2  VAL  33          1HG2      VAL  33  -7.025   5.070 -18.636
  433   2HG2  VAL  33          2HG2      VAL  33  -8.506   4.232 -19.095
  434   3HG2  VAL  33          3HG2      VAL  33  -8.586   5.676 -18.086
  435    H    ASN  34           H        ASN  34  -8.158   0.563 -17.227
  436    HA   ASN  34           HA       ASN  34  -8.212   0.295 -20.218
  437   1HB   ASN  34          1HB       ASN  34  -7.631  -1.616 -17.966
  438   2HB   ASN  34          2HB       ASN  34  -8.247  -2.234 -19.499
  439   1HD2  ASN  34          2HD2      ASN  34  -6.826  -2.218 -21.328
  440   2HD2  ASN  34          1HD2      ASN  34  -5.201  -1.741 -21.225
  441    H    ARG  35           H        ARG  35 -10.335   1.619 -19.192
  442    HA   ARG  35           HA       ARG  35 -12.528  -0.393 -19.358
  443   1HB   ARG  35          1HB       ARG  35 -11.832   1.445 -17.092
  444   2HB   ARG  35          2HB       ARG  35 -13.532   1.100 -17.404
  445   1HG   ARG  35          1HG       ARG  35 -13.290  -0.838 -16.286
  446   2HG   ARG  35          2HG       ARG  35 -12.210  -1.390 -17.566
  447   1HD   ARG  35          1HD       ARG  35 -10.743   0.399 -15.854
  448   2HD   ARG  35          2HD       ARG  35 -11.529  -0.839 -14.855
  449    HE   ARG  35           HE       ARG  35  -9.407  -1.322 -16.778
  450   1HH1  ARG  35          1HH1      ARG  35 -12.283  -2.622 -15.336
  451   2HH1  ARG  35          2HH1      ARG  35 -11.817  -4.267 -15.603
  452   1HH2  ARG  35          1HH2      ARG  35  -8.809  -3.463 -17.121
  453   2HH2  ARG  35          2HH2      ARG  35  -9.859  -4.742 -16.609
  454    HA   PRO  36           HA       PRO  36 -13.163   3.637 -21.664
  455   1HB   PRO  36          1HB       PRO  36 -13.362   2.557 -24.172
  456   2HB   PRO  36          2HB       PRO  36 -11.819   3.074 -23.462
  457   1HG   PRO  36          1HG       PRO  36 -12.962   0.340 -23.719
  458   2HG   PRO  36          2HG       PRO  36 -11.287   0.885 -23.887
  459   1HD   PRO  36          1HD       PRO  36 -12.264  -0.356 -21.656
  460   2HD   PRO  36          2HD       PRO  36 -10.887   0.769 -21.640
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  12.572 -15.705   1.976
    2   2H5*    G   1          2H5*        G   1  12.937 -17.138   0.987
    3    H4*    G   1           H4*        G   1  11.123 -18.317   1.783
    4    H3*    G   1           H3*        G   1   9.793 -15.630   2.278
    5    H2*    G   1           H2*        G   1   8.441 -16.643   3.933
    6   2HO*    G   1          2HO*        G   1   8.317 -18.881   4.196
    7    H1*    G   1           H1*        G   1  10.445 -18.297   4.931
    8    H8     G   1           H8         G   1  11.741 -14.804   4.306
    9    H1     G   1           H1         G   1   8.166 -15.361   9.616
   10   1H2     G   1          1H2         G   1   7.347 -17.420   9.754
   11   2H2     G   1          2H2         G   1   7.299 -18.457   8.346
   12   1H5*    C   2          1H5*        C   2   6.000 -16.845   1.044
   13   2H5*    C   2          2H5*        C   2   7.136 -16.512   2.371
   14    H4*    C   2           H4*        C   2   4.867 -18.381   2.920
   15    H3*    C   2           H3*        C   2   4.580 -15.392   2.507
   16    H2*    C   2           H2*        C   2   3.217 -15.237   4.416
   17   2HO*    C   2          2HO*        C   2   2.572 -17.336   5.450
   18    H1*    C   2           H1*        C   2   4.553 -17.153   5.943
   19   1H4     C   2          1H4         C   2   6.681 -11.649   8.223
   20   2H4     C   2          2H4         C   2   7.715 -11.423   6.834
   21    H5     C   2           H5         C   2   7.451 -12.774   4.814
   22    H6     C   2           H6         C   2   6.776 -15.002   4.036
   23   1H5*    C   3          1H5*        C   3   0.196 -13.938   1.749
   24   2H5*    C   3          2H5*        C   3   1.392 -12.700   2.169
   25    H4*    C   3           H4*        C   3  -0.326 -14.367   4.007
   26    H3*    C   3           H3*        C   3   0.210 -11.424   3.582
   27    H2*    C   3           H2*        C   3  -0.107 -10.997   5.859
   28   2HO*    C   3          2HO*        C   3  -0.812 -13.476   6.732
   29    H1*    C   3           H1*        C   3   1.092 -13.320   6.805
   30   1H4     C   3          1H4         C   3   5.535  -8.791   7.323
   31   2H4     C   3          2H4         C   3   5.735  -8.732   5.586
   32    H5     C   3           H5         C   3   4.746 -10.487   4.185
   33    H6     C   3           H6         C   3   3.064 -12.243   4.074
   34   1H5*    C   4          1H5*        C   4  -3.941 -10.199   4.708
   35   2H5*    C   4          2H5*        C   4  -2.172 -10.303   4.806
   36    H4*    C   4           H4*        C   4  -3.923 -10.037   7.254
   37    H3*    C   4           H3*        C   4  -2.810  -7.856   5.453
   38    H2*    C   4           H2*        C   4  -2.204  -6.599   7.337
   39   2HO*    C   4          2HO*        C   4  -4.340  -7.862   8.456
   40    H1*    C   4           H1*        C   4  -1.482  -8.730   8.971
   41   1H4     C   4          1H4         C   4   3.631  -5.993   6.077
   42   2H4     C   4          2H4         C   4   4.118  -7.660   5.898
   43    H5     C   4           H5         C   4   1.798  -8.606   4.833
   44    H6     C   4           H6         C   4  -0.316  -9.285   5.635
   45   1H5*    U   5          1H5*        U   5  -5.019  -5.905   8.248
   46   2H5*    U   5          2H5*        U   5  -6.154  -4.746   7.522
   47    H4*    U   5           H4*        U   5  -4.840  -3.539   9.108
   48    H3*    U   5           H3*        U   5  -3.891  -3.035   6.275
   49    H2*    U   5           H2*        U   5  -2.314  -1.514   7.157
   50   2HO*    U   5          2HO*        U   5  -3.496  -1.603   9.722
   51    H1*    U   5           H1*        U   5  -1.901  -2.930   9.558
   52    H3     U   5           H3         U   5   2.090  -2.396   7.472
   53    H5     U   5           H5         U   5   0.272  -5.579   5.453
   54    H6     U   5           H6         U   5  -1.766  -5.014   6.587
   55   1H5*    G   6          1H5*        G   6  -2.093   0.318   7.883
   56   2H5*    G   6          2H5*        G   6  -3.325   1.598   7.802
   57    H4*    G   6           H4*        G   6  -1.870   2.664   6.439
   58    H3*    G   6           H3*        G   6  -2.747   0.411   4.587
   59    H2*    G   6           H2*        G   6  -1.139   1.126   3.038
   60   2HO*    G   6          2HO*        G   6  -1.456   3.581   4.333
   61    H1*    G   6           H1*        G   6   0.758   1.969   4.947
   62    H8     G   6           H8         G   6  -1.080  -1.443   4.836
   63    H1     G   6           H1         G   6   4.869  -1.356   2.382
   64   1H2     G   6          1H2         G   6   5.559   0.780   2.193
   65   2H2     G   6          2H2         G   6   4.880   1.962   3.299
   66   1H5*    A   7          1H5*        A   7  -4.485   1.864   0.470
   67   2H5*    A   7          2H5*        A   7  -3.555   0.352   0.468
   68    H4*    A   7           H4*        A   7  -2.674   1.803  -1.249
   69    H3*    A   7           H3*        A   7  -0.900   1.680   1.212
   70    H2*    A   7           H2*        A   7   0.639   3.088   0.080
   71   2HO*    A   7          2HO*        A   7   1.002   2.529  -1.907
   72    H1*    A   7           H1*        A   7  -1.309   4.539  -1.304
   73    H8     A   7           H8         A   7  -2.341   4.576   2.245
   74   1H6     A   7          1H6         A   7   1.955   8.918   3.299
   75   2H6     A   7          2H6         A   7   0.582   8.066   3.968
   76    H2     A   7           H2         A   7   2.664   7.221  -0.792
   77   1H5*    A   8          1H5*        A   8   1.188   0.694  -1.785
   78   2H5*    A   8          2H5*        A   8   2.474  -0.533  -1.842
   79    H4*    A   8           H4*        A   8   3.479   1.623  -2.218
   80    H3*    A   8           H3*        A   8   3.933   0.544   0.581
   81    H2*    A   8           H2*        A   8   5.197   2.458   1.127
   82   2HO*    A   8          2HO*        A   8   6.373   3.456  -0.293
   83    H1*    A   8           H1*        A   8   3.631   4.268  -0.325
   84    H8     A   8           H8         A   8   1.391   1.917   1.576
   85   1H6     A   8          1H6         A   8   2.309   5.435   6.563
   86   2H6     A   8          2H6         A   8   1.085   4.499   5.733
   87    H2     A   8           H2         A   8   5.130   6.839   3.346
   88   1H5*    A   9          2H5*        A   9   8.514  -1.121  -2.131
   89   2H5*    A   9          1H5*        A   9   7.527  -0.170  -1.003
   90    H4*    A   9           H4*        A   9   9.701   0.748  -2.510
   91    H3*    A   9           H3*        A   9   7.455   2.181  -1.064
   92    H2*    A   9           H2*        A   9   8.282   4.233  -1.909
   93   2HO*    A   9          2HO*        A   9  10.639   2.766  -2.217
   94    H1*    A   9           H1*        A   9   8.949   3.224  -4.428
   95    H8     A   9           H8         A   9   6.509   4.626  -2.122
   96   1H6     A   9          1H6         A   9   2.638   5.252  -6.551
   97   2H6     A   9          2H6         A   9   2.227   4.399  -5.080
   98    H2     A   9           H2         A   9   5.648   1.899  -7.867
   99   1H5*    A  10          1H5*        A  10   9.982   1.059   4.071
  100   2H5*    A  10          2H5*        A  10   8.328   1.331   3.477
  101    H4*    A  10           H4*        A  10  10.143   3.700   3.645
  102    H3*    A  10           H3*        A  10   8.987   2.232   6.021
  103    H2*    A  10           H2*        A  10   8.302   4.255   6.998
  104   2HO*    A  10          2HO*        A  10   9.562   5.863   5.091
  105    H1*    A  10           H1*        A  10   7.540   5.533   4.643
  106    H8     A  10           H8         A  10   6.114   2.310   4.003
  107   1H6     A  10          1H6         A  10   2.508   2.144   8.136
  108   2H6     A  10          2H6         A  10   1.591   3.346   7.255
  109    H2     A  10           H2         A  10   5.068   6.275   8.945
  110   1H5*    A  11          1H5*        A  11   9.893   4.814   8.710
  111   2H5*    A  11          2H5*        A  11  10.497   3.786  10.031
  112    H4*    A  11           H4*        A  11   8.130   4.795  10.271
  113    H3*    A  11           H3*        A  11   8.726   1.844  10.602
  114    H2*    A  11           H2*        A  11   6.442   1.443  11.042
  115   2HO*    A  11          2HO*        A  11   5.150   3.639  11.063
  116    H1*    A  11           H1*        A  11   5.424   3.287   9.247
  117    H8     A  11           H8         A  11   8.236   1.382   7.617
  118   1H6     A  11          1H6         A  11   4.376  -3.174   6.537
  119   2H6     A  11          2H6         A  11   5.214  -2.103   5.439
  120    H2     A  11           H2         A  11   2.146  -0.079   9.069
  121   1H5*    G  12          1H5*        G  12   8.560  -0.826  13.759
  122   2H5*    G  12          2H5*        G  12   8.497  -0.065  12.159
  123    H4*    G  12           H4*        G  12   6.261   0.780  13.808
  124    H3*    G  12           H3*        G  12   6.700  -2.183  13.461
  125    H2*    G  12           H2*        G  12   4.425  -2.457  12.868
  126   2HO*    G  12          2HO*        G  12   4.064  -0.423  14.550
  127    H1*    G  12           H1*        G  12   4.183  -0.073  11.430
  128    H8     G  12           H8         G  12   7.232  -1.053   9.941
  129    H1     G  12           H1         G  12   2.641  -5.287   8.451
  130   1H2     G  12          1H2         G  12   0.809  -4.844   9.671
  131   2H2     G  12          2H2         G  12   1.049  -4.187  11.274
  132   1H5*    G  13          1H5*        G  13   5.470  -4.562  17.495
  133   2H5*    G  13          2H5*        G  13   6.340  -5.593  16.362
  134    H4*    G  13           H4*        G  13   3.479  -5.347  16.898
  135    H3*    G  13           H3*        G  13   5.311  -7.276  15.467
  136    H2*    G  13           H2*        G  13   3.520  -8.148  14.270
  137   2HO*    G  13          2HO*        G  13   1.323  -7.638  14.847
  138    H1*    G  13           H1*        G  13   2.123  -5.788  13.885
  139    H8     G  13           H8         G  13   5.477  -4.685  13.194
  140    H1     G  13           H1         G  13   3.514  -8.956   8.807
  141   1H2     G  13          1H2         G  13   1.524  -9.782   9.440
  142   2H2     G  13          2H2         G  13   1.186  -9.867  11.153
  143   1H5*    G  14          1H5*        G  14   2.539  -9.219  17.033
  144   2H5*    G  14          2H5*        G  14   2.133 -10.059  18.547
  145    H4*    G  14           H4*        G  14   1.522 -11.820  17.277
  146    H3*    G  14           H3*        G  14   4.486 -11.866  16.632
  147    H2*    G  14           H2*        G  14   4.031 -13.565  15.041
  148   2HO*    G  14          2HO*        G  14   1.686 -14.280  14.965
  149    H1*    G  14           H1*        G  14   1.640 -12.444  14.140
  150    H8     G  14           H8         G  14   4.267  -9.777  14.598
  151    H1     G  14           H1         G  14   4.927 -13.162   9.162
  152   1H2     G  14          1H2         G  14   3.867 -15.244   9.584
  153   2H2     G  14          2H2         G  14   2.245 -14.900  10.141
  154   1H5*    C  15          1H5*        C  15   3.057 -15.591  16.963
  155   2H5*    C  15          2H5*        C  15   3.979 -16.711  17.993
  156    H4*    C  15           H4*        C  15   3.583 -17.796  15.865
  157    H3*    C  15           H3*        C  15   6.426 -16.782  16.171
  158    H2*    C  15           H2*        C  15   6.927 -17.730  14.071
  159   2HO*    C  15          2HO*        C  15   5.477 -19.692  14.818
  160    H1*    C  15           H1*        C  15   4.385 -17.259  12.949
  161   1H4     C  15          1H4         C  15   8.335 -13.116  10.228
  162   2H4     C  15          2H4         C  15   8.563 -12.259  11.740
  163    H5     C  15           H5         C  15   7.148 -12.751  13.682
  164    H6     C  15           H6         C  15   5.686 -14.389  14.693
  165   2H    ASP   2          2H        ASP   2   9.769 -12.820  -1.049
  166   1H    ASP   2          1H        ASP   2   9.548 -14.280  -0.212
  167   3H    ASP   2          3H        ASP   2  10.922 -13.327   0.087
  168    HA   ASP   2           HA       ASP   2   9.519 -12.881   1.906
  169   1HB   ASP   2          1HB       ASP   2   8.992 -10.766  -0.200
  170   2HB   ASP   2          2HB       ASP   2   9.088 -10.524   1.542
  171    H    ALA   3           H        ALA   3   7.260 -11.233   1.883
  172    HA   ALA   3           HA       ALA   3   5.125 -12.757   0.469
  173   1HB   ALA   3          1HB       ALA   3   5.651 -13.800   2.696
  174   2HB   ALA   3          2HB       ALA   3   5.200 -12.278   3.459
  175   3HB   ALA   3          3HB       ALA   3   3.994 -13.210   2.574
  176    H    GLN   4           H        GLN   4   5.954 -10.023   2.586
  177    HA   GLN   4           HA       GLN   4   3.475  -8.604   2.197
  178   1HB   GLN   4          1HB       GLN   4   5.264  -8.314   4.004
  179   2HB   GLN   4          2HB       GLN   4   6.219  -7.463   2.793
  180   1HG   GLN   4          1HG       GLN   4   4.184  -5.959   2.442
  181   2HG   GLN   4          2HG       GLN   4   3.524  -6.677   3.913
  182   1HE2  GLN   4          2HE2      GLN   4   5.318  -4.060   2.852
  183   2HE2  GLN   4          1HE2      GLN   4   6.156  -3.710   4.285
  184    H    THR   5           H        THR   5   6.715  -8.139   0.773
  185    HA   THR   5           HA       THR   5   6.100  -6.134  -1.111
  186    HB   THR   5           HB       THR   5   7.859  -8.599  -1.417
  187    HG1  THR   5           HG1      THR   5   8.510  -5.981  -0.549
  188   1HG2  THR   5          1HG2      THR   5   7.677  -5.983  -2.902
  189   2HG2  THR   5          2HG2      THR   5   9.151  -6.953  -2.909
  190   3HG2  THR   5          3HG2      THR   5   7.653  -7.620  -3.560
  191    H    ARG   6           H        ARG   6   5.441  -9.581  -1.106
  192    HA   ARG   6           HA       ARG   6   4.354  -9.754  -3.802
  193   1HB   ARG   6          1HB       ARG   6   4.840 -11.408  -1.466
  194   2HB   ARG   6          2HB       ARG   6   3.208 -11.689  -2.084
  195   1HG   ARG   6          1HG       ARG   6   4.213 -13.092  -3.567
  196   2HG   ARG   6          2HG       ARG   6   4.712 -11.622  -4.402
  197   1HD   ARG   6          1HD       ARG   6   6.739 -12.836  -4.091
  198   2HD   ARG   6          2HD       ARG   6   6.748 -11.648  -2.772
  199    HE   ARG   6           HE       ARG   6   6.431 -13.424  -1.251
  200   1HH1  ARG   6          1HH1      ARG   6   5.554 -14.374  -4.472
  201   2HH1  ARG   6          2HH1      ARG   6   5.268 -16.024  -4.033
  202   1HH2  ARG   6          1HH2      ARG   6   6.056 -15.570  -0.692
  203   2HH2  ARG   6          2HH2      ARG   6   5.551 -16.698  -1.905
  204    H    ARG   7           H        ARG   7   3.046  -9.524  -0.507
  205    HA   ARG   7           HA       ARG   7   0.304  -9.538  -1.169
  206   1HB   ARG   7          1HB       ARG   7   1.097  -9.770   1.104
  207   2HB   ARG   7          2HB       ARG   7   1.895  -8.201   1.039
  208   1HG   ARG   7          1HG       ARG   7  -0.446  -7.212   0.597
  209   2HG   ARG   7          2HG       ARG   7  -1.070  -8.778   1.110
  210   1HD   ARG   7          1HD       ARG   7  -0.454  -8.447   3.308
  211   2HD   ARG   7          2HD       ARG   7   0.948  -7.454   2.882
  212    HE   ARG   7           HE       ARG   7  -0.477  -5.578   2.958
  213   1HH1  ARG   7          1HH1      ARG   7  -2.310  -8.481   2.482
  214   2HH1  ARG   7          2HH1      ARG   7  -3.831  -7.666   2.556
  215   1HH2  ARG   7          1HH2      ARG   7  -2.426  -4.529   3.065
  216   2HH2  ARG   7          2HH2      ARG   7  -3.899  -5.419   2.884
  217    H    ARG   8           H        ARG   8   2.689  -6.940  -1.209
  218    HA   ARG   8           HA       ARG   8   1.003  -4.675  -1.474
  219   1HB   ARG   8          1HB       ARG   8   3.666  -5.163  -1.398
  220   2HB   ARG   8          2HB       ARG   8   3.484  -4.885  -3.128
  221   1HG   ARG   8          1HG       ARG   8   3.895  -2.729  -2.301
  222   2HG   ARG   8          2HG       ARG   8   2.136  -2.775  -2.412
  223   1HD   ARG   8          1HD       ARG   8   2.967  -1.851  -0.219
  224   2HD   ARG   8          2HD       ARG   8   1.960  -3.298  -0.022
  225    HE   ARG   8           HE       ARG   8   3.876  -4.456   0.729
  226   1HH1  ARG   8          1HH1      ARG   8   4.766  -1.626  -1.060
  227   2HH1  ARG   8          2HH1      ARG   8   6.456  -1.816  -0.750
  228   1HH2  ARG   8          1HH2      ARG   8   6.074  -4.697   1.129
  229   2HH2  ARG   8          2HH2      ARG   8   7.196  -3.545   0.484
  230    H    GLU   9           H        GLU   9   2.123  -7.014  -3.890
  231    HA   GLU   9           HA       GLU   9   0.990  -5.675  -6.169
  232   1HB   GLU   9          1HB       GLU   9   1.427  -8.628  -5.564
  233   2HB   GLU   9          2HB       GLU   9   1.137  -7.965  -7.173
  234   1HG   GLU   9          1HG       GLU   9   3.254  -6.453  -6.018
  235   2HG   GLU   9          2HG       GLU   9   3.622  -8.156  -5.743
  236    H    ARG  10           H        ARG  10  -0.249  -7.734  -3.646
  237    HA   ARG  10           HA       ARG  10  -2.909  -8.046  -4.803
  238   1HB   ARG  10          1HB       ARG  10  -1.333  -8.975  -2.554
  239   2HB   ARG  10          2HB       ARG  10  -2.916  -8.432  -1.998
  240   1HG   ARG  10          1HG       ARG  10  -4.055 -10.026  -3.251
  241   2HG   ARG  10          2HG       ARG  10  -2.756 -10.168  -4.437
  242   1HD   ARG  10          1HD       ARG  10  -1.335 -11.259  -2.670
  243   2HD   ARG  10          2HD       ARG  10  -2.750 -11.254  -1.600
  244    HE   ARG  10           HE       ARG  10  -3.379 -12.365  -4.206
  245   1HH1  ARG  10          1HH1      ARG  10  -1.953 -13.020  -1.111
  246   2HH1  ARG  10          2HH1      ARG  10  -2.271 -14.719  -1.191
  247   1HH2  ARG  10          1HH2      ARG  10  -3.788 -14.577  -4.301
  248   2HH2  ARG  10          2HH2      ARG  10  -3.305 -15.598  -2.989
  249    H    ARG  11           H        ARG  11  -1.160  -5.593  -3.161
  250    HA   ARG  11           HA       ARG  11  -3.609  -4.305  -2.109
  251   1HB   ARG  11          1HB       ARG  11  -0.651  -3.638  -2.009
  252   2HB   ARG  11          2HB       ARG  11  -1.915  -2.669  -1.249
  253   1HG   ARG  11          1HG       ARG  11  -1.210  -5.557  -0.612
  254   2HG   ARG  11          2HG       ARG  11  -0.976  -4.174   0.439
  255   1HD   ARG  11          1HD       ARG  11  -3.098  -4.363   1.212
  256   2HD   ARG  11          2HD       ARG  11  -3.748  -4.306  -0.429
  257    HE   ARG  11           HE       ARG  11  -2.458  -6.850   0.165
  258   1HH1  ARG  11          1HH1      ARG  11  -5.384  -4.997   0.433
  259   2HH1  ARG  11          2HH1      ARG  11  -6.399  -6.393   0.520
  260   1HH2  ARG  11          1HH2      ARG  11  -3.791  -8.657   0.281
  261   2HH2  ARG  11          2HH2      ARG  11  -5.505  -8.454   0.436
  262    H    ALA  12           H        ALA  12  -2.174  -4.502  -5.099
  263    HA   ALA  12           HA       ALA  12  -1.917  -1.804  -5.996
  264   1HB   ALA  12          1HB       ALA  12  -1.477  -4.040  -7.203
  265   2HB   ALA  12          2HB       ALA  12  -3.211  -4.091  -7.528
  266   3HB   ALA  12          3HB       ALA  12  -2.229  -2.779  -8.180
  267    H    GLU  13           H        GLU  13  -4.716  -3.738  -5.164
  268    HA   GLU  13           HA       GLU  13  -6.694  -1.954  -6.349
  269   1HB   GLU  13          1HB       GLU  13  -6.816  -4.131  -4.229
  270   2HB   GLU  13          2HB       GLU  13  -8.231  -3.378  -4.964
  271   1HG   GLU  13          1HG       GLU  13  -7.614  -4.203  -7.154
  272   2HG   GLU  13          2HG       GLU  13  -6.070  -4.800  -6.542
  273    H    LYS  14           H        LYS  14  -5.054  -2.344  -3.234
  274    HA   LYS  14           HA       LYS  14  -6.693  -0.321  -1.874
  275   1HB   LYS  14          1HB       LYS  14  -4.026  -1.659  -1.255
  276   2HB   LYS  14          2HB       LYS  14  -4.953  -0.683  -0.112
  277   1HG   LYS  14          1HG       LYS  14  -5.968  -3.208  -1.447
  278   2HG   LYS  14          2HG       LYS  14  -5.339  -3.118   0.198
  279   1HD   LYS  14          1HD       LYS  14  -7.339  -2.433   0.960
  280   2HD   LYS  14          2HD       LYS  14  -7.313  -1.059  -0.145
  281   1HE   LYS  14          1HE       LYS  14  -7.932  -3.056  -1.891
  282   2HE   LYS  14          2HE       LYS  14  -8.712  -3.660  -0.415
  283   1HZ   LYS  14          1HZ       LYS  14  -9.650  -1.414  -0.098
  284   2HZ   LYS  14          2HZ       LYS  14  -9.024  -0.957  -1.610
  285   3HZ   LYS  14          3HZ       LYS  14 -10.213  -2.162  -1.515
  286    H    GLN  15           H        GLN  15  -3.648  -0.604  -3.550
  287    HA   GLN  15           HA       GLN  15  -2.599   2.029  -3.039
  288   1HB   GLN  15          1HB       GLN  15  -2.040  -0.418  -4.539
  289   2HB   GLN  15          2HB       GLN  15  -1.577   1.006  -5.453
  290   1HG   GLN  15          1HG       GLN  15   0.000   1.673  -3.873
  291   2HG   GLN  15          2HG       GLN  15  -0.832   0.841  -2.560
  292   1HE2  GLN  15          2HE2      GLN  15  -0.904  -1.674  -2.870
  293   2HE2  GLN  15          1HE2      GLN  15   0.519  -2.396  -3.447
  294    H    ALA  16           H        ALA  16  -4.238   0.569  -5.858
  295    HA   ALA  16           HA       ALA  16  -4.385   3.044  -7.353
  296   1HB   ALA  16          1HB       ALA  16  -4.566   0.614  -8.160
  297   2HB   ALA  16          2HB       ALA  16  -6.219   0.633  -7.544
  298   3HB   ALA  16          3HB       ALA  16  -5.748   1.731  -8.841
  299    H    GLN  17           H        GLN  17  -6.359   1.611  -4.819
  300    HA   GLN  17           HA       GLN  17  -8.648   3.391  -5.317
  301   1HB   GLN  17          1HB       GLN  17  -7.777   1.380  -3.243
  302   2HB   GLN  17          2HB       GLN  17  -9.138   2.447  -2.899
  303   1HG   GLN  17          1HG       GLN  17  -9.165   1.110  -5.553
  304   2HG   GLN  17          2HG       GLN  17  -9.425   0.069  -4.153
  305   1HE2  GLN  17          2HE2      GLN  17 -11.348   0.444  -2.842
  306   2HE2  GLN  17          1HE2      GLN  17 -12.619   1.425  -3.392
  307    H    TRP  18           H        TRP  18  -5.790   3.219  -3.304
  308    HA   TRP  18           HA       TRP  18  -6.380   5.593  -1.711
  309   1HB   TRP  18          1HB       TRP  18  -4.931   3.793  -0.892
  310   2HB   TRP  18          2HB       TRP  18  -3.905   3.939  -2.304
  311    HD1  TRP  18           HD1      TRP  18  -4.544   5.558   1.060
  312    HE1  TRP  18           HE1      TRP  18  -2.795   7.430   1.409
  313    HE3  TRP  18           HE3      TRP  18  -2.456   5.668  -3.530
  314    HZ2  TRP  18           HZ2      TRP  18  -0.760   8.773  -0.083
  315    HZ3  TRP  18           HZ3      TRP  18  -0.640   7.207  -4.059
  316    HH2  TRP  18           HH2      TRP  18   0.226   8.745  -2.368
  317    H    LYS  19           H        LYS  19  -4.235   4.758  -4.390
  318    HA   LYS  19           HA       LYS  19  -3.041   7.299  -4.825
  319   1HB   LYS  19          1HB       LYS  19  -3.642   4.881  -6.541
  320   2HB   LYS  19          2HB       LYS  19  -2.824   6.290  -7.200
  321   1HG   LYS  19          1HG       LYS  19  -1.151   6.081  -5.313
  322   2HG   LYS  19          2HG       LYS  19  -1.874   4.517  -4.951
  323   1HD   LYS  19          1HD       LYS  19  -1.511   4.181  -7.583
  324   2HD   LYS  19          2HD       LYS  19  -0.221   5.348  -7.290
  325   1HE   LYS  19          1HE       LYS  19   0.595   3.874  -5.410
  326   2HE   LYS  19          2HE       LYS  19  -0.593   2.660  -5.927
  327   1HZ   LYS  19          1HZ       LYS  19   0.346   2.850  -8.194
  328   2HZ   LYS  19          2HZ       LYS  19   1.577   3.843  -7.574
  329   3HZ   LYS  19          3HZ       LYS  19   1.455   2.230  -7.066
  330    H    ALA  20           H        ALA  20  -6.069   5.853  -5.893
  331    HA   ALA  20           HA       ALA  20  -6.795   7.809  -7.815
  332   1HB   ALA  20          1HB       ALA  20  -8.053   5.708  -6.186
  333   2HB   ALA  20          2HB       ALA  20  -9.152   6.991  -6.688
  334   3HB   ALA  20          3HB       ALA  20  -8.262   6.069  -7.900
  335    H    ALA  21           H        ALA  21  -6.953   7.776  -4.305
  336    HA   ALA  21           HA       ALA  21  -8.131  10.522  -4.377
  337   1HB   ALA  21          1HB       ALA  21  -9.233   8.305  -3.294
  338   2HB   ALA  21          2HB       ALA  21  -8.270   8.852  -1.922
  339   3HB   ALA  21          3HB       ALA  21  -9.494   9.913  -2.620
  340    H    ASN  22           H        ASN  22  -5.313   9.644  -4.489
  341    HA   ASN  22           HA       ASN  22  -4.294  11.457  -2.398
  342   1HB   ASN  22          1HB       ASN  22  -3.543   8.527  -2.579
  343   2HB   ASN  22          2HB       ASN  22  -2.671   9.716  -1.615
  344   1HD2  ASN  22          2HD2      ASN  22  -4.990   7.395  -1.330
  345   2HD2  ASN  22          1HD2      ASN  22  -5.866   8.008  -0.011
  346    HA   PRO  23           HA       PRO  23  -1.966  11.125  -6.491
  347   1HB   PRO  23          1HB       PRO  23  -2.788  13.515  -7.559
  348   2HB   PRO  23          2HB       PRO  23  -3.629  11.983  -7.872
  349   1HG   PRO  23          1HG       PRO  23  -4.318  14.167  -5.972
  350   2HG   PRO  23          2HG       PRO  23  -5.379  13.171  -6.982
  351   1HD   PRO  23          1HD       PRO  23  -5.007  12.737  -4.319
  352   2HD   PRO  23          2HD       PRO  23  -5.417  11.445  -5.459
  353    H    LEU  24           H        LEU  24  -2.776  13.593  -4.156
  354    HA   LEU  24           HA       LEU  24  -0.584  15.386  -4.446
  355   1HB   LEU  24          1HB       LEU  24  -1.381  16.211  -2.403
  356   2HB   LEU  24          2HB       LEU  24  -2.775  15.261  -2.904
  357    HG   LEU  24           HG       LEU  24  -0.579  14.114  -1.149
  358   1HD1  LEU  24          1HD1      LEU  24  -1.754  16.172  -0.184
  359   2HD1  LEU  24          2HD1      LEU  24  -3.223  15.196  -0.174
  360   3HD1  LEU  24          3HD1      LEU  24  -1.828  14.699   0.783
  361   1HD2  LEU  24          1HD2      LEU  24  -2.720  12.914  -2.487
  362   2HD2  LEU  24          2HD2      LEU  24  -1.844  12.220  -1.123
  363   3HD2  LEU  24          3HD2      LEU  24  -3.328  13.136  -0.850
  364    H    LEU  25           H        LEU  25  -0.877  12.258  -2.886
  365    HA   LEU  25           HA       LEU  25   1.987  12.289  -2.079
  366   1HB   LEU  25          1HB       LEU  25  -0.521  10.770  -1.397
  367   2HB   LEU  25          2HB       LEU  25   1.038   9.988  -1.117
  368    HG   LEU  25           HG       LEU  25   0.482  12.778  -0.110
  369   1HD1  LEU  25          1HD1      LEU  25  -0.091  10.132   1.257
  370   2HD1  LEU  25          2HD1      LEU  25  -0.041  11.687   2.089
  371   3HD1  LEU  25          3HD1      LEU  25  -1.263  11.387   0.852
  372   1HD2  LEU  25          1HD2      LEU  25   2.806  11.458  -0.279
  373   2HD2  LEU  25          2HD2      LEU  25   2.439  12.510   1.088
  374   3HD2  LEU  25          3HD2      LEU  25   2.231  10.765   1.237
  375    H    VAL  26           H        VAL  26   0.998  12.227  -4.790
  376    HA   VAL  26           HA       VAL  26   2.304   9.760  -5.764
  377    HB   VAL  26           HB       VAL  26  -0.561  10.387  -5.649
  378   1HG1  VAL  26          1HG1      VAL  26   0.712   9.867  -8.345
  379   2HG1  VAL  26          2HG1      VAL  26  -0.960   9.425  -7.997
  380   3HG1  VAL  26          3HG1      VAL  26  -0.459  11.114  -7.905
  381   1HG2  VAL  26          1HG2      VAL  26   1.083   7.969  -6.449
  382   2HG2  VAL  26          2HG2      VAL  26   0.416   8.311  -4.851
  383   3HG2  VAL  26          3HG2      VAL  26  -0.666   7.949  -6.198
  384    H    GLY  27           H        GLY  27   3.830  10.645  -7.104
  385   1HA   GLY  27          1HA       GLY  27   4.694  11.905  -8.920
  386   2HA   GLY  27          2HA       GLY  27   3.042  12.421  -9.283
  387    H    VAL  28           H        VAL  28   2.118  13.846  -7.338
  388    HA   VAL  28           HA       VAL  28   3.611  16.288  -7.230
  389    HB   VAL  28           HB       VAL  28   1.343  15.191  -5.537
  390   1HG1  VAL  28          1HG1      VAL  28   2.606  17.165  -4.556
  391   2HG1  VAL  28          2HG1      VAL  28   2.121  18.086  -5.980
  392   3HG1  VAL  28          3HG1      VAL  28   0.897  17.462  -4.875
  393   1HG2  VAL  28          1HG2      VAL  28   1.544  16.516  -8.206
  394   2HG2  VAL  28          2HG2      VAL  28   0.411  15.286  -7.646
  395   3HG2  VAL  28          3HG2      VAL  28   0.186  16.971  -7.176
  396    H    SER  29           H        SER  29   4.662  17.236  -5.336
  397    HA   SER  29           HA       SER  29   6.186  17.122  -3.527
  398   1HB   SER  29          1HB       SER  29   3.844  15.378  -2.884
  399   2HB   SER  29          2HB       SER  29   5.233  15.315  -1.803
  400    HG   SER  29           HG       SER  29   4.833  17.298  -1.171
  401    H    ALA  30           H        ALA  30   7.171  15.050  -2.028
  402    HA   ALA  30           HA       ALA  30   8.803  13.337  -2.138
  403   1HB   ALA  30          1HB       ALA  30   6.424  12.577  -3.734
  404   2HB   ALA  30          2HB       ALA  30   7.872  11.619  -4.047
  405   3HB   ALA  30          3HB       ALA  30   7.212  11.713  -2.414
  406    H    LYS  31           H        LYS  31  10.294  14.989  -3.128
  407    HA   LYS  31           HA       LYS  31  10.948  14.289  -5.969
  408   1HB   LYS  31          1HB       LYS  31  11.010  16.938  -4.482
  409   2HB   LYS  31          2HB       LYS  31  11.691  16.709  -6.092
  410   1HG   LYS  31          1HG       LYS  31   9.363  15.793  -6.744
  411   2HG   LYS  31          2HG       LYS  31   8.798  16.524  -5.242
  412   1HD   LYS  31          1HD       LYS  31  10.458  18.409  -6.665
  413   2HD   LYS  31          2HD       LYS  31   9.194  17.808  -7.737
  414   1HE   LYS  31          1HE       LYS  31   8.168  18.390  -5.053
  415   2HE   LYS  31          2HE       LYS  31   8.862  19.819  -5.844
  416   1HZ   LYS  31          1HZ       LYS  31   7.608  19.249  -7.851
  417   2HZ   LYS  31          2HZ       LYS  31   6.893  17.938  -7.040
  418   3HZ   LYS  31          3HZ       LYS  31   6.573  19.529  -6.536
  419    HA   PRO  32           HA       PRO  32  14.970  13.439  -4.476
  420   1HB   PRO  32          1HB       PRO  32  16.618  14.477  -6.409
  421   2HB   PRO  32          2HB       PRO  32  15.658  13.002  -6.642
  422   1HG   PRO  32          1HG       PRO  32  15.111  15.780  -7.564
  423   2HG   PRO  32          2HG       PRO  32  14.846  14.241  -8.399
  424   1HD   PRO  32          1HD       PRO  32  12.853  15.642  -7.191
  425   2HD   PRO  32          2HD       PRO  32  12.834  13.874  -7.363
  426    H    VAL  33           H        VAL  33  14.362  15.218  -2.786
  427    HA   VAL  33           HA       VAL  33  16.396  17.418  -2.952
  428    HB   VAL  33           HB       VAL  33  13.577  17.468  -1.820
  429   1HG1  VAL  33          1HG1      VAL  33  15.883  19.375  -1.734
  430   2HG1  VAL  33          2HG1      VAL  33  14.257  20.039  -1.896
  431   3HG1  VAL  33          3HG1      VAL  33  14.664  19.035  -0.504
  432   1HG2  VAL  33          1HG2      VAL  33  14.828  18.393  -4.389
  433   2HG2  VAL  33          2HG2      VAL  33  13.266  17.617  -4.127
  434   3HG2  VAL  33          3HG2      VAL  33  13.488  19.316  -3.707
  435    H    ASN  34           H        ASN  34  17.777  17.411  -1.212
  436    HA   ASN  34           HA       ASN  34  17.786  15.399   0.789
  437   1HB   ASN  34          1HB       ASN  34  19.653  16.920  -0.015
  438   2HB   ASN  34          2HB       ASN  34  18.946  18.193   0.980
  439   1HD2  ASN  34          2HD2      ASN  34  21.035  18.096   2.246
  440   2HD2  ASN  34          1HD2      ASN  34  21.224  16.887   3.422
  441    H    ARG  35           H        ARG  35  16.215  15.141   2.331
  442    HA   ARG  35           HA       ARG  35  14.248  16.959   3.148
  443   1HB   ARG  35          1HB       ARG  35  15.667  14.675   4.532
  444   2HB   ARG  35          2HB       ARG  35  14.283  15.489   5.260
  445   1HG   ARG  35          1HG       ARG  35  14.272  14.223   2.504
  446   2HG   ARG  35          2HG       ARG  35  13.634  13.456   3.958
  447   1HD   ARG  35          1HD       ARG  35  12.385  15.905   4.050
  448   2HD   ARG  35          2HD       ARG  35  12.448  15.592   2.305
  449    HE   ARG  35           HE       ARG  35  10.972  13.778   2.631
  450   1HH1  ARG  35          1HH1      ARG  35  12.457  14.733   5.619
  451   2HH1  ARG  35          2HH1      ARG  35  11.501  13.654   6.576
  452   1HH2  ARG  35          1HH2      ARG  35   9.735  12.379   3.883
  453   2HH2  ARG  35          2HH2      ARG  35   9.967  12.327   5.599
  454    HA   PRO  36           HA       PRO  36  17.074  19.753   5.310
  455   1HB   PRO  36          1HB       PRO  36  15.333  21.859   5.422
  456   2HB   PRO  36          2HB       PRO  36  16.296  21.479   3.980
  457   1HG   PRO  36          1HG       PRO  36  13.431  20.940   4.539
  458   2HG   PRO  36          2HG       PRO  36  14.228  21.365   3.016
  459   1HD   PRO  36          1HD       PRO  36  13.433  18.821   3.710
  460   2HD   PRO  36          2HD       PRO  36  14.695  19.196   2.517
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  13.047 -17.450   2.900
    2   2H5*    G   1          2H5*        G   1  12.883 -18.616   1.568
    3    H4*    G   1           H4*        G   1  10.934 -19.393   2.387
    4    H3*    G   1           H3*        G   1  10.161 -16.478   2.774
    5    H2*    G   1           H2*        G   1   8.390 -17.189   4.178
    6   2HO*    G   1          2HO*        G   1   7.382 -18.905   3.442
    7    H1*    G   1           H1*        G   1   9.853 -19.218   5.402
    8    H8     G   1           H8         G   1  12.008 -16.162   5.156
    9    H1     G   1           H1         G   1   7.429 -15.718   9.643
   10   1H2     G   1          1H2         G   1   5.837 -17.253   9.206
   11   2H2     G   1          2H2         G   1   6.332 -18.735   8.421
   12   1H5*    C   2          1H5*        C   2   6.403 -16.812   1.045
   13   2H5*    C   2          2H5*        C   2   7.398 -16.744   2.514
   14    H4*    C   2           H4*        C   2   4.741 -18.090   2.725
   15    H3*    C   2           H3*        C   2   5.112 -15.108   2.315
   16    H2*    C   2           H2*        C   2   3.563 -14.664   4.031
   17   2HO*    C   2          2HO*        C   2   2.139 -16.455   3.154
   18    H1*    C   2           H1*        C   2   4.282 -16.781   5.698
   19   1H4     C   2          1H4         C   2   7.122 -11.744   8.269
   20   2H4     C   2          2H4         C   2   8.390 -11.801   7.069
   21    H5     C   2           H5         C   2   8.146 -13.129   5.030
   22    H6     C   2           H6         C   2   7.149 -15.190   4.157
   23   1H5*    C   3          1H5*        C   3   0.036 -13.485   1.381
   24   2H5*    C   3          2H5*        C   3   1.570 -12.835   1.987
   25    H4*    C   3           H4*        C   3  -0.476 -14.340   3.647
   26    H3*    C   3           H3*        C   3   0.191 -11.408   3.350
   27    H2*    C   3           H2*        C   3  -0.076 -11.071   5.657
   28   2HO*    C   3          2HO*        C   3  -1.756 -12.023   6.482
   29    H1*    C   3           H1*        C   3   1.016 -13.497   6.470
   30   1H4     C   3          1H4         C   3   5.713  -9.270   7.177
   31   2H4     C   3          2H4         C   3   5.906  -9.133   5.443
   32    H5     C   3           H5         C   3   4.927 -10.930   4.047
   33    H6     C   3           H6         C   3   3.121 -12.528   3.858
   34   1H5*    C   4          1H5*        C   4  -3.765  -9.978   4.534
   35   2H5*    C   4          2H5*        C   4  -2.011 -10.220   4.641
   36    H4*    C   4           H4*        C   4  -3.744  -9.863   7.091
   37    H3*    C   4           H3*        C   4  -2.478  -7.759   5.313
   38    H2*    C   4           H2*        C   4  -1.788  -6.544   7.169
   39   2HO*    C   4          2HO*        C   4  -3.159  -6.353   8.739
   40    H1*    C   4           H1*        C   4  -1.189  -8.720   8.794
   41   1H4     C   4          1H4         C   4   3.986  -6.215   5.759
   42   2H4     C   4          2H4         C   4   4.411  -7.901   5.616
   43    H5     C   4           H5         C   4   2.034  -8.763   4.590
   44    H6     C   4           H6         C   4  -0.110  -9.327   5.433
   45   1H5*    U   5          1H5*        U   5  -4.887  -4.580   6.484
   46   2H5*    U   5          2H5*        U   5  -3.505  -5.677   6.531
   47    H4*    U   5           H4*        U   5  -3.966  -4.026   8.967
   48    H3*    U   5           H3*        U   5  -2.965  -2.896   6.322
   49    H2*    U   5           H2*        U   5  -1.356  -1.672   7.515
   50   2HO*    U   5          2HO*        U   5  -1.554  -1.649   9.921
   51    H1*    U   5           H1*        U   5  -0.969  -3.609   9.526
   52    H3     U   5           H3         U   5   2.881  -2.509   7.274
   53    H5     U   5           H5         U   5   1.112  -5.596   5.070
   54    H6     U   5           H6         U   5  -0.878  -5.253   6.369
   55   1H5*    G   6          1H5*        G   6  -2.396  -0.300   7.572
   56   2H5*    G   6          2H5*        G   6  -2.875   1.191   8.396
   57    H4*    G   6           H4*        G   6  -1.954   2.519   6.783
   58    H3*    G   6           H3*        G   6  -2.739   0.363   4.788
   59    H2*    G   6           H2*        G   6  -1.124   1.188   3.324
   60   2HO*    G   6          2HO*        G   6  -1.614   3.565   4.648
   61    H1*    G   6           H1*        G   6   0.719   1.965   5.312
   62    H8     G   6           H8         G   6  -1.025  -1.471   5.016
   63    H1     G   6           H1         G   6   4.886  -1.132   2.504
   64   1H2     G   6          1H2         G   6   5.523   1.022   2.390
   65   2H2     G   6          2H2         G   6   4.836   2.143   3.551
   66   1H5*    A   7          1H5*        A   7  -4.627   1.555   0.833
   67   2H5*    A   7          2H5*        A   7  -3.599   0.108   0.862
   68    H4*    A   7           H4*        A   7  -2.880   1.564  -0.941
   69    H3*    A   7           H3*        A   7  -1.005   1.595   1.451
   70    H2*    A   7           H2*        A   7   0.403   3.062   0.242
   71   2HO*    A   7          2HO*        A   7   0.632   2.954  -1.845
   72    H1*    A   7           H1*        A   7  -1.673   4.360  -1.112
   73    H8     A   7           H8         A   7  -2.561   4.460   2.478
   74   1H6     A   7          1H6         A   7   0.939   9.349   3.053
   75   2H6     A   7          2H6         A   7   0.763   7.935   4.069
   76    H2     A   7           H2         A   7   2.139   7.281  -0.869
   77   1H5*    A   8          1H5*        A   8   0.951   0.766  -1.576
   78   2H5*    A   8          2H5*        A   8   2.309  -0.359  -1.795
   79    H4*    A   8           H4*        A   8   3.153   1.866  -2.116
   80    H3*    A   8           H3*        A   8   3.833   0.699   0.600
   81    H2*    A   8           H2*        A   8   5.036   2.652   1.151
   82   2HO*    A   8          2HO*        A   8   5.964   3.899  -0.293
   83    H1*    A   8           H1*        A   8   3.275   4.430  -0.106
   84    H8     A   8           H8         A   8   1.196   1.963   1.744
   85   1H6     A   8          1H6         A   8   1.738   3.710   6.368
   86   2H6     A   8          2H6         A   8   1.996   5.396   6.753
   87    H2     A   8           H2         A   8   5.148   6.632   3.720
   88   1H5*    A   9          2H5*        A   9   8.371  -0.468  -2.413
   89   2H5*    A   9          1H5*        A   9   7.356   0.324  -1.190
   90    H4*    A   9           H4*        A   9   9.409   1.506  -2.679
   91    H3*    A   9           H3*        A   9   7.110   2.651  -1.071
   92    H2*    A   9           H2*        A   9   7.775   4.819  -1.761
   93   2HO*    A   9          2HO*        A   9   9.769   5.303  -2.203
   94    H1*    A   9           H1*        A   9   8.424   4.063  -4.371
   95    H8     A   9           H8         A   9   6.005   5.143  -1.908
   96   1H6     A   9          1H6         A   9   1.949   5.854  -6.103
   97   2H6     A   9          2H6         A   9   1.601   4.806  -4.746
   98    H2     A   9           H2         A   9   5.086   2.785  -7.804
   99   1H5*    A  10          1H5*        A  10   9.909   1.109   3.839
  100   2H5*    A  10          2H5*        A  10   8.265   1.535   3.320
  101    H4*    A  10           H4*        A  10  10.218   3.773   3.514
  102    H3*    A  10           H3*        A  10   9.206   2.201   5.885
  103    H2*    A  10           H2*        A  10   8.698   4.175   7.053
  104   2HO*    A  10          2HO*        A  10   9.587   6.119   6.604
  105    H1*    A  10           H1*        A  10   7.797   5.648   4.866
  106    H8     A  10           H8         A  10   6.097   2.667   4.025
  107   1H6     A  10          1H6         A  10   2.403   3.132   8.975
  108   2H6     A  10          2H6         A  10   2.469   2.602   7.310
  109    H2     A  10           H2         A  10   5.821   5.999   9.507
  110   1H5*    A  11          1H5*        A  11  10.237   5.040   8.920
  111   2H5*    A  11          2H5*        A  11  11.087   3.842   9.922
  112    H4*    A  11           H4*        A  11   8.698   4.596  10.630
  113    H3*    A  11           H3*        A  11   9.596   1.712  10.416
  114    H2*    A  11           H2*        A  11   7.438   0.986  11.027
  115   2HO*    A  11          2HO*        A  11   6.831   3.652  11.786
  116    H1*    A  11           H1*        A  11   6.019   2.964   9.697
  117    H8     A  11           H8         A  11   8.846   1.499   7.604
  118   1H6     A  11          1H6         A  11   5.181  -3.117   6.214
  119   2H6     A  11          2H6         A  11   5.828  -1.874   5.171
  120    H2     A  11           H2         A  11   2.922  -0.422   9.171
  121   1H5*    G  12          1H5*        G  12   9.372  -1.308  13.505
  122   2H5*    G  12          2H5*        G  12   9.209  -0.429  11.972
  123    H4*    G  12           H4*        G  12   7.002   0.171  13.774
  124    H3*    G  12           H3*        G  12   7.553  -2.721  13.059
  125    H2*    G  12           H2*        G  12   5.247  -3.037  12.668
  126   2HO*    G  12          2HO*        G  12   4.296  -0.576  13.300
  127    H1*    G  12           H1*        G  12   4.843  -0.542  11.470
  128    H8     G  12           H8         G  12   7.856  -1.464   9.757
  129    H1     G  12           H1         G  12   3.099  -5.503   8.228
  130   1H2     G  12          1H2         G  12   1.311  -5.036   9.518
  131   2H2     G  12          2H2         G  12   1.638  -4.487  11.147
  132   1H5*    G  13          1H5*        G  13   5.344  -4.252  16.784
  133   2H5*    G  13          2H5*        G  13   5.747  -4.116  15.067
  134    H4*    G  13           H4*        G  13   2.928  -4.503  16.099
  135    H3*    G  13           H3*        G  13   5.012  -6.532  15.295
  136    H2*    G  13           H2*        G  13   3.376  -7.770  14.146
  137   2HO*    G  13          2HO*        G  13   1.089  -6.589  14.558
  138    H1*    G  13           H1*        G  13   1.933  -5.607  13.176
  139    H8     G  13           H8         G  13   5.494  -4.733  12.718
  140    H1     G  13           H1         G  13   3.484  -9.125   8.486
  141   1H2     G  13          1H2         G  13   1.430  -9.783   9.011
  142   2H2     G  13          2H2         G  13   0.854  -9.603  10.653
  143   1H5*    G  14          1H5*        G  14   1.839  -8.377  16.871
  144   2H5*    G  14          2H5*        G  14   2.049  -9.638  18.108
  145    H4*    G  14           H4*        G  14   0.683 -10.579  16.365
  146    H3*    G  14           H3*        G  14   3.563 -11.506  16.133
  147    H2*    G  14           H2*        G  14   2.882 -12.887  14.328
  148   2HO*    G  14          2HO*        G  14   0.233 -12.370  14.248
  149    H1*    G  14           H1*        G  14   1.115 -11.027  13.232
  150    H8     G  14           H8         G  14   4.177  -9.119  14.141
  151    H1     G  14           H1         G  14   4.959 -12.810   8.920
  152   1H2     G  14          1H2         G  14   3.409 -14.512   9.058
  153   2H2     G  14          2H2         G  14   1.828 -13.936   9.533
  154   1H5*    C  15          1H5*        C  15   1.151 -14.610  15.893
  155   2H5*    C  15          2H5*        C  15   1.463 -15.993  16.968
  156    H4*    C  15           H4*        C  15   1.215 -16.861  14.734
  157    H3*    C  15           H3*        C  15   4.116 -16.714  15.611
  158    H2*    C  15           H2*        C  15   4.728 -17.702  13.559
  159   2HO*    C  15          2HO*        C  15   2.198 -18.805  13.747
  160    H1*    C  15           H1*        C  15   2.673 -16.493  12.053
  161   1H4     C  15          1H4         C  15   8.078 -13.610  10.423
  162   2H4     C  15          2H4         C  15   8.208 -12.853  11.998
  163    H5     C  15           H5         C  15   6.339 -12.948  13.588
  164    H6     C  15           H6         C  15   4.305 -14.109  14.174
  165   2H    ASP   2          2H        ASP   2  10.343 -10.644  -2.036
  166   1H    ASP   2          1H        ASP   2   9.992 -12.308  -1.989
  167   3H    ASP   2          3H        ASP   2  11.524 -11.752  -1.517
  168    HA   ASP   2           HA       ASP   2  10.589 -12.030   0.548
  169   1HB   ASP   2          1HB       ASP   2   9.499  -9.317  -0.234
  170   2HB   ASP   2          2HB       ASP   2  10.135  -9.812   1.332
  171    H    ALA   3           H        ALA   3   8.371 -10.855   1.728
  172    HA   ALA   3           HA       ALA   3   6.108 -12.309   0.403
  173   1HB   ALA   3          1HB       ALA   3   6.813 -11.760   3.298
  174   2HB   ALA   3          2HB       ALA   3   5.278 -12.469   2.796
  175   3HB   ALA   3          3HB       ALA   3   6.788 -13.326   2.487
  176    H    GLN   4           H        GLN   4   6.891  -9.458   2.398
  177    HA   GLN   4           HA       GLN   4   4.283  -8.255   2.140
  178   1HB   GLN   4          1HB       GLN   4   6.138  -7.775   3.838
  179   2HB   GLN   4          2HB       GLN   4   6.949  -6.873   2.559
  180   1HG   GLN   4          1HG       GLN   4   4.729  -5.591   2.299
  181   2HG   GLN   4          2HG       GLN   4   4.291  -6.281   3.862
  182   1HE2  GLN   4          2HE2      GLN   4   5.542  -3.512   2.590
  183   2HE2  GLN   4          1HE2      GLN   4   6.545  -3.025   3.870
  184    H    THR   5           H        THR   5   7.384  -7.557   0.520
  185    HA   THR   5           HA       THR   5   6.491  -5.648  -1.360
  186    HB   THR   5           HB       THR   5   8.452  -7.953  -1.688
  187    HG1  THR   5           HG1      THR   5   9.792  -6.739  -0.610
  188   1HG2  THR   5          1HG2      THR   5   7.859  -5.496  -3.306
  189   2HG2  THR   5          2HG2      THR   5   9.491  -6.167  -3.286
  190   3HG2  THR   5          3HG2      THR   5   8.141  -7.148  -3.858
  191    H    ARG   6           H        ARG   6   6.130  -9.141  -1.251
  192    HA   ARG   6           HA       ARG   6   4.929  -9.463  -3.886
  193   1HB   ARG   6          1HB       ARG   6   5.676 -11.021  -1.552
  194   2HB   ARG   6          2HB       ARG   6   4.045 -11.454  -2.079
  195   1HG   ARG   6          1HG       ARG   6   5.373 -11.331  -4.478
  196   2HG   ARG   6          2HG       ARG   6   6.648 -11.925  -3.411
  197   1HD   ARG   6          1HD       ARG   6   3.922 -13.178  -3.222
  198   2HD   ARG   6          2HD       ARG   6   5.000 -13.649  -4.551
  199    HE   ARG   6           HE       ARG   6   6.360 -13.587  -1.974
  200   1HH1  ARG   6          1HH1      ARG   6   4.377 -15.456  -4.127
  201   2HH1  ARG   6          2HH1      ARG   6   4.909 -16.972  -3.486
  202   1HH2  ARG   6          1HH2      ARG   6   7.042 -15.565  -1.150
  203   2HH2  ARG   6          2HH2      ARG   6   6.409 -17.035  -1.810
  204    H    ARG   7           H        ARG   7   3.779  -9.271  -0.532
  205    HA   ARG   7           HA       ARG   7   1.014  -9.525  -1.046
  206   1HB   ARG   7          1HB       ARG   7   1.888  -9.663   1.182
  207   2HB   ARG   7          2HB       ARG   7   2.652  -8.080   1.050
  208   1HG   ARG   7          1HG       ARG   7   0.261  -7.148   0.735
  209   2HG   ARG   7          2HG       ARG   7  -0.287  -8.713   1.335
  210   1HD   ARG   7          1HD       ARG   7   0.663  -8.373   3.452
  211   2HD   ARG   7          2HD       ARG   7   1.788  -7.140   2.860
  212    HE   ARG   7           HE       ARG   7   0.053  -5.547   3.069
  213   1HH1  ARG   7          1HH1      ARG   7  -1.196  -8.787   3.065
  214   2HH1  ARG   7          2HH1      ARG   7  -2.814  -8.289   3.418
  215   1HH2  ARG   7          1HH2      ARG   7  -2.057  -4.913   3.528
  216   2HH2  ARG   7          2HH2      ARG   7  -3.300  -6.109   3.679
  217    H    ARG   8           H        ARG   8   3.186  -6.763  -1.265
  218    HA   ARG   8           HA       ARG   8   1.343  -4.622  -1.459
  219   1HB   ARG   8          1HB       ARG   8   4.043  -4.974  -1.606
  220   2HB   ARG   8          2HB       ARG   8   3.686  -4.686  -3.307
  221   1HG   ARG   8          1HG       ARG   8   4.100  -2.532  -2.400
  222   2HG   ARG   8          2HG       ARG   8   2.345  -2.645  -2.510
  223   1HD   ARG   8          1HD       ARG   8   3.113  -1.738  -0.298
  224   2HD   ARG   8          2HD       ARG   8   2.211  -3.257  -0.127
  225    HE   ARG   8           HE       ARG   8   4.210  -4.296   0.581
  226   1HH1  ARG   8          1HH1      ARG   8   4.884  -1.364  -1.135
  227   2HH1  ARG   8          2HH1      ARG   8   6.586  -1.438  -0.835
  228   1HH2  ARG   8          1HH2      ARG   8   6.420  -4.387   0.968
  229   2HH2  ARG   8          2HH2      ARG   8   7.453  -3.142   0.350
  230    H    GLU   9           H        GLU   9   2.385  -6.995  -3.868
  231    HA   GLU   9           HA       GLU   9   0.999  -5.796  -6.095
  232   1HB   GLU   9          1HB       GLU   9   1.717  -8.678  -5.427
  233   2HB   GLU   9          2HB       GLU   9   1.203  -8.128  -7.022
  234   1HG   GLU   9          1HG       GLU   9   3.355  -6.462  -6.011
  235   2HG   GLU   9          2HG       GLU   9   3.831  -8.161  -6.018
  236    H    ARG  10           H        ARG  10   0.134  -7.905  -3.456
  237    HA   ARG  10           HA       ARG  10  -2.584  -8.431  -4.358
  238   1HB   ARG  10          1HB       ARG  10  -0.756  -9.109  -2.185
  239   2HB   ARG  10          2HB       ARG  10  -2.366  -8.747  -1.569
  240   1HG   ARG  10          1HG       ARG  10  -3.364 -10.479  -2.809
  241   2HG   ARG  10          2HG       ARG  10  -2.008 -10.576  -3.934
  242   1HD   ARG  10          1HD       ARG  10  -0.728 -11.858  -2.494
  243   2HD   ARG  10          2HD       ARG  10  -1.443 -11.125  -1.045
  244    HE   ARG  10           HE       ARG  10  -3.530 -12.487  -2.374
  245   1HH1  ARG  10          1HH1      ARG  10  -0.500 -13.192  -0.836
  246   2HH1  ARG  10          2HH1      ARG  10  -0.983 -14.778  -0.340
  247   1HH2  ARG  10          1HH2      ARG  10  -4.150 -14.552  -1.725
  248   2HH2  ARG  10          2HH2      ARG  10  -3.041 -15.546  -0.840
  249    H    ARG  11           H        ARG  11  -0.895  -5.808  -2.884
  250    HA   ARG  11           HA       ARG  11  -3.360  -4.683  -1.678
  251   1HB   ARG  11          1HB       ARG  11  -0.470  -3.772  -1.816
  252   2HB   ARG  11          2HB       ARG  11  -1.750  -2.913  -0.960
  253   1HG   ARG  11          1HG       ARG  11  -0.806  -5.742  -0.389
  254   2HG   ARG  11          2HG       ARG  11  -0.489  -4.332   0.610
  255   1HD   ARG  11          1HD       ARG  11  -2.505  -4.552   1.640
  256   2HD   ARG  11          2HD       ARG  11  -3.346  -4.609   0.085
  257    HE   ARG  11           HE       ARG  11  -1.926  -7.068   0.476
  258   1HH1  ARG  11          1HH1      ARG  11  -4.687  -5.293   1.610
  259   2HH1  ARG  11          2HH1      ARG  11  -5.569  -6.717   2.045
  260   1HH2  ARG  11          1HH2      ARG  11  -3.083  -8.909   1.047
  261   2HH2  ARG  11          2HH2      ARG  11  -4.667  -8.753   1.728
  262    H    ALA  12           H        ALA  12  -2.117  -4.837  -4.758
  263    HA   ALA  12           HA       ALA  12  -2.119  -2.144  -5.712
  264   1HB   ALA  12          1HB       ALA  12  -1.545  -4.298  -6.944
  265   2HB   ALA  12          2HB       ALA  12  -3.276  -4.610  -7.078
  266   3HB   ALA  12          3HB       ALA  12  -2.570  -3.198  -7.866
  267    H    GLU  13           H        GLU  13  -4.704  -4.261  -4.669
  268    HA   GLU  13           HA       GLU  13  -6.878  -2.651  -5.761
  269   1HB   GLU  13          1HB       GLU  13  -6.563  -4.926  -3.795
  270   2HB   GLU  13          2HB       GLU  13  -8.127  -4.139  -4.010
  271   1HG   GLU  13          1HG       GLU  13  -7.538  -4.527  -6.590
  272   2HG   GLU  13          2HG       GLU  13  -6.587  -5.849  -5.912
  273    H    LYS  14           H        LYS  14  -5.020  -2.858  -2.753
  274    HA   LYS  14           HA       LYS  14  -6.724  -0.945  -1.316
  275   1HB   LYS  14          1HB       LYS  14  -3.906  -2.022  -0.856
  276   2HB   LYS  14          2HB       LYS  14  -4.865  -1.144   0.339
  277   1HG   LYS  14          1HG       LYS  14  -5.731  -3.745  -0.948
  278   2HG   LYS  14          2HG       LYS  14  -4.942  -3.634   0.627
  279   1HD   LYS  14          1HD       LYS  14  -6.804  -2.015   1.291
  280   2HD   LYS  14          2HD       LYS  14  -7.637  -2.521  -0.180
  281   1HE   LYS  14          1HE       LYS  14  -6.879  -4.938   0.981
  282   2HE   LYS  14          2HE       LYS  14  -7.372  -3.942   2.365
  283   1HZ   LYS  14          1HZ       LYS  14  -8.934  -4.134  -0.150
  284   2HZ   LYS  14          2HZ       LYS  14  -9.241  -5.105   1.205
  285   3HZ   LYS  14          3HZ       LYS  14  -9.416  -3.418   1.314
  286    H    GLN  15           H        GLN  15  -3.751  -1.015  -3.147
  287    HA   GLN  15           HA       GLN  15  -2.924   1.715  -2.759
  288   1HB   GLN  15          1HB       GLN  15  -2.208  -0.725  -4.203
  289   2HB   GLN  15          2HB       GLN  15  -1.914   0.700  -5.185
  290   1HG   GLN  15          1HG       GLN  15  -0.330   1.554  -3.708
  291   2HG   GLN  15          2HG       GLN  15  -1.041   0.723  -2.325
  292   1HE2  GLN  15          2HE2      GLN  15  -0.933  -1.810  -2.550
  293   2HE2  GLN  15          1HE2      GLN  15   0.529  -2.440  -3.141
  294    H    ALA  16           H        ALA  16  -4.541   0.019  -5.458
  295    HA   ALA  16           HA       ALA  16  -4.960   2.396  -7.040
  296   1HB   ALA  16          1HB       ALA  16  -5.025  -0.017  -7.795
  297   2HB   ALA  16          2HB       ALA  16  -6.569  -0.185  -6.959
  298   3HB   ALA  16          3HB       ALA  16  -6.422   0.919  -8.325
  299    H    GLN  17           H        GLN  17  -6.668   0.977  -4.318
  300    HA   GLN  17           HA       GLN  17  -9.102   2.575  -4.733
  301   1HB   GLN  17          1HB       GLN  17  -7.944   0.735  -2.638
  302   2HB   GLN  17          2HB       GLN  17  -9.353   1.717  -2.247
  303   1HG   GLN  17          1HG       GLN  17 -10.626   0.733  -4.039
  304   2HG   GLN  17          2HG       GLN  17  -9.205  -0.102  -4.662
  305   1HE2  GLN  17          2HE2      GLN  17 -10.811  -2.035  -4.285
  306   2HE2  GLN  17          1HE2      GLN  17 -10.760  -2.766  -2.754
  307    H    TRP  18           H        TRP  18  -6.150   2.666  -2.847
  308    HA   TRP  18           HA       TRP  18  -6.808   5.092  -1.363
  309   1HB   TRP  18          1HB       TRP  18  -5.241   3.411  -0.512
  310   2HB   TRP  18          2HB       TRP  18  -4.271   3.540  -1.963
  311    HD1  TRP  18           HD1      TRP  18  -4.884   5.293   1.340
  312    HE1  TRP  18           HE1      TRP  18  -3.228   7.268   1.529
  313    HE3  TRP  18           HE3      TRP  18  -2.971   5.275  -3.321
  314    HZ2  TRP  18           HZ2      TRP  18  -1.320   8.634  -0.105
  315    HZ3  TRP  18           HZ3      TRP  18  -1.264   6.871  -4.001
  316    HH2  TRP  18           HH2      TRP  18  -0.419   8.543  -2.425
  317    H    LYS  19           H        LYS  19  -4.748   4.219  -4.088
  318    HA   LYS  19           HA       LYS  19  -3.660   6.771  -4.689
  319   1HB   LYS  19          1HB       LYS  19  -4.282   4.286  -6.309
  320   2HB   LYS  19          2HB       LYS  19  -3.462   5.676  -7.004
  321   1HG   LYS  19          1HG       LYS  19  -1.673   5.496  -5.336
  322   2HG   LYS  19          2HG       LYS  19  -2.492   4.125  -4.592
  323   1HD   LYS  19          1HD       LYS  19  -2.242   2.810  -6.621
  324   2HD   LYS  19          2HD       LYS  19  -1.550   4.192  -7.471
  325   1HE   LYS  19          1HE       LYS  19   0.122   4.093  -5.334
  326   2HE   LYS  19          2HE       LYS  19  -0.283   2.372  -5.496
  327   1HZ   LYS  19          1HZ       LYS  19   0.194   2.528  -7.868
  328   2HZ   LYS  19          2HZ       LYS  19   0.631   4.157  -7.690
  329   3HZ   LYS  19          3HZ       LYS  19   1.560   2.943  -6.948
  330    H    ALA  20           H        ALA  20  -6.677   5.175  -5.577
  331    HA   ALA  20           HA       ALA  20  -7.541   7.034  -7.538
  332   1HB   ALA  20          1HB       ALA  20  -8.659   4.946  -5.798
  333   2HB   ALA  20          2HB       ALA  20  -9.825   6.174  -6.290
  334   3HB   ALA  20          3HB       ALA  20  -8.952   5.249  -7.511
  335    H    ALA  21           H        ALA  21  -7.559   7.136  -4.027
  336    HA   ALA  21           HA       ALA  21  -8.864   9.821  -4.150
  337   1HB   ALA  21          1HB       ALA  21  -9.194   7.423  -2.465
  338   2HB   ALA  21          2HB       ALA  21  -9.155   8.940  -1.567
  339   3HB   ALA  21          3HB       ALA  21 -10.359   8.696  -2.833
  340    H    ASN  22           H        ASN  22  -6.001   9.054  -4.340
  341    HA   ASN  22           HA       ASN  22  -4.988  11.027  -2.399
  342   1HB   ASN  22          1HB       ASN  22  -4.111   8.125  -2.413
  343   2HB   ASN  22          2HB       ASN  22  -3.288   9.413  -1.536
  344   1HD2  ASN  22          2HD2      ASN  22  -5.533   7.010  -1.128
  345   2HD2  ASN  22          1HD2      ASN  22  -6.393   7.641   0.193
  346    HA   PRO  23           HA       PRO  23  -2.755  10.504  -6.523
  347   1HB   PRO  23          1HB       PRO  23  -3.674  12.797  -7.716
  348   2HB   PRO  23          2HB       PRO  23  -4.478  11.225  -7.908
  349   1HG   PRO  23          1HG       PRO  23  -5.180  13.506  -6.130
  350   2HG   PRO  23          2HG       PRO  23  -6.238  12.418  -7.045
  351   1HD   PRO  23          1HD       PRO  23  -5.780  12.164  -4.372
  352   2HD   PRO  23          2HD       PRO  23  -6.184  10.791  -5.417
  353    H    LEU  24           H        LEU  24  -3.578  13.114  -4.346
  354    HA   LEU  24           HA       LEU  24  -1.433  14.929  -4.819
  355   1HB   LEU  24          1HB       LEU  24  -2.200  15.883  -2.820
  356   2HB   LEU  24          2HB       LEU  24  -3.585  14.874  -3.221
  357    HG   LEU  24           HG       LEU  24  -1.329  13.910  -1.433
  358   1HD1  LEU  24          1HD1      LEU  24  -3.908  15.322  -0.721
  359   2HD1  LEU  24          2HD1      LEU  24  -2.953  14.397   0.437
  360   3HD1  LEU  24          3HD1      LEU  24  -2.265  15.828  -0.330
  361   1HD2  LEU  24          1HD2      LEU  24  -3.449  12.552  -2.653
  362   2HD2  LEU  24          2HD2      LEU  24  -2.527  11.981  -1.266
  363   3HD2  LEU  24          3HD2      LEU  24  -4.036  12.862  -1.022
  364    H    LEU  25           H        LEU  25  -1.597  11.879  -3.101
  365    HA   LEU  25           HA       LEU  25   1.280  12.065  -2.353
  366   1HB   LEU  25          1HB       LEU  25  -1.166  10.576  -1.452
  367   2HB   LEU  25          2HB       LEU  25   0.400   9.792  -1.217
  368    HG   LEU  25           HG       LEU  25   0.129  12.653  -0.389
  369   1HD1  LEU  25          1HD1      LEU  25  -1.886  11.252   0.456
  370   2HD1  LEU  25          2HD1      LEU  25  -0.702  10.425   1.468
  371   3HD1  LEU  25          3HD1      LEU  25  -0.957  12.161   1.648
  372   1HD2  LEU  25          1HD2      LEU  25   1.974  10.462  -0.075
  373   2HD2  LEU  25          2HD2      LEU  25   2.171  12.142   0.421
  374   3HD2  LEU  25          3HD2      LEU  25   1.423  10.981   1.517
  375    H    VAL  26           H        VAL  26   0.170  11.745  -5.019
  376    HA   VAL  26           HA       VAL  26   1.556   9.261  -5.845
  377    HB   VAL  26           HB       VAL  26  -1.321   9.764  -5.658
  378   1HG1  VAL  26          1HG1      VAL  26  -0.174   9.149  -8.396
  379   2HG1  VAL  26          2HG1      VAL  26  -1.834   8.761  -7.938
  380   3HG1  VAL  26          3HG1      VAL  26  -1.292  10.441  -7.952
  381   1HG2  VAL  26          1HG2      VAL  26   0.046   7.740  -4.950
  382   2HG2  VAL  26          2HG2      VAL  26  -1.422   7.378  -5.859
  383   3HG2  VAL  26          3HG2      VAL  26   0.151   7.312  -6.660
  384    H    GLY  27           H        GLY  27   2.897   9.912  -7.521
  385   1HA   GLY  27          1HA       GLY  27   3.574  11.053  -9.489
  386   2HA   GLY  27          2HA       GLY  27   1.921  11.661  -9.646
  387    H    VAL  28           H        VAL  28   1.379  13.152  -7.580
  388    HA   VAL  28           HA       VAL  28   2.722  15.608  -7.768
  389    HB   VAL  28           HB       VAL  28   1.076  14.187  -5.689
  390   1HG1  VAL  28          1HG1      VAL  28   2.203  16.994  -5.424
  391   2HG1  VAL  28          2HG1      VAL  28   0.983  16.281  -4.368
  392   3HG1  VAL  28          3HG1      VAL  28   2.619  15.618  -4.400
  393   1HG2  VAL  28          1HG2      VAL  28   0.727  16.364  -7.717
  394   2HG2  VAL  28          2HG2      VAL  28  -0.305  14.975  -7.381
  395   3HG2  VAL  28          3HG2      VAL  28  -0.311  16.363  -6.293
  396    H    SER  29           H        SER  29   4.084  16.603  -5.899
  397    HA   SER  29           HA       SER  29   6.335  14.802  -5.353
  398   1HB   SER  29          1HB       SER  29   5.694  17.720  -5.069
  399   2HB   SER  29          2HB       SER  29   7.074  17.065  -4.193
  400    HG   SER  29           HG       SER  29   6.742  17.553  -6.865
  401    H    ALA  30           H        ALA  30   3.985  13.962  -4.060
  402    HA   ALA  30           HA       ALA  30   2.944  13.736  -1.898
  403   1HB   ALA  30          1HB       ALA  30   5.870  12.978  -1.623
  404   2HB   ALA  30          2HB       ALA  30   4.570  12.393  -0.583
  405   3HB   ALA  30          3HB       ALA  30   4.595  11.957  -2.294
  406    H    LYS  31           H        LYS  31   3.377  16.430  -2.082
  407    HA   LYS  31           HA       LYS  31   4.636  17.138   0.546
  408   1HB   LYS  31          1HB       LYS  31   5.026  19.374  -0.643
  409   2HB   LYS  31          2HB       LYS  31   5.974  18.012  -1.233
  410   1HG   LYS  31          1HG       LYS  31   4.878  17.946  -3.247
  411   2HG   LYS  31          2HG       LYS  31   3.332  18.410  -2.538
  412   1HD   LYS  31          1HD       LYS  31   5.530  20.439  -2.558
  413   2HD   LYS  31          2HD       LYS  31   4.696  20.101  -4.075
  414   1HE   LYS  31          1HE       LYS  31   3.123  20.643  -1.554
  415   2HE   LYS  31          2HE       LYS  31   3.707  21.975  -2.573
  416   1HZ   LYS  31          1HZ       LYS  31   2.734  20.779  -4.500
  417   2HZ   LYS  31          2HZ       LYS  31   2.023  19.680  -3.423
  418   3HZ   LYS  31          3HZ       LYS  31   1.573  21.318  -3.384
  419    HA   PRO  32           HA       PRO  32   0.432  18.477   1.310
  420   1HB   PRO  32          1HB       PRO  32   0.822  19.218   3.911
  421   2HB   PRO  32          2HB       PRO  32   0.635  17.525   3.411
  422   1HG   PRO  32          1HG       PRO  32   3.096  19.031   4.111
  423   2HG   PRO  32          2HG       PRO  32   2.680  17.338   4.415
  424   1HD   PRO  32          1HD       PRO  32   4.358  18.198   2.410
  425   2HD   PRO  32          2HD       PRO  32   3.477  16.656   2.395
  426    H    VAL  33           H        VAL  33  -0.230  20.634   2.838
  427    HA   VAL  33           HA       VAL  33   0.624  22.893   1.236
  428    HB   VAL  33           HB       VAL  33  -0.855  24.121   2.815
  429   1HG1  VAL  33          1HG1      VAL  33  -1.596  22.306   0.965
  430   2HG1  VAL  33          2HG1      VAL  33  -2.321  21.569   2.393
  431   3HG1  VAL  33          3HG1      VAL  33  -2.763  23.211   1.927
  432   1HG2  VAL  33          1HG2      VAL  33  -0.039  22.615   4.784
  433   2HG2  VAL  33          2HG2      VAL  33  -1.722  23.140   4.774
  434   3HG2  VAL  33          3HG2      VAL  33  -1.305  21.507   4.252
  435    H    ASN  34           H        ASN  34   1.305  24.980   2.555
  436    HA   ASN  34           HA       ASN  34   3.333  24.292   4.642
  437   1HB   ASN  34          1HB       ASN  34   4.944  25.738   3.399
  438   2HB   ASN  34          2HB       ASN  34   4.439  24.341   2.450
  439   1HD2  ASN  34          2HD2      ASN  34   2.627  24.762   0.829
  440   2HD2  ASN  34          1HD2      ASN  34   2.522  26.302   0.125
  441    H    ARG  35           H        ARG  35   1.190  25.327   5.668
  442    HA   ARG  35           HA       ARG  35   1.702  28.272   5.912
  443   1HB   ARG  35          1HB       ARG  35  -0.883  26.730   5.570
  444   2HB   ARG  35          2HB       ARG  35  -0.846  28.399   6.137
  445   1HG   ARG  35          1HG       ARG  35  -0.129  29.225   4.097
  446   2HG   ARG  35          2HG       ARG  35   0.676  27.720   3.654
  447   1HD   ARG  35          1HD       ARG  35  -1.217  26.844   2.715
  448   2HD   ARG  35          2HD       ARG  35  -2.266  27.517   3.979
  449    HE   ARG  35           HE       ARG  35  -1.592  28.826   1.474
  450   1HH1  ARG  35          1HH1      ARG  35  -2.301  29.312   4.838
  451   2HH1  ARG  35          2HH1      ARG  35  -2.894  30.920   4.601
  452   1HH2  ARG  35          1HH2      ARG  35  -2.366  30.918   1.179
  453   2HH2  ARG  35          2HH2      ARG  35  -2.932  31.825   2.542
  454    HA   PRO  36           HA       PRO  36   1.391  25.927   9.987
  455   1HB   PRO  36          1HB       PRO  36   3.971  26.288  10.825
  456   2HB   PRO  36          2HB       PRO  36   3.455  24.889   9.864
  457   1HG   PRO  36          1HG       PRO  36   4.874  27.356   9.003
  458   2HG   PRO  36          2HG       PRO  36   5.085  25.684   8.463
  459   1HD   PRO  36          1HD       PRO  36   3.712  27.578   7.049
  460   2HD   PRO  36          2HD       PRO  36   3.404  25.832   6.926
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  12.205 -13.303   2.533
    2   2H5*    G   1          2H5*        G   1  13.237 -14.503   1.722
    3    H4*    G   1           H4*        G   1  11.887 -16.294   2.372
    4    H3*    G   1           H3*        G   1   9.671 -14.250   2.714
    5    H2*    G   1           H2*        G   1   8.722 -15.548   4.447
    6   2HO*    G   1          2HO*        G   1   9.933 -17.741   4.735
    7    H1*    G   1           H1*        G   1  11.115 -16.427   5.554
    8    H8     G   1           H8         G   1  11.337 -12.758   4.772
    9    H1     G   1           H1         G   1   7.865 -14.073  10.016
   10   1H2     G   1          1H2         G   1   7.603 -16.259  10.219
   11   2H2     G   1          2H2         G   1   7.970 -17.346   8.898
   12   1H5*    C   2          1H5*        C   2   6.914 -18.496   2.443
   13   2H5*    C   2          2H5*        C   2   6.073 -17.689   1.100
   14    H4*    C   2           H4*        C   2   4.561 -18.490   2.959
   15    H3*    C   2           H3*        C   2   4.688 -15.526   2.298
   16    H2*    C   2           H2*        C   2   3.071 -15.114   3.956
   17   2HO*    C   2          2HO*        C   2   2.555 -17.910   3.945
   18    H1*    C   2           H1*        C   2   3.951 -17.092   5.745
   19   1H4     C   2          1H4         C   2   6.057 -11.677   8.255
   20   2H4     C   2          2H4         C   2   7.244 -11.491   6.990
   21    H5     C   2           H5         C   2   7.103 -12.795   4.923
   22    H6     C   2           H6         C   2   6.503 -15.038   4.104
   23   1H5*    C   3          1H5*        C   3   0.261 -13.981   1.396
   24   2H5*    C   3          2H5*        C   3   1.432 -12.714   1.799
   25    H4*    C   3           H4*        C   3  -0.250 -14.402   3.646
   26    H3*    C   3           H3*        C   3   0.309 -11.455   3.267
   27    H2*    C   3           H2*        C   3   0.014 -11.068   5.553
   28   2HO*    C   3          2HO*        C   3  -1.228 -12.206   6.816
   29    H1*    C   3           H1*        C   3   1.202 -13.419   6.443
   30   1H4     C   3          1H4         C   3   5.672  -8.931   7.039
   31   2H4     C   3          2H4         C   3   5.895  -8.868   5.305
   32    H5     C   3           H5         C   3   4.855 -10.548   3.859
   33    H6     C   3           H6         C   3   3.109 -12.222   3.688
   34   1H5*    C   4          1H5*        C   4  -4.154 -10.352   4.571
   35   2H5*    C   4          2H5*        C   4  -2.398 -10.190   4.383
   36    H4*    C   4           H4*        C   4  -3.945  -9.948   6.981
   37    H3*    C   4           H3*        C   4  -2.697  -7.888   5.136
   38    H2*    C   4           H2*        C   4  -2.021  -6.623   6.973
   39   2HO*    C   4          2HO*        C   4  -3.213  -8.135   8.949
   40    H1*    C   4           H1*        C   4  -1.390  -8.776   8.625
   41   1H4     C   4          1H4         C   4   3.801  -6.307   5.669
   42   2H4     C   4          2H4         C   4   4.149  -7.981   5.313
   43    H5     C   4           H5         C   4   1.751  -8.738   4.339
   44    H6     C   4           H6         C   4  -0.384  -9.314   5.206
   45   1H5*    U   5          1H5*        U   5  -5.122  -4.699   6.260
   46   2H5*    U   5          2H5*        U   5  -3.717  -5.763   6.365
   47    H4*    U   5           H4*        U   5  -4.293  -4.045   8.740
   48    H3*    U   5           H3*        U   5  -3.178  -3.006   6.103
   49    H2*    U   5           H2*        U   5  -1.618  -1.736   7.320
   50   2HO*    U   5          2HO*        U   5  -3.477  -1.194   8.913
   51    H1*    U   5           H1*        U   5  -1.298  -3.604   9.396
   52    H3     U   5           H3         U   5   2.666  -2.710   7.289
   53    H5     U   5           H5         U   5   0.842  -5.725   5.019
   54    H6     U   5           H6         U   5  -1.183  -5.274   6.229
   55   1H5*    G   6          1H5*        G   6  -2.620  -0.345   7.382
   56   2H5*    G   6          2H5*        G   6  -3.145   1.145   8.178
   57    H4*    G   6           H4*        G   6  -2.110   2.464   6.637
   58    H3*    G   6           H3*        G   6  -2.916   0.383   4.574
   59    H2*    G   6           H2*        G   6  -1.219   1.158   3.171
   60   2HO*    G   6          2HO*        G   6  -0.384   3.175   3.253
   61    H1*    G   6           H1*        G   6   0.605   1.816   5.208
   62    H8     G   6           H8         G   6  -1.324  -1.513   4.824
   63    H1     G   6           H1         G   6   4.686  -1.512   2.537
   64   1H2     G   6          1H2         G   6   5.423   0.626   2.418
   65   2H2     G   6          2H2         G   6   4.828   1.728   3.646
   66   1H5*    A   7          1H5*        A   7  -4.625   1.807   0.589
   67   2H5*    A   7          2H5*        A   7  -3.702   0.290   0.615
   68    H4*    A   7           H4*        A   7  -2.834   1.718  -1.139
   69    H3*    A   7           H3*        A   7  -1.029   1.584   1.303
   70    H2*    A   7           H2*        A   7   0.516   2.959   0.151
   71   2HO*    A   7          2HO*        A   7   0.288   3.333  -2.118
   72    H1*    A   7           H1*        A   7  -1.427   4.423  -1.236
   73    H8     A   7           H8         A   7  -2.432   4.569   2.308
   74   1H6     A   7          1H6         A   7   1.720   7.773   3.977
   75   2H6     A   7          2H6         A   7   0.844   9.070   3.195
   76    H2     A   7           H2         A   7   2.618   7.011  -0.815
   77   1H5*    A   8          1H5*        A   8   0.942   0.611  -1.703
   78   2H5*    A   8          2H5*        A   8   2.222  -0.609  -1.878
   79    H4*    A   8           H4*        A   8   3.220   1.558  -2.192
   80    H3*    A   8           H3*        A   8   3.773   0.346   0.534
   81    H2*    A   8           H2*        A   8   5.090   2.217   1.114
   82   2HO*    A   8          2HO*        A   8   5.207   3.810  -0.901
   83    H1*    A   8           H1*        A   8   3.482   4.107  -0.177
   84    H8     A   8           H8         A   8   1.226   1.767   1.652
   85   1H6     A   8          1H6         A   8   2.592   4.829   6.862
   86   2H6     A   8          2H6         A   8   1.384   3.843   6.069
   87    H2     A   8           H2         A   8   5.451   6.169   3.673
   88   1H5*    A   9          2H5*        A   9   8.251  -1.176  -2.402
   89   2H5*    A   9          1H5*        A   9   7.279  -0.314  -1.191
   90    H4*    A   9           H4*        A   9   9.450   0.713  -2.615
   91    H3*    A   9           H3*        A   9   7.197   2.032  -1.077
   92    H2*    A   9           H2*        A   9   8.037   4.143  -1.754
   93   2HO*    A   9          2HO*        A   9  10.093   4.143  -2.983
   94    H1*    A   9           H1*        A   9   8.713   3.332  -4.341
   95    H8     A   9           H8         A   9   6.294   4.586  -1.956
   96   1H6     A   9          1H6         A   9   2.311   5.137  -4.732
   97   2H6     A   9          2H6         A   9   2.072   4.956  -6.456
   98    H2     A   9           H2         A   9   5.358   2.213  -7.842
   99   1H5*    A  10          1H5*        A  10   9.781   0.374   3.931
  100   2H5*    A  10          2H5*        A  10   8.194   0.934   3.370
  101    H4*    A  10           H4*        A  10  10.346   2.984   3.488
  102    H3*    A  10           H3*        A  10   9.188   1.619   5.919
  103    H2*    A  10           H2*        A  10   8.864   3.680   6.996
  104   2HO*    A  10          2HO*        A  10   9.764   5.631   5.896
  105    H1*    A  10           H1*        A  10   8.105   5.130   4.745
  106    H8     A  10           H8         A  10   6.124   2.292   4.023
  107   1H6     A  10          1H6         A  10   2.270   3.702   8.527
  108   2H6     A  10          2H6         A  10   2.847   2.202   7.836
  109    H2     A  10           H2         A  10   6.245   5.784   9.412
  110   1H5*    A  11          1H5*        A  11  10.686   4.235   9.159
  111   2H5*    A  11          2H5*        A  11  11.176   2.760  10.022
  112    H4*    A  11           H4*        A  11   8.912   4.084  10.602
  113    H3*    A  11           H3*        A  11   9.400   1.097  10.596
  114    H2*    A  11           H2*        A  11   7.129   0.709  11.090
  115   2HO*    A  11          2HO*        A  11   6.920   3.474  11.696
  116    H1*    A  11           H1*        A  11   6.078   2.758   9.554
  117    H8     A  11           H8         A  11   8.797   1.017   7.625
  118   1H6     A  11          1H6         A  11   4.988  -3.418   6.267
  119   2H6     A  11          2H6         A  11   5.553  -2.188   5.162
  120    H2     A  11           H2         A  11   2.749  -0.558   9.131
  121   1H5*    G  12          1H5*        G  12   9.344  -1.930  13.393
  122   2H5*    G  12          2H5*        G  12   9.212  -0.996  11.893
  123    H4*    G  12           H4*        G  12   7.091  -0.300  13.756
  124    H3*    G  12           H3*        G  12   7.414  -3.209  13.013
  125    H2*    G  12           H2*        G  12   5.095  -3.336  12.558
  126   2HO*    G  12          2HO*        G  12   4.535  -2.114  14.512
  127    H1*    G  12           H1*        G  12   4.870  -0.792  11.409
  128    H8     G  12           H8         G  12   7.799  -1.769   9.658
  129    H1     G  12           H1         G  12   2.946  -5.674   8.093
  130   1H2     G  12          1H2         G  12   1.280  -5.424   9.505
  131   2H2     G  12          2H2         G  12   1.454  -4.507  10.984
  132   1H5*    G  13          1H5*        G  13   4.782  -3.591  16.208
  133   2H5*    G  13          2H5*        G  13   5.286  -4.713  17.490
  134    H4*    G  13           H4*        G  13   3.169  -5.469  16.644
  135    H3*    G  13           H3*        G  13   5.514  -7.051  15.557
  136    H2*    G  13           H2*        G  13   4.065  -8.369  14.304
  137   2HO*    G  13          2HO*        G  13   1.623  -7.551  14.961
  138    H1*    G  13           H1*        G  13   2.231  -6.359  13.680
  139    H8     G  13           H8         G  13   5.671  -5.043  13.057
  140    H1     G  13           H1         G  13   3.647  -9.149   8.543
  141   1H2     G  13          1H2         G  13   1.516  -9.831   9.163
  142   2H2     G  13          2H2         G  13   1.451 -10.258  10.858
  143   1H5*    G  14          1H5*        G  14   0.592  -9.109  16.505
  144   2H5*    G  14          2H5*        G  14   0.710  -9.857  18.113
  145    H4*    G  14           H4*        G  14   0.197 -11.738  16.874
  146    H3*    G  14           H3*        G  14   3.192 -11.453  16.512
  147    H2*    G  14           H2*        G  14   3.122 -13.396  15.148
  148   2HO*    G  14          2HO*        G  14   0.524 -14.045  15.210
  149    H1*    G  14           H1*        G  14   0.733 -12.723  13.869
  150    H8     G  14           H8         G  14   3.242  -9.917  14.480
  151    H1     G  14           H1         G  14   4.248 -13.232   9.066
  152   1H2     G  14          1H2         G  14   3.114 -15.210   9.250
  153   2H2     G  14          2H2         G  14   1.526 -15.059   9.968
  154   1H5*    C  15          1H5*        C  15   2.462 -15.211  16.954
  155   2H5*    C  15          2H5*        C  15   3.403 -16.061  18.202
  156    H4*    C  15           H4*        C  15   3.697 -17.335  16.214
  157    H3*    C  15           H3*        C  15   6.057 -15.491  16.687
  158    H2*    C  15           H2*        C  15   7.082 -16.406  14.769
  159   2HO*    C  15          2HO*        C  15   6.579 -18.631  15.430
  160    H1*    C  15           H1*        C  15   4.681 -16.817  13.349
  161   1H4     C  15          1H4         C  15   7.377 -11.849  10.511
  162   2H4     C  15          2H4         C  15   7.394 -10.922  11.998
  163    H5     C  15           H5         C  15   6.046 -11.670  13.921
  164    H6     C  15           H6         C  15   5.015 -13.587  14.974
  165   2H    ASP   2          2H        ASP   2   9.444  -9.979  -1.406
  166   1H    ASP   2          1H        ASP   2   9.340 -11.520  -2.109
  167   3H    ASP   2          3H        ASP   2  10.769 -11.041  -1.325
  168    HA   ASP   2           HA       ASP   2   9.707 -12.451   0.218
  169   1HB   ASP   2          1HB       ASP   2   8.884  -9.612   0.883
  170   2HB   ASP   2          2HB       ASP   2   9.339 -10.883   2.015
  171    H    ALA   3           H        ALA   3   7.541 -11.804   1.848
  172    HA   ALA   3           HA       ALA   3   5.283 -12.665   0.145
  173   1HB   ALA   3          1HB       ALA   3   5.857 -13.776   2.288
  174   2HB   ALA   3          2HB       ALA   3   5.570 -12.258   3.138
  175   3HB   ALA   3          3HB       ALA   3   4.235 -13.087   2.338
  176    H    GLN   4           H        GLN   4   6.210  -9.911   2.172
  177    HA   GLN   4           HA       GLN   4   3.667  -8.548   1.969
  178   1HB   GLN   4          1HB       GLN   4   5.503  -8.194   3.683
  179   2HB   GLN   4          2HB       GLN   4   6.445  -7.409   2.418
  180   1HG   GLN   4          1HG       GLN   4   4.457  -5.855   2.072
  181   2HG   GLN   4          2HG       GLN   4   3.796  -6.512   3.568
  182   1HE2  GLN   4          2HE2      GLN   4   5.223  -3.801   2.666
  183   2HE2  GLN   4          1HE2      GLN   4   6.269  -3.509   3.971
  184    H    THR   5           H        THR   5   6.806  -7.972   0.373
  185    HA   THR   5           HA       THR   5   6.015  -6.000  -1.476
  186    HB   THR   5           HB       THR   5   7.857  -8.393  -1.856
  187    HG1  THR   5           HG1      THR   5   8.812  -7.329  -0.297
  188   1HG2  THR   5          1HG2      THR   5   7.417  -5.847  -3.394
  189   2HG2  THR   5          2HG2      THR   5   8.988  -6.652  -3.420
  190   3HG2  THR   5          3HG2      THR   5   7.553  -7.497  -4.003
  191    H    ARG   6           H        ARG   6   5.480  -9.472  -1.442
  192    HA   ARG   6           HA       ARG   6   4.275  -9.685  -4.084
  193   1HB   ARG   6          1HB       ARG   6   4.939 -11.318  -1.790
  194   2HB   ARG   6          2HB       ARG   6   3.270 -11.634  -2.277
  195   1HG   ARG   6          1HG       ARG   6   4.460 -11.617  -4.712
  196   2HG   ARG   6          2HG       ARG   6   5.808 -12.194  -3.730
  197   1HD   ARG   6          1HD       ARG   6   3.051 -13.412  -3.462
  198   2HD   ARG   6          2HD       ARG   6   4.214 -14.000  -4.667
  199    HE   ARG   6           HE       ARG   6   4.430 -14.365  -1.786
  200   1HH1  ARG   6          1HH1      ARG   6   6.178 -13.957  -4.758
  201   2HH1  ARG   6          2HH1      ARG   6   7.592 -14.766  -4.172
  202   1HH2  ARG   6          1HH2      ARG   6   6.268 -15.412  -1.038
  203   2HH2  ARG   6          2HH2      ARG   6   7.644 -15.586  -2.076
  204    H    ARG   7           H        ARG   7   3.115  -9.494  -0.736
  205    HA   ARG   7           HA       ARG   7   0.341  -9.564  -1.267
  206   1HB   ARG   7          1HB       ARG   7   1.228  -9.806   0.955
  207   2HB   ARG   7          2HB       ARG   7   2.050  -8.252   0.860
  208   1HG   ARG   7          1HG       ARG   7  -0.356  -7.275   0.530
  209   2HG   ARG   7          2HG       ARG   7  -0.884  -8.811   1.218
  210   1HD   ARG   7          1HD       ARG   7   0.106  -8.370   3.289
  211   2HD   ARG   7          2HD       ARG   7   1.277  -7.233   2.601
  212    HE   ARG   7           HE       ARG   7  -0.348  -5.543   2.825
  213   1HH1  ARG   7          1HH1      ARG   7  -1.824  -8.688   2.819
  214   2HH1  ARG   7          2HH1      ARG   7  -3.409  -8.073   3.134
  215   1HH2  ARG   7          1HH2      ARG   7  -2.417  -4.760   3.241
  216   2HH2  ARG   7          2HH2      ARG   7  -3.744  -5.864   3.372
  217    H    ARG   8           H        ARG   8   2.684  -6.946  -1.453
  218    HA   ARG   8           HA       ARG   8   0.961  -4.692  -1.599
  219   1HB   ARG   8          1HB       ARG   8   3.646  -5.208  -1.737
  220   2HB   ARG   8          2HB       ARG   8   3.312  -4.820  -3.423
  221   1HG   ARG   8          1HG       ARG   8   3.859  -2.745  -2.389
  222   2HG   ARG   8          2HG       ARG   8   2.104  -2.741  -2.556
  223   1HD   ARG   8          1HD       ARG   8   2.876  -1.990  -0.281
  224   2HD   ARG   8          2HD       ARG   8   1.845  -3.433  -0.214
  225    HE   ARG   8           HE       ARG   8   3.725  -4.673   0.498
  226   1HH1  ARG   8          1HH1      ARG   8   4.698  -1.722  -1.019
  227   2HH1  ARG   8          2HH1      ARG   8   6.375  -1.948  -0.657
  228   1HH2  ARG   8          1HH2      ARG   8   5.900  -4.966   0.968
  229   2HH2  ARG   8          2HH2      ARG   8   7.055  -3.777   0.462
  230    H    GLU   9           H        GLU   9   1.958  -7.015  -4.082
  231    HA   GLU   9           HA       GLU   9   0.652  -5.692  -6.278
  232   1HB   GLU   9          1HB       GLU   9   1.197  -8.635  -5.722
  233   2HB   GLU   9          2HB       GLU   9   0.804  -7.965  -7.306
  234   1HG   GLU   9          1HG       GLU   9   2.906  -6.366  -6.438
  235   2HG   GLU   9          2HG       GLU   9   3.358  -7.976  -5.877
  236    H    ARG  10           H        ARG  10  -0.364  -7.782  -3.688
  237    HA   ARG  10           HA       ARG  10  -3.079  -8.185  -4.673
  238   1HB   ARG  10          1HB       ARG  10  -1.342  -8.970  -2.453
  239   2HB   ARG  10          2HB       ARG  10  -2.971  -8.590  -1.906
  240   1HG   ARG  10          1HG       ARG  10  -3.573 -10.657  -2.583
  241   2HG   ARG  10          2HG       ARG  10  -3.346 -10.099  -4.240
  242   1HD   ARG  10          1HD       ARG  10  -0.762 -10.619  -3.573
  243   2HD   ARG  10          2HD       ARG  10  -1.593 -11.835  -2.585
  244    HE   ARG  10           HE       ARG  10  -1.540 -11.750  -5.514
  245   1HH1  ARG  10          1HH1      ARG  10  -3.230 -12.805  -2.666
  246   2HH1  ARG  10          2HH1      ARG  10  -4.045 -14.092  -3.487
  247   1HH2  ARG  10          1HH2      ARG  10  -2.609 -13.426  -6.565
  248   2HH2  ARG  10          2HH2      ARG  10  -3.696 -14.443  -5.680
  249    H    ARG  11           H        ARG  11  -1.307  -5.679  -3.113
  250    HA   ARG  11           HA       ARG  11  -3.733  -4.447  -1.937
  251   1HB   ARG  11          1HB       ARG  11  -0.794  -3.699  -2.013
  252   2HB   ARG  11          2HB       ARG  11  -2.034  -2.774  -1.169
  253   1HG   ARG  11          1HG       ARG  11  -1.260  -5.656  -0.615
  254   2HG   ARG  11          2HG       ARG  11  -0.900  -4.280   0.414
  255   1HD   ARG  11          1HD       ARG  11  -2.953  -4.403   1.383
  256   2HD   ARG  11          2HD       ARG  11  -3.754  -4.417  -0.194
  257    HE   ARG  11           HE       ARG  11  -2.443  -6.935   0.233
  258   1HH1  ARG  11          1HH1      ARG  11  -5.177  -5.052   1.249
  259   2HH1  ARG  11          2HH1      ARG  11  -6.138  -6.438   1.635
  260   1HH2  ARG  11          1HH2      ARG  11  -3.702  -8.728   0.738
  261   2HH2  ARG  11          2HH2      ARG  11  -5.308  -8.509   1.348
  262    H    ALA  12           H        ALA  12  -2.465  -4.625  -5.001
  263    HA   ALA  12           HA       ALA  12  -2.291  -1.935  -5.930
  264   1HB   ALA  12          1HB       ALA  12  -1.853  -4.090  -7.195
  265   2HB   ALA  12          2HB       ALA  12  -3.598  -4.317  -7.310
  266   3HB   ALA  12          3HB       ALA  12  -2.836  -2.935  -8.096
  267    H    GLU  13           H        GLU  13  -5.027  -3.875  -4.923
  268    HA   GLU  13           HA       GLU  13  -7.075  -2.103  -6.009
  269   1HB   GLU  13          1HB       GLU  13  -7.028  -4.316  -3.927
  270   2HB   GLU  13          2HB       GLU  13  -8.509  -3.530  -4.473
  271   1HG   GLU  13          1HG       GLU  13  -8.533  -4.686  -6.420
  272   2HG   GLU  13          2HG       GLU  13  -6.809  -4.428  -6.689
  273    H    LYS  14           H        LYS  14  -5.261  -2.479  -2.995
  274    HA   LYS  14           HA       LYS  14  -6.834  -0.464  -1.549
  275   1HB   LYS  14          1HB       LYS  14  -4.125  -1.774  -1.057
  276   2HB   LYS  14          2HB       LYS  14  -5.033  -0.839   0.135
  277   1HG   LYS  14          1HG       LYS  14  -6.134  -3.310  -1.221
  278   2HG   LYS  14          2HG       LYS  14  -5.299  -3.346   0.334
  279   1HD   LYS  14          1HD       LYS  14  -7.004  -1.478   1.002
  280   2HD   LYS  14          2HD       LYS  14  -7.944  -2.091  -0.360
  281   1HE   LYS  14          1HE       LYS  14  -7.765  -4.401   0.646
  282   2HE   LYS  14          2HE       LYS  14  -7.028  -3.655   2.078
  283   1HZ   LYS  14          1HZ       LYS  14  -8.966  -2.125   2.137
  284   2HZ   LYS  14          2HZ       LYS  14  -9.697  -3.057   0.918
  285   3HZ   LYS  14          3HZ       LYS  14  -9.375  -3.748   2.433
  286    H    GLN  15           H        GLN  15  -3.883  -0.735  -3.383
  287    HA   GLN  15           HA       GLN  15  -2.837   1.914  -2.923
  288   1HB   GLN  15          1HB       GLN  15  -2.292  -0.547  -4.400
  289   2HB   GLN  15          2HB       GLN  15  -1.890   0.865  -5.360
  290   1HG   GLN  15          1HG       GLN  15  -0.263   1.588  -3.861
  291   2HG   GLN  15          2HG       GLN  15  -1.029   0.774  -2.496
  292   1HE2  GLN  15          2HE2      GLN  15  -1.079  -1.749  -2.765
  293   2HE2  GLN  15          1HE2      GLN  15   0.337  -2.462  -3.375
  294    H    ALA  16           H        ALA  16  -4.559   0.394  -5.658
  295    HA   ALA  16           HA       ALA  16  -4.760   2.805  -7.224
  296   1HB   ALA  16          1HB       ALA  16  -5.022   0.482  -8.074
  297   2HB   ALA  16          2HB       ALA  16  -6.510   0.315  -7.141
  298   3HB   ALA  16          3HB       ALA  16  -6.430   1.467  -8.473
  299    H    GLN  17           H        GLN  17  -6.665   1.507  -4.554
  300    HA   GLN  17           HA       GLN  17  -8.910   3.351  -5.002
  301   1HB   GLN  17          1HB       GLN  17  -8.010   1.334  -2.961
  302   2HB   GLN  17          2HB       GLN  17  -9.264   2.485  -2.506
  303   1HG   GLN  17          1HG       GLN  17  -9.727   1.302  -5.146
  304   2HG   GLN  17          2HG       GLN  17  -9.682   0.098  -3.860
  305   1HE2  GLN  17          2HE2      GLN  17 -10.788   3.484  -3.505
  306   2HE2  GLN  17          1HE2      GLN  17 -12.393   3.086  -3.121
  307    H    TRP  18           H        TRP  18  -5.989   3.151  -3.082
  308    HA   TRP  18           HA       TRP  18  -6.454   5.601  -1.561
  309   1HB   TRP  18          1HB       TRP  18  -5.034   3.786  -0.722
  310   2HB   TRP  18          2HB       TRP  18  -4.049   3.855  -2.168
  311    HD1  TRP  18           HD1      TRP  18  -4.576   5.644   1.137
  312    HE1  TRP  18           HE1      TRP  18  -2.756   7.467   1.369
  313    HE3  TRP  18           HE3      TRP  18  -2.554   5.461  -3.487
  314    HZ2  TRP  18           HZ2      TRP  18  -0.704   8.659  -0.206
  315    HZ3  TRP  18           HZ3      TRP  18  -0.695   6.913  -4.107
  316    HH2  TRP  18           HH2      TRP  18   0.247   8.498  -2.503
  317    H    LYS  19           H        LYS  19  -4.421   4.600  -4.265
  318    HA   LYS  19           HA       LYS  19  -3.151   7.075  -4.828
  319   1HB   LYS  19          1HB       LYS  19  -3.908   4.636  -6.457
  320   2HB   LYS  19          2HB       LYS  19  -3.020   5.978  -7.160
  321   1HG   LYS  19          1HG       LYS  19  -1.368   5.708  -5.225
  322   2HG   LYS  19          2HG       LYS  19  -2.142   4.157  -4.928
  323   1HD   LYS  19          1HD       LYS  19  -1.000   4.980  -7.609
  324   2HD   LYS  19          2HD       LYS  19  -0.118   4.020  -6.421
  325   1HE   LYS  19          1HE       LYS  19  -2.278   2.497  -6.479
  326   2HE   LYS  19          2HE       LYS  19  -2.511   3.253  -8.068
  327   1HZ   LYS  19          1HZ       LYS  19  -0.192   2.710  -8.593
  328   2HZ   LYS  19          2HZ       LYS  19  -0.041   1.901  -7.109
  329   3HZ   LYS  19          3HZ       LYS  19  -1.111   1.312  -8.292
  330    H    ALA  20           H        ALA  20  -6.258   5.699  -5.768
  331    HA   ALA  20           HA       ALA  20  -6.972   7.615  -7.733
  332   1HB   ALA  20          1HB       ALA  20  -8.255   5.620  -5.993
  333   2HB   ALA  20          2HB       ALA  20  -9.324   6.925  -6.507
  334   3HB   ALA  20          3HB       ALA  20  -8.506   5.930  -7.711
  335    H    ALA  21           H        ALA  21  -6.980   7.723  -4.226
  336    HA   ALA  21           HA       ALA  21  -8.079  10.500  -4.353
  337   1HB   ALA  21          1HB       ALA  21  -8.509   8.158  -2.559
  338   2HB   ALA  21          2HB       ALA  21  -8.539   9.752  -1.808
  339   3HB   ALA  21          3HB       ALA  21  -9.668   9.368  -3.107
  340    H    ASN  22           H        ASN  22  -5.298   9.483  -4.545
  341    HA   ASN  22           HA       ASN  22  -4.102  11.370  -2.621
  342   1HB   ASN  22          1HB       ASN  22  -3.498   8.399  -2.631
  343   2HB   ASN  22          2HB       ASN  22  -2.542   9.606  -1.773
  344   1HD2  ASN  22          2HD2      ASN  22  -4.993   7.428  -1.313
  345   2HD2  ASN  22          1HD2      ASN  22  -5.775   8.148   0.012
  346    HA   PRO  23           HA       PRO  23  -1.968  10.622  -6.763
  347   1HB   PRO  23          1HB       PRO  23  -2.717  12.957  -7.988
  348   2HB   PRO  23          2HB       PRO  23  -3.649  11.453  -8.138
  349   1HG   PRO  23          1HG       PRO  23  -4.141  13.819  -6.406
  350   2HG   PRO  23          2HG       PRO  23  -5.295  12.795  -7.274
  351   1HD   PRO  23          1HD       PRO  23  -4.798  12.577  -4.600
  352   2HD   PRO  23          2HD       PRO  23  -5.353  11.224  -5.597
  353    H    LEU  24           H        LEU  24  -2.550  13.308  -4.608
  354    HA   LEU  24           HA       LEU  24  -0.311  14.967  -5.141
  355   1HB   LEU  24          1HB       LEU  24  -0.946  15.959  -3.110
  356   2HB   LEU  24          2HB       LEU  24  -2.405  15.045  -3.470
  357    HG   LEU  24           HG       LEU  24  -0.166  13.899  -1.774
  358   1HD1  LEU  24          1HD1      LEU  24  -2.607  15.457  -0.889
  359   2HD1  LEU  24          2HD1      LEU  24  -1.542  14.555   0.188
  360   3HD1  LEU  24          3HD1      LEU  24  -0.925  15.950  -0.697
  361   1HD2  LEU  24          1HD2      LEU  24  -2.400  12.702  -2.893
  362   2HD2  LEU  24          2HD2      LEU  24  -1.550  12.103  -1.470
  363   3HD2  LEU  24          3HD2      LEU  24  -2.972  13.131  -1.286
  364    H    LEU  25           H        LEU  25  -0.629  11.972  -3.357
  365    HA   LEU  25           HA       LEU  25   2.283  11.925  -2.738
  366   1HB   LEU  25          1HB       LEU  25  -0.245  10.641  -1.734
  367   2HB   LEU  25          2HB       LEU  25   1.279   9.775  -1.504
  368    HG   LEU  25           HG       LEU  25   0.996  12.675  -0.718
  369   1HD1  LEU  25          1HD1      LEU  25  -0.660  10.864   0.368
  370   2HD1  LEU  25          2HD1      LEU  25   0.773  10.527   1.340
  371   3HD1  LEU  25          3HD1      LEU  25   0.078  12.147   1.329
  372   1HD2  LEU  25          1HD2      LEU  25   3.230  11.337  -0.958
  373   2HD2  LEU  25          2HD2      LEU  25   2.976  12.306   0.493
  374   3HD2  LEU  25          3HD2      LEU  25   2.731  10.560   0.545
  375    H    VAL  26           H        VAL  26   1.173  11.695  -5.366
  376    HA   VAL  26           HA       VAL  26   2.264   9.078  -6.179
  377    HB   VAL  26           HB       VAL  26  -0.559   9.801  -5.872
  378   1HG1  VAL  26          1HG1      VAL  26   0.415   8.998  -8.625
  379   2HG1  VAL  26          2HG1      VAL  26  -1.239   8.721  -8.077
  380   3HG1  VAL  26          3HG1      VAL  26  -0.611  10.367  -8.187
  381   1HG2  VAL  26          1HG2      VAL  26   0.620   7.732  -5.085
  382   2HG2  VAL  26          2HG2      VAL  26  -0.831   7.397  -6.031
  383   3HG2  VAL  26          3HG2      VAL  26   0.765   7.224  -6.769
  384    H    GLY  27           H        GLY  27   3.615   9.651  -7.861
  385   1HA   GLY  27          1HA       GLY  27   4.313  10.682  -9.877
  386   2HA   GLY  27          2HA       GLY  27   2.658  11.270 -10.083
  387    H    VAL  28           H        VAL  28   2.086  12.947  -8.203
  388    HA   VAL  28           HA       VAL  28   3.458  15.362  -8.573
  389    HB   VAL  28           HB       VAL  28   1.767  14.165  -6.382
  390   1HG1  VAL  28          1HG1      VAL  28   2.872  16.992  -6.444
  391   2HG1  VAL  28          2HG1      VAL  28   1.632  16.408  -5.334
  392   3HG1  VAL  28          3HG1      VAL  28   3.269  15.756  -5.250
  393   1HG2  VAL  28          1HG2      VAL  28   0.841  14.860  -8.635
  394   2HG2  VAL  28          2HG2      VAL  28   0.090  15.658  -7.253
  395   3HG2  VAL  28          3HG2      VAL  28   1.282  16.518  -8.228
  396    H    SER  29           H        SER  29   4.754  16.531  -6.750
  397    HA   SER  29           HA       SER  29   7.073  14.925  -6.079
  398   1HB   SER  29          1HB       SER  29   6.295  17.664  -5.056
  399   2HB   SER  29          2HB       SER  29   7.923  17.018  -5.235
  400    HG   SER  29           HG       SER  29   7.553  16.960  -7.494
  401    H    ALA  30           H        ALA  30   4.945  13.626  -4.929
  402    HA   ALA  30           HA       ALA  30   3.853  13.073  -2.872
  403   1HB   ALA  30          1HB       ALA  30   6.821  12.857  -2.834
  404   2HB   ALA  30          2HB       ALA  30   5.979  12.551  -1.314
  405   3HB   ALA  30          3HB       ALA  30   5.599  11.587  -2.744
  406    H    LYS  31           H        LYS  31   3.196  15.560  -2.731
  407    HA   LYS  31           HA       LYS  31   4.162  16.537  -0.075
  408   1HB   LYS  31          1HB       LYS  31   4.196  18.818  -1.052
  409   2HB   LYS  31          2HB       LYS  31   5.297  17.742  -1.909
  410   1HG   LYS  31          1HG       LYS  31   3.950  17.646  -3.804
  411   2HG   LYS  31          2HG       LYS  31   2.476  17.996  -2.898
  412   1HD   LYS  31          1HD       LYS  31   3.065  19.952  -4.224
  413   2HD   LYS  31          2HD       LYS  31   3.315  20.322  -2.517
  414   1HE   LYS  31          1HE       LYS  31   5.699  20.032  -2.714
  415   2HE   LYS  31          2HE       LYS  31   5.538  19.357  -4.347
  416   1HZ   LYS  31          1HZ       LYS  31   4.542  22.050  -3.605
  417   2HZ   LYS  31          2HZ       LYS  31   6.087  21.793  -4.255
  418   3HZ   LYS  31          3HZ       LYS  31   4.708  21.398  -5.165
  419    HA   PRO  32           HA       PRO  32  -0.108  17.100   0.756
  420   1HB   PRO  32          1HB       PRO  32  -0.125  19.372   2.287
  421   2HB   PRO  32          2HB       PRO  32   0.466  17.807   2.884
  422   1HG   PRO  32          1HG       PRO  32   2.002  20.155   1.889
  423   2HG   PRO  32          2HG       PRO  32   2.360  19.059   3.233
  424   1HD   PRO  32          1HD       PRO  32   3.571  18.892   0.798
  425   2HD   PRO  32          2HD       PRO  32   3.332  17.495   1.871
  426    H    VAL  33           H        VAL  33  -1.950  18.748   0.489
  427    HA   VAL  33           HA       VAL  33  -1.314  20.908  -1.464
  428    HB   VAL  33           HB       VAL  33  -3.443  19.921  -2.702
  429   1HG1  VAL  33          1HG1      VAL  33  -0.945  20.066  -3.405
  430   2HG1  VAL  33          2HG1      VAL  33  -0.884  18.356  -2.978
  431   3HG1  VAL  33          3HG1      VAL  33  -1.980  18.911  -4.242
  432   1HG2  VAL  33          1HG2      VAL  33  -3.408  18.114  -0.705
  433   2HG2  VAL  33          2HG2      VAL  33  -3.959  17.704  -2.329
  434   3HG2  VAL  33          3HG2      VAL  33  -2.318  17.299  -1.825
  435    H    ASN  34           H        ASN  34  -4.581  19.724  -0.945
  436    HA   ASN  34           HA       ASN  34  -5.213  21.502   1.270
  437   1HB   ASN  34          1HB       ASN  34  -4.955  22.603  -1.320
  438   2HB   ASN  34          2HB       ASN  34  -6.690  22.504  -1.018
  439   1HD2  ASN  34          2HD2      ASN  34  -3.730  23.421   0.854
  440   2HD2  ASN  34          1HD2      ASN  34  -4.439  24.784   1.575
  441    H    ARG  35           H        ARG  35  -7.655  21.570   1.590
  442    HA   ARG  35           HA       ARG  35  -9.677  20.371   1.843
  443   1HB   ARG  35          1HB       ARG  35  -8.995  19.742  -1.050
  444   2HB   ARG  35          2HB       ARG  35 -10.601  19.632  -0.326
  445   1HG   ARG  35          1HG       ARG  35 -10.949  21.834  -0.639
  446   2HG   ARG  35          2HG       ARG  35  -9.465  22.229   0.228
  447   1HD   ARG  35          1HD       ARG  35  -8.678  22.965  -1.779
  448   2HD   ARG  35          2HD       ARG  35  -8.550  21.252  -2.227
  449    HE   ARG  35           HE       ARG  35 -10.466  21.530  -3.572
  450   1HH1  ARG  35          1HH1      ARG  35 -10.255  24.037  -1.181
  451   2HH1  ARG  35          2HH1      ARG  35 -11.626  24.898  -1.793
  452   1HH2  ARG  35          1HH2      ARG  35 -12.247  22.655  -4.359
  453   2HH2  ARG  35          2HH2      ARG  35 -12.749  24.120  -3.583
  454    HA   PRO  36           HA       PRO  36  -7.230  16.344   1.999
  455   1HB   PRO  36          1HB       PRO  36  -6.828  16.254   4.705
  456   2HB   PRO  36          2HB       PRO  36  -5.685  17.020   3.582
  457   1HG   PRO  36          1HG       PRO  36  -7.734  18.269   5.339
  458   2HG   PRO  36          2HG       PRO  36  -6.103  18.824   4.935
  459   1HD   PRO  36          1HD       PRO  36  -8.373  19.836   3.801
  460   2HD   PRO  36          2HD       PRO  36  -6.786  19.834   3.002
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  12.215 -16.168   1.716
    2   2H5*    G   1          2H5*        G   1  13.231 -16.663   3.088
    3    H4*    G   1           H4*        G   1  11.299 -18.733   2.490
    4    H3*    G   1           H3*        G   1  10.228 -15.925   2.946
    5    H2*    G   1           H2*        G   1   8.537 -16.835   4.326
    6   2HO*    G   1          2HO*        G   1   8.533 -19.272   4.494
    7    H1*    G   1           H1*        G   1  10.180 -18.749   5.506
    8    H8     G   1           H8         G   1  12.042 -15.505   5.354
    9    H1     G   1           H1         G   1   7.415 -15.586   9.812
   10   1H2     G   1          1H2         G   1   6.459 -17.719   9.740
   11   2H2     G   1          2H2         G   1   6.111 -18.181   8.089
   12   1H5*    C   2          1H5*        C   2   6.473 -16.681   1.146
   13   2H5*    C   2          2H5*        C   2   7.501 -16.501   2.585
   14    H4*    C   2           H4*        C   2   5.023 -18.159   2.840
   15    H3*    C   2           H3*        C   2   5.061 -15.144   2.532
   16    H2*    C   2           H2*        C   2   3.541 -14.921   4.310
   17   2HO*    C   2          2HO*        C   2   1.949 -16.308   4.129
   18    H1*    C   2           H1*        C   2   4.537 -17.001   5.876
   19   1H4     C   2          1H4         C   2   6.879 -11.723   8.481
   20   2H4     C   2          2H4         C   2   8.172 -11.689   7.309
   21    H5     C   2           H5         C   2   8.075 -13.032   5.270
   22    H6     C   2           H6         C   2   7.198 -15.108   4.330
   23   1H5*    C   3          1H5*        C   3   0.506 -13.872   1.641
   24   2H5*    C   3          2H5*        C   3   1.451 -12.415   1.998
   25    H4*    C   3           H4*        C   3  -0.014 -14.253   3.840
   26    H3*    C   3           H3*        C   3   0.562 -11.297   3.603
   27    H2*    C   3           H2*        C   3   0.360 -11.019   5.908
   28   2HO*    C   3          2HO*        C   3  -0.651 -12.390   7.266
   29    H1*    C   3           H1*        C   3   1.542 -13.419   6.658
   30   1H4     C   3          1H4         C   3   6.031  -8.926   7.227
   31   2H4     C   3          2H4         C   3   6.304  -8.949   5.499
   32    H5     C   3           H5         C   3   5.301 -10.718   4.126
   33    H6     C   3           H6         C   3   3.504 -12.333   3.972
   34   1H5*    C   4          1H5*        C   4  -3.969 -10.277   4.913
   35   2H5*    C   4          2H5*        C   4  -2.224 -10.111   4.653
   36    H4*    C   4           H4*        C   4  -3.699  -9.774   7.283
   37    H3*    C   4           H3*        C   4  -2.387  -7.826   5.363
   38    H2*    C   4           H2*        C   4  -1.734  -6.506   7.197
   39   2HO*    C   4          2HO*        C   4  -2.726  -6.512   9.101
   40    H1*    C   4           H1*        C   4  -1.132  -8.636   8.884
   41   1H4     C   4          1H4         C   4   4.010  -6.176   5.791
   42   2H4     C   4          2H4         C   4   4.425  -7.863   5.602
   43    H5     C   4           H5         C   4   2.057  -8.772   4.651
   44    H6     C   4           H6         C   4  -0.090  -9.306   5.519
   45   1H5*    U   5          1H5*        U   5  -4.660  -5.758   7.983
   46   2H5*    U   5          2H5*        U   5  -5.606  -4.393   7.348
   47    H4*    U   5           H4*        U   5  -4.190  -3.634   9.176
   48    H3*    U   5           H3*        U   5  -3.250  -2.709   6.436
   49    H2*    U   5           H2*        U   5  -1.537  -1.511   7.500
   50   2HO*    U   5          2HO*        U   5  -2.865  -1.885   9.990
   51    H1*    U   5           H1*        U   5  -1.195  -3.341   9.617
   52    H3     U   5           H3         U   5   2.672  -2.469   7.336
   53    H5     U   5           H5         U   5   0.796  -5.545   5.215
   54    H6     U   5           H6         U   5  -1.183  -5.081   6.478
   55   1H5*    G   6          1H5*        G   6  -2.440  -0.022   7.558
   56   2H5*    G   6          2H5*        G   6  -2.836   1.478   8.411
   57    H4*    G   6           H4*        G   6  -2.110   2.810   6.664
   58    H3*    G   6           H3*        G   6  -2.725   0.463   4.834
   59    H2*    G   6           H2*        G   6  -1.134   1.263   3.323
   60   2HO*    G   6          2HO*        G   6  -1.901   3.670   4.290
   61    H1*    G   6           H1*        G   6   0.637   2.287   5.263
   62    H8     G   6           H8         G   6  -0.939  -1.237   5.270
   63    H1     G   6           H1         G   6   5.007  -0.871   2.849
   64   1H2     G   6          1H2         G   6   5.522   1.290   2.483
   65   2H2     G   6          2H2         G   6   4.776   2.490   3.523
   66   1H5*    A   7          1H5*        A   7  -4.735   1.584   0.744
   67   2H5*    A   7          2H5*        A   7  -3.733   0.117   0.752
   68    H4*    A   7           H4*        A   7  -2.969   1.548  -1.030
   69    H3*    A   7           H3*        A   7  -1.128   1.603   1.388
   70    H2*    A   7           H2*        A   7   0.303   3.051   0.178
   71   2HO*    A   7          2HO*        A   7   0.406   3.129  -1.974
   72    H1*    A   7           H1*        A   7  -1.750   4.335  -1.221
   73    H8     A   7           H8         A   7  -2.737   4.528   2.322
   74   1H6     A   7          1H6         A   7  -0.072   8.950   3.292
   75   2H6     A   7          2H6         A   7   1.537   8.345   3.617
   76    H2     A   7           H2         A   7   2.146   7.174  -0.902
   77   1H5*    A   8          1H5*        A   8   0.877   0.791  -1.624
   78   2H5*    A   8          2H5*        A   8   2.242  -0.331  -1.808
   79    H4*    A   8           H4*        A   8   3.067   1.900  -2.173
   80    H3*    A   8           H3*        A   8   3.760   0.773   0.562
   81    H2*    A   8           H2*        A   8   4.961   2.740   1.078
   82   2HO*    A   8          2HO*        A   8   4.691   3.606  -1.611
   83    H1*    A   8           H1*        A   8   3.190   4.490  -0.202
   84    H8     A   8           H8         A   8   1.114   2.057   1.685
   85   1H6     A   8          1H6         A   8   1.519   3.922   6.210
   86   2H6     A   8          2H6         A   8   2.101   5.490   6.723
   87    H2     A   8           H2         A   8   5.144   6.680   3.614
   88   1H5*    A   9          2H5*        A   9   8.339  -0.325  -2.385
   89   2H5*    A   9          1H5*        A   9   7.299   0.482  -1.193
   90    H4*    A   9           H4*        A   9   9.382   1.639  -2.679
   91    H3*    A   9           H3*        A   9   7.094   2.814  -1.076
   92    H2*    A   9           H2*        A   9   7.788   4.971  -1.774
   93   2HO*    A   9          2HO*        A   9   9.796   5.113  -3.050
   94    H1*    A   9           H1*        A   9   8.425   4.194  -4.381
   95    H8     A   9           H8         A   9   6.015   5.304  -1.914
   96   1H6     A   9          1H6         A   9   1.751   5.273  -4.597
   97   2H6     A   9          2H6         A   9   1.824   5.793  -6.265
   98    H2     A   9           H2         A   9   5.064   2.935  -7.802
   99   1H5*    A  10          1H5*        A  10   9.812   1.286   3.861
  100   2H5*    A  10          2H5*        A  10   8.195   1.764   3.313
  101    H4*    A  10           H4*        A  10  10.214   3.939   3.489
  102    H3*    A  10           H3*        A  10   9.164   2.424   5.881
  103    H2*    A  10           H2*        A  10   8.710   4.419   7.026
  104   2HO*    A  10          2HO*        A  10  10.746   5.379   5.458
  105    H1*    A  10           H1*        A  10   7.845   5.896   4.826
  106    H8     A  10           H8         A  10   6.040   3.006   3.973
  107   1H6     A  10          1H6         A  10   2.548   2.834   7.382
  108   2H6     A  10          2H6         A  10   2.309   3.685   8.892
  109    H2     A  10           H2         A  10   5.958   6.212   9.533
  110   1H5*    A  11          1H5*        A  11  10.489   4.743   8.889
  111   2H5*    A  11          2H5*        A  11  11.071   3.423   9.929
  112    H4*    A  11           H4*        A  11   8.750   4.596  10.412
  113    H3*    A  11           H3*        A  11   9.332   1.627  10.501
  114    H2*    A  11           H2*        A  11   7.069   1.186  10.999
  115   2HO*    A  11          2HO*        A  11   5.652   2.734  11.725
  116    H1*    A  11           H1*        A  11   5.972   3.157   9.394
  117    H8     A  11           H8         A  11   8.727   1.434   7.502
  118   1H6     A  11          1H6         A  11   4.930  -3.140   6.290
  119   2H6     A  11          2H6         A  11   5.673  -1.973   5.221
  120    H2     A  11           H2         A  11   2.739  -0.261   9.109
  121   1H5*    G  12          1H5*        G  12   9.409  -1.325  13.378
  122   2H5*    G  12          2H5*        G  12   9.254  -0.456  11.840
  123    H4*    G  12           H4*        G  12   7.106   0.240  13.680
  124    H3*    G  12           H3*        G  12   7.518  -2.677  13.015
  125    H2*    G  12           H2*        G  12   5.202  -2.884  12.569
  126   2HO*    G  12          2HO*        G  12   5.014  -0.907  14.400
  127    H1*    G  12           H1*        G  12   4.907  -0.381  11.346
  128    H8     G  12           H8         G  12   7.880  -1.351   9.643
  129    H1     G  12           H1         G  12   3.127  -5.430   8.213
  130   1H2     G  12          1H2         G  12   1.390  -5.048   9.546
  131   2H2     G  12          2H2         G  12   1.647  -4.286  11.099
  132   1H5*    G  13          1H5*        G  13   4.862  -2.943  16.053
  133   2H5*    G  13          2H5*        G  13   5.210  -4.029  17.415
  134    H4*    G  13           H4*        G  13   3.140  -4.740  16.392
  135    H3*    G  13           H3*        G  13   5.496  -6.486  15.632
  136    H2*    G  13           H2*        G  13   4.049  -7.798  14.344
  137   2HO*    G  13          2HO*        G  13   2.400  -8.004  15.949
  138    H1*    G  13           H1*        G  13   2.379  -5.719  13.490
  139    H8     G  13           H8         G  13   5.874  -4.606  12.915
  140    H1     G  13           H1         G  13   3.902  -9.001   8.660
  141   1H2     G  13          1H2         G  13   1.873  -9.731   9.250
  142   2H2     G  13          2H2         G  13   1.435  -9.701  10.943
  143   1H5*    G  14          1H5*        G  14   1.249  -9.086  17.505
  144   2H5*    G  14          2H5*        G  14   2.394 -10.293  18.135
  145    H4*    G  14           H4*        G  14   0.400 -11.081  16.618
  146    H3*    G  14           H3*        G  14   3.282 -11.937  16.281
  147    H2*    G  14           H2*        G  14   2.652 -13.268  14.435
  148   2HO*    G  14          2HO*        G  14   0.249 -13.329  15.735
  149    H1*    G  14           H1*        G  14   0.770 -11.498  13.398
  150    H8     G  14           H8         G  14   3.661  -9.389  14.328
  151    H1     G  14           H1         G  14   4.796 -12.978   9.107
  152   1H2     G  14          1H2         G  14   3.387 -14.805   9.227
  153   2H2     G  14          2H2         G  14   1.758 -14.350   9.676
  154   1H5*    C  15          1H5*        C  15   1.066 -15.093  16.006
  155   2H5*    C  15          2H5*        C  15   1.394 -16.491  17.058
  156    H4*    C  15           H4*        C  15   1.283 -17.357  14.833
  157    H3*    C  15           H3*        C  15   4.150 -16.972  15.745
  158    H2*    C  15           H2*        C  15   4.869 -17.880  13.690
  159   2HO*    C  15          2HO*        C  15   2.920 -18.753  12.332
  160    H1*    C  15           H1*        C  15   2.736 -16.835  12.172
  161   1H4     C  15          1H4         C  15   7.847 -13.421  10.626
  162   2H4     C  15          2H4         C  15   7.938 -12.734  12.236
  163    H5     C  15           H5         C  15   6.062 -13.007  13.800
  164    H6     C  15           H6         C  15   4.151 -14.367  14.360
  165   2H    ASP   2          2H        ASP   2   9.839 -11.780  -2.171
  166   1H    ASP   2          1H        ASP   2   9.729 -13.430  -1.792
  167   3H    ASP   2          3H        ASP   2  11.168 -12.581  -1.479
  168    HA   ASP   2           HA       ASP   2  10.163 -12.729   0.620
  169   1HB   ASP   2          1HB       ASP   2   9.212 -10.115  -0.580
  170   2HB   ASP   2          2HB       ASP   2   9.743 -10.401   1.075
  171    H    ALA   3           H        ALA   3   7.972 -11.292   1.557
  172    HA   ALA   3           HA       ALA   3   5.634 -12.700   0.310
  173   1HB   ALA   3          1HB       ALA   3   6.441 -13.755   2.400
  174   2HB   ALA   3          2HB       ALA   3   6.272 -12.211   3.236
  175   3HB   ALA   3          3HB       ALA   3   4.842 -13.045   2.629
  176    H    GLN   4           H        GLN   4   6.702  -9.943   2.283
  177    HA   GLN   4           HA       GLN   4   4.161  -8.577   2.220
  178   1HB   GLN   4          1HB       GLN   4   6.140  -8.254   3.805
  179   2HB   GLN   4          2HB       GLN   4   6.939  -7.391   2.493
  180   1HG   GLN   4          1HG       GLN   4   5.160  -5.747   2.413
  181   2HG   GLN   4          2HG       GLN   4   4.218  -6.648   3.601
  182   1HE2  GLN   4          2HE2      GLN   4   5.517  -3.853   3.684
  183   2HE2  GLN   4          1HE2      GLN   4   6.415  -3.862   5.122
  184    H    THR   5           H        THR   5   7.189  -8.038   0.407
  185    HA   THR   5           HA       THR   5   6.268  -6.041  -1.369
  186    HB   THR   5           HB       THR   5   8.091  -8.421  -1.891
  187    HG1  THR   5           HG1      THR   5   9.705  -6.970  -1.273
  188   1HG2  THR   5          1HG2      THR   5   7.402  -5.957  -3.422
  189   2HG2  THR   5          2HG2      THR   5   9.081  -6.502  -3.453
  190   3HG2  THR   5          3HG2      THR   5   7.795  -7.573  -4.011
  191    H    ARG   6           H        ARG   6   5.783  -9.524  -1.331
  192    HA   ARG   6           HA       ARG   6   4.404  -9.740  -3.880
  193   1HB   ARG   6          1HB       ARG   6   5.201 -11.365  -1.621
  194   2HB   ARG   6          2HB       ARG   6   3.511 -11.690  -2.023
  195   1HG   ARG   6          1HG       ARG   6   4.237 -13.000  -3.713
  196   2HG   ARG   6          2HG       ARG   6   4.854 -11.550  -4.503
  197   1HD   ARG   6          1HD       ARG   6   6.852 -12.694  -4.342
  198   2HD   ARG   6          2HD       ARG   6   6.854 -11.997  -2.709
  199    HE   ARG   6           HE       ARG   6   6.370 -14.143  -1.854
  200   1HH1  ARG   6          1HH1      ARG   6   5.650 -13.964  -5.245
  201   2HH1  ARG   6          2HH1      ARG   6   5.278 -15.649  -5.375
  202   1HH2  ARG   6          1HH2      ARG   6   5.885 -16.330  -2.035
  203   2HH2  ARG   6          2HH2      ARG   6   5.410 -16.982  -3.567
  204    H    ARG   7           H        ARG   7   3.458  -9.489  -0.470
  205    HA   ARG   7           HA       ARG   7   0.660  -9.623  -0.799
  206   1HB   ARG   7          1HB       ARG   7   1.650  -9.773   1.364
  207   2HB   ARG   7          2HB       ARG   7   2.518  -8.256   1.151
  208   1HG   ARG   7          1HG       ARG   7   0.107  -7.216   0.947
  209   2HG   ARG   7          2HG       ARG   7  -0.391  -8.693   1.771
  210   1HD   ARG   7          1HD       ARG   7   0.259  -7.791   3.738
  211   2HD   ARG   7          2HD       ARG   7   1.918  -7.676   3.128
  212    HE   ARG   7           HE       ARG   7  -0.086  -5.499   3.068
  213   1HH1  ARG   7          1HH1      ARG   7   2.960  -6.758   1.979
  214   2HH1  ARG   7          2HH1      ARG   7   3.551  -5.211   1.502
  215   1HH2  ARG   7          1HH2      ARG   7   0.696  -3.503   2.444
  216   2HH2  ARG   7          2HH2      ARG   7   2.281  -3.374   1.760
  217    H    ARG   8           H        ARG   8   2.909  -6.935  -1.202
  218    HA   ARG   8           HA       ARG   8   1.083  -4.749  -1.362
  219   1HB   ARG   8          1HB       ARG   8   3.752  -5.070  -1.489
  220   2HB   ARG   8          2HB       ARG   8   3.438  -4.970  -3.218
  221   1HG   ARG   8          1HG       ARG   8   3.805  -2.727  -2.606
  222   2HG   ARG   8          2HG       ARG   8   2.047  -2.858  -2.621
  223   1HD   ARG   8          1HD       ARG   8   2.888  -1.704  -0.562
  224   2HD   ARG   8          2HD       ARG   8   2.043  -3.215  -0.176
  225    HE   ARG   8           HE       ARG   8   4.104  -4.125   0.519
  226   1HH1  ARG   8          1HH1      ARG   8   4.599  -1.361  -1.513
  227   2HH1  ARG   8          2HH1      ARG   8   6.315  -1.361  -1.291
  228   1HH2  ARG   8          1HH2      ARG   8   6.334  -4.115   0.802
  229   2HH2  ARG   8          2HH2      ARG   8   7.294  -2.909   0.012
  230    H    GLU   9           H        GLU   9   2.092  -7.127  -3.792
  231    HA   GLU   9           HA       GLU   9   0.673  -5.954  -5.995
  232   1HB   GLU   9          1HB       GLU   9   1.359  -8.837  -5.298
  233   2HB   GLU   9          2HB       GLU   9   0.815  -8.306  -6.890
  234   1HG   GLU   9          1HG       GLU   9   2.928  -6.572  -6.206
  235   2HG   GLU   9          2HG       GLU   9   3.472  -8.182  -5.740
  236    H    ARG  10           H        ARG  10  -0.203  -7.943  -3.276
  237    HA   ARG  10           HA       ARG  10  -2.931  -8.478  -4.150
  238   1HB   ARG  10          1HB       ARG  10  -1.098  -9.128  -1.986
  239   2HB   ARG  10          2HB       ARG  10  -2.678  -8.687  -1.343
  240   1HG   ARG  10          1HG       ARG  10  -3.771 -10.370  -2.669
  241   2HG   ARG  10          2HG       ARG  10  -2.295 -10.683  -3.583
  242   1HD   ARG  10          1HD       ARG  10  -1.412 -12.009  -1.937
  243   2HD   ARG  10          2HD       ARG  10  -2.032 -10.970  -0.639
  244    HE   ARG  10           HE       ARG  10  -3.442 -13.234  -1.822
  245   1HH1  ARG  10          1HH1      ARG  10  -3.754 -10.138  -0.279
  246   2HH1  ARG  10          2HH1      ARG  10  -5.341 -10.470   0.327
  247   1HH2  ARG  10          1HH2      ARG  10  -5.505 -13.652  -1.029
  248   2HH2  ARG  10          2HH2      ARG  10  -6.327 -12.447  -0.095
  249    H    ARG  11           H        ARG  11  -1.207  -5.829  -2.792
  250    HA   ARG  11           HA       ARG  11  -3.646  -4.621  -1.609
  251   1HB   ARG  11          1HB       ARG  11  -0.736  -3.775  -1.796
  252   2HB   ARG  11          2HB       ARG  11  -1.990  -2.858  -0.971
  253   1HG   ARG  11          1HG       ARG  11  -1.117  -5.679  -0.296
  254   2HG   ARG  11          2HG       ARG  11  -0.759  -4.233   0.642
  255   1HD   ARG  11          1HD       ARG  11  -2.776  -4.361   1.694
  256   2HD   ARG  11          2HD       ARG  11  -3.622  -4.455   0.144
  257    HE   ARG  11           HE       ARG  11  -2.273  -6.937   0.631
  258   1HH1  ARG  11          1HH1      ARG  11  -4.981  -5.037   1.682
  259   2HH1  ARG  11          2HH1      ARG  11  -5.910  -6.413   2.165
  260   1HH2  ARG  11          1HH2      ARG  11  -3.489  -8.718   1.262
  261   2HH2  ARG  11          2HH2      ARG  11  -5.071  -8.487   1.930
  262    H    ALA  12           H        ALA  12  -2.429  -4.906  -4.695
  263    HA   ALA  12           HA       ALA  12  -2.368  -2.255  -5.744
  264   1HB   ALA  12          1HB       ALA  12  -1.895  -4.484  -6.901
  265   2HB   ALA  12          2HB       ALA  12  -3.640  -4.710  -7.021
  266   3HB   ALA  12          3HB       ALA  12  -2.865  -3.361  -7.852
  267    H    GLU  13           H        GLU  13  -5.015  -4.243  -4.601
  268    HA   GLU  13           HA       GLU  13  -7.135  -2.580  -5.726
  269   1HB   GLU  13          1HB       GLU  13  -6.917  -4.802  -3.681
  270   2HB   GLU  13          2HB       GLU  13  -8.451  -3.989  -3.990
  271   1HG   GLU  13          1HG       GLU  13  -8.489  -4.694  -6.263
  272   2HG   GLU  13          2HG       GLU  13  -6.794  -5.182  -6.218
  273    H    LYS  14           H        LYS  14  -5.270  -2.782  -2.723
  274    HA   LYS  14           HA       LYS  14  -6.903  -0.770  -1.335
  275   1HB   LYS  14          1HB       LYS  14  -4.158  -1.989  -0.823
  276   2HB   LYS  14          2HB       LYS  14  -5.058  -1.006   0.335
  277   1HG   LYS  14          1HG       LYS  14  -6.272  -3.488  -0.865
  278   2HG   LYS  14          2HG       LYS  14  -5.228  -3.573   0.556
  279   1HD   LYS  14          1HD       LYS  14  -6.898  -1.524   1.255
  280   2HD   LYS  14          2HD       LYS  14  -7.985  -2.541   0.307
  281   1HE   LYS  14          1HE       LYS  14  -7.439  -4.486   1.698
  282   2HE   LYS  14          2HE       LYS  14  -6.271  -3.520   2.620
  283   1HZ   LYS  14          1HZ       LYS  14  -9.056  -2.593   2.295
  284   2HZ   LYS  14          2HZ       LYS  14  -8.667  -3.708   3.512
  285   3HZ   LYS  14          3HZ       LYS  14  -7.926  -2.179   3.495
  286    H    GLN  15           H        GLN  15  -3.968  -1.005  -3.197
  287    HA   GLN  15           HA       GLN  15  -3.019   1.701  -2.825
  288   1HB   GLN  15          1HB       GLN  15  -2.349  -0.801  -4.169
  289   2HB   GLN  15          2HB       GLN  15  -2.009   0.571  -5.207
  290   1HG   GLN  15          1HG       GLN  15  -0.420   1.450  -3.755
  291   2HG   GLN  15          2HG       GLN  15  -1.168   0.706  -2.342
  292   1HE2  GLN  15          2HE2      GLN  15  -1.243  -1.906  -2.702
  293   2HE2  GLN  15          1HE2      GLN  15   0.256  -2.573  -3.133
  294    H    ALA  16           H        ALA  16  -4.665  -0.018  -5.484
  295    HA   ALA  16           HA       ALA  16  -4.957   2.325  -7.150
  296   1HB   ALA  16          1HB       ALA  16  -5.089  -0.118  -7.821
  297   2HB   ALA  16          2HB       ALA  16  -6.671  -0.184  -7.045
  298   3HB   ALA  16          3HB       ALA  16  -6.415   0.865  -8.440
  299    H    GLN  17           H        GLN  17  -6.801   1.026  -4.441
  300    HA   GLN  17           HA       GLN  17  -9.143   2.725  -4.981
  301   1HB   GLN  17          1HB       GLN  17  -8.171   0.868  -2.813
  302   2HB   GLN  17          2HB       GLN  17  -9.540   1.929  -2.495
  303   1HG   GLN  17          1HG       GLN  17  -9.431   0.151  -4.936
  304   2HG   GLN  17          2HG       GLN  17 -10.099  -0.406  -3.402
  305   1HE2  GLN  17          2HE2      GLN  17 -11.373   0.380  -6.151
  306   2HE2  GLN  17          1HE2      GLN  17 -12.639   1.418  -5.703
  307    H    TRP  18           H        TRP  18  -6.231   2.739  -3.037
  308    HA   TRP  18           HA       TRP  18  -6.831   5.207  -1.593
  309   1HB   TRP  18          1HB       TRP  18  -5.317   3.489  -0.695
  310   2HB   TRP  18          2HB       TRP  18  -4.325   3.578  -2.137
  311    HD1  TRP  18           HD1      TRP  18  -4.961   5.398   1.127
  312    HE1  TRP  18           HE1      TRP  18  -3.274   7.349   1.313
  313    HE3  TRP  18           HE3      TRP  18  -2.937   5.250  -3.495
  314    HZ2  TRP  18           HZ2      TRP  18  -1.307   8.645  -0.297
  315    HZ3  TRP  18           HZ3      TRP  18  -1.175   6.808  -4.156
  316    HH2  TRP  18           HH2      TRP  18  -0.349   8.494  -2.591
  317    H    LYS  19           H        LYS  19  -4.733   4.230  -4.258
  318    HA   LYS  19           HA       LYS  19  -3.600   6.754  -4.898
  319   1HB   LYS  19          1HB       LYS  19  -4.212   4.229  -6.456
  320   2HB   LYS  19          2HB       LYS  19  -3.385   5.595  -7.187
  321   1HG   LYS  19          1HG       LYS  19  -1.674   5.479  -5.363
  322   2HG   LYS  19          2HG       LYS  19  -2.446   4.000  -4.798
  323   1HD   LYS  19          1HD       LYS  19  -1.913   2.828  -6.791
  324   2HD   LYS  19          2HD       LYS  19  -1.519   4.315  -7.653
  325   1HE   LYS  19          1HE       LYS  19   0.633   4.202  -6.954
  326   2HE   LYS  19          2HE       LYS  19   0.116   4.070  -5.261
  327   1HZ   LYS  19          1HZ       LYS  19  -0.472   1.716  -5.751
  328   2HZ   LYS  19          2HZ       LYS  19   0.285   1.883  -7.263
  329   3HZ   LYS  19          3HZ       LYS  19   1.191   2.039  -5.834
  330    H    ALA  20           H        ALA  20  -6.618   5.177  -5.800
  331    HA   ALA  20           HA       ALA  20  -7.437   6.968  -7.835
  332   1HB   ALA  20          1HB       ALA  20  -8.620   4.998  -5.993
  333   2HB   ALA  20          2HB       ALA  20  -9.750   6.214  -6.588
  334   3HB   ALA  20          3HB       ALA  20  -8.868   5.196  -7.728
  335    H    ALA  21           H        ALA  21  -7.497   7.203  -4.330
  336    HA   ALA  21           HA       ALA  21  -8.714   9.922  -4.575
  337   1HB   ALA  21          1HB       ALA  21  -9.606   7.691  -3.198
  338   2HB   ALA  21          2HB       ALA  21  -8.778   8.618  -1.946
  339   3HB   ALA  21          3HB       ALA  21 -10.099   9.349  -2.858
  340    H    ASN  22           H        ASN  22  -5.884   9.047  -4.707
  341    HA   ASN  22           HA       ASN  22  -4.822  11.047  -2.815
  342   1HB   ASN  22          1HB       ASN  22  -4.055   8.117  -2.761
  343   2HB   ASN  22          2HB       ASN  22  -3.157   9.390  -1.939
  344   1HD2  ASN  22          2HD2      ASN  22  -5.488   7.105  -1.394
  345   2HD2  ASN  22          1HD2      ASN  22  -6.305   7.827  -0.094
  346    HA   PRO  23           HA       PRO  23  -2.598  10.392  -6.925
  347   1HB   PRO  23          1HB       PRO  23  -3.471  12.676  -8.168
  348   2HB   PRO  23          2HB       PRO  23  -4.302  11.116  -8.329
  349   1HG   PRO  23          1HG       PRO  23  -4.975  13.448  -6.612
  350   2HG   PRO  23          2HG       PRO  23  -6.046  12.350  -7.497
  351   1HD   PRO  23          1HD       PRO  23  -5.590  12.172  -4.814
  352   2HD   PRO  23          2HD       PRO  23  -6.028  10.779  -5.818
  353    H    LEU  24           H        LEU  24  -3.398  13.059  -4.817
  354    HA   LEU  24           HA       LEU  24  -1.253  14.854  -5.273
  355   1HB   LEU  24          1HB       LEU  24  -2.037  15.817  -3.289
  356   2HB   LEU  24          2HB       LEU  24  -3.417  14.812  -3.709
  357    HG   LEU  24           HG       LEU  24  -1.200  13.815  -1.895
  358   1HD1  LEU  24          1HD1      LEU  24  -3.554  15.563  -1.310
  359   2HD1  LEU  24          2HD1      LEU  24  -3.101  14.333  -0.129
  360   3HD1  LEU  24          3HD1      LEU  24  -1.942  15.577  -0.596
  361   1HD2  LEU  24          1HD2      LEU  24  -3.256  12.453  -3.107
  362   2HD2  LEU  24          2HD2      LEU  24  -2.518  11.965  -1.583
  363   3HD2  LEU  24          3HD2      LEU  24  -4.005  12.916  -1.583
  364    H    LEU  25           H        LEU  25  -1.432  11.856  -3.468
  365    HA   LEU  25           HA       LEU  25   1.450  12.041  -2.727
  366   1HB   LEU  25          1HB       LEU  25  -1.036  10.680  -1.742
  367   2HB   LEU  25          2HB       LEU  25   0.509   9.876  -1.441
  368    HG   LEU  25           HG       LEU  25   0.384  12.785  -0.826
  369   1HD1  LEU  25          1HD1      LEU  25  -1.265  10.688   0.528
  370   2HD1  LEU  25          2HD1      LEU  25  -0.484  11.907   1.534
  371   3HD1  LEU  25          3HD1      LEU  25  -1.617  12.397   0.273
  372   1HD2  LEU  25          1HD2      LEU  25   2.410  11.365  -0.490
  373   2HD2  LEU  25          2HD2      LEU  25   1.832  12.078   1.016
  374   3HD2  LEU  25          3HD2      LEU  25   1.500  10.384   0.658
  375    H    VAL  26           H        VAL  26   0.442  11.559  -5.394
  376    HA   VAL  26           HA       VAL  26   1.520   8.818  -5.846
  377    HB   VAL  26           HB       VAL  26  -1.160   9.864  -6.100
  378   1HG1  VAL  26          1HG1      VAL  26   0.141   8.922  -8.665
  379   2HG1  VAL  26          2HG1      VAL  26  -1.602   8.885  -8.398
  380   3HG1  VAL  26          3HG1      VAL  26  -0.742  10.424  -8.385
  381   1HG2  VAL  26          1HG2      VAL  26   0.089   7.493  -5.491
  382   2HG2  VAL  26          2HG2      VAL  26  -1.645   7.685  -5.744
  383   3HG2  VAL  26          3HG2      VAL  26  -0.614   7.140  -7.070
  384    H    GLY  27           H        GLY  27   3.267   9.046  -7.125
  385   1HA   GLY  27          1HA       GLY  27   4.690   9.804  -8.817
  386   2HA   GLY  27          2HA       GLY  27   3.233  10.223  -9.707
  387    H    VAL  28           H        VAL  28   3.425  11.732  -6.676
  388    HA   VAL  28           HA       VAL  28   3.660  14.008  -6.084
  389    HB   VAL  28           HB       VAL  28   5.948  13.754  -8.066
  390   1HG1  VAL  28          1HG1      VAL  28   5.325  15.577  -5.749
  391   2HG1  VAL  28          2HG1      VAL  28   6.995  15.276  -6.230
  392   3HG1  VAL  28          3HG1      VAL  28   5.866  16.000  -7.374
  393   1HG2  VAL  28          1HG2      VAL  28   5.656  12.837  -5.194
  394   2HG2  VAL  28          2HG2      VAL  28   6.118  11.870  -6.596
  395   3HG2  VAL  28          3HG2      VAL  28   7.228  13.082  -5.955
  396    H    SER  29           H        SER  29   3.819  16.304  -7.068
  397    HA   SER  29           HA       SER  29   2.798  17.904  -8.473
  398   1HB   SER  29          1HB       SER  29   4.652  16.297  -9.847
  399   2HB   SER  29          2HB       SER  29   3.272  16.432 -10.933
  400    HG   SER  29           HG       SER  29   4.213  18.284 -11.363
  401    H    ALA  30           H        ALA  30   0.885  16.236  -7.404
  402    HA   ALA  30           HA       ALA  30  -1.025  15.955  -9.684
  403   1HB   ALA  30          1HB       ALA  30   0.127  13.907  -7.966
  404   2HB   ALA  30          2HB       ALA  30  -1.629  13.941  -7.809
  405   3HB   ALA  30          3HB       ALA  30  -0.891  13.708  -9.392
  406    H    LYS  31           H        LYS  31  -0.833  18.141  -7.940
  407    HA   LYS  31           HA       LYS  31  -3.524  18.345  -6.929
  408   1HB   LYS  31          1HB       LYS  31  -2.936  18.357  -4.501
  409   2HB   LYS  31          2HB       LYS  31  -2.631  16.790  -5.246
  410   1HG   LYS  31          1HG       LYS  31  -0.387  16.941  -4.930
  411   2HG   LYS  31          2HG       LYS  31  -0.344  18.641  -5.394
  412   1HD   LYS  31          1HD       LYS  31  -0.458  19.342  -3.243
  413   2HD   LYS  31          2HD       LYS  31  -1.733  18.188  -2.850
  414   1HE   LYS  31          1HE       LYS  31   0.241  17.616  -1.536
  415   2HE   LYS  31          2HE       LYS  31   0.053  16.380  -2.796
  416   1HZ   LYS  31          1HZ       LYS  31   1.747  18.813  -3.010
  417   2HZ   LYS  31          2HZ       LYS  31   2.324  17.241  -2.738
  418   3HZ   LYS  31          3HZ       LYS  31   1.562  17.622  -4.208
  419    HA   PRO  32           HA       PRO  32  -2.339  22.586  -6.977
  420   1HB   PRO  32          1HB       PRO  32  -4.042  23.670  -5.130
  421   2HB   PRO  32          2HB       PRO  32  -4.579  23.121  -6.731
  422   1HG   PRO  32          1HG       PRO  32  -4.815  21.771  -4.090
  423   2HG   PRO  32          2HG       PRO  32  -5.960  21.824  -5.438
  424   1HD   PRO  32          1HD       PRO  32  -4.350  19.685  -4.902
  425   2HD   PRO  32          2HD       PRO  32  -4.966  20.074  -6.522
  426    H    VAL  33           H        VAL  33  -1.660  24.431  -5.365
  427    HA   VAL  33           HA       VAL  33   0.351  23.348  -3.557
  428    HB   VAL  33           HB       VAL  33   0.880  25.722  -3.233
  429   1HG1  VAL  33          1HG1      VAL  33   1.084  24.384  -5.574
  430   2HG1  VAL  33          2HG1      VAL  33   0.084  25.740  -6.098
  431   3HG1  VAL  33          3HG1      VAL  33   1.660  26.037  -5.364
  432   1HG2  VAL  33          1HG2      VAL  33  -1.932  26.013  -4.146
  433   2HG2  VAL  33          2HG2      VAL  33  -1.007  27.003  -3.016
  434   3HG2  VAL  33          3HG2      VAL  33  -0.800  27.221  -4.755
  435    H    ASN  34           H        ASN  34  -2.966  24.292  -3.214
  436    HA   ASN  34           HA       ASN  34  -4.358  24.474  -1.312
  437   1HB   ASN  34          1HB       ASN  34  -2.628  22.309  -1.045
  438   2HB   ASN  34          2HB       ASN  34  -2.436  23.166   0.483
  439   1HD2  ASN  34          2HD2      ASN  34  -4.114  20.650  -0.641
  440   2HD2  ASN  34          1HD2      ASN  34  -5.594  20.851   0.164
  441    H    ARG  35           H        ARG  35  -4.155  25.200   1.177
  442    HA   ARG  35           HA       ARG  35  -3.673  27.058   2.550
  443   1HB   ARG  35          1HB       ARG  35  -1.535  26.783   3.397
  444   2HB   ARG  35          2HB       ARG  35  -1.667  25.301   2.464
  445   1HG   ARG  35          1HG       ARG  35  -0.312  26.140   0.715
  446   2HG   ARG  35          2HG       ARG  35  -0.499  27.809   1.245
  447   1HD   ARG  35          1HD       ARG  35   0.628  26.147   3.357
  448   2HD   ARG  35          2HD       ARG  35   1.628  26.122   1.894
  449    HE   ARG  35           HE       ARG  35   1.401  28.678   1.940
  450   1HH1  ARG  35          1HH1      ARG  35   1.140  26.734   4.818
  451   2HH1  ARG  35          2HH1      ARG  35   1.628  28.020   5.863
  452   1HH2  ARG  35          1HH2      ARG  35   2.032  30.329   3.319
  453   2HH2  ARG  35          2HH2      ARG  35   2.131  30.039   5.025
  454    HA   PRO  36           HA       PRO  36  -2.954  30.790   0.328
  455   1HB   PRO  36          1HB       PRO  36  -0.970  32.197   1.585
  456   2HB   PRO  36          2HB       PRO  36  -2.593  31.994   2.272
  457   1HG   PRO  36          1HG       PRO  36  -0.075  30.543   2.909
  458   2HG   PRO  36          2HG       PRO  36  -1.358  31.106   3.993
  459   1HD   PRO  36          1HD       PRO  36  -1.098  28.527   3.190
  460   2HD   PRO  36          2HD       PRO  36  -2.660  29.257   3.619
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1  12.252 -16.403   1.962
    2   2H5*    G   1          2H5*        G   1  13.144 -17.939   2.061
    3    H4*    G   1           H4*        G   1  10.873 -19.104   2.053
    4    H3*    G   1           H3*        G   1   9.986 -16.233   2.509
    5    H2*    G   1           H2*        G   1   8.352 -17.024   4.030
    6   2HO*    G   1          2HO*        G   1   7.433 -18.898   3.816
    7    H1*    G   1           H1*        G   1   9.972 -18.998   5.138
    8    H8     G   1           H8         G   1  11.944 -15.821   4.747
    9    H1     G   1           H1         G   1   7.761 -15.687   9.621
   10   1H2     G   1          1H2         G   1   6.106 -17.285   9.103
   11   2H2     G   1          2H2         G   1   6.880 -18.794   8.679
   12   1H5*    C   2          1H5*        C   2   6.136 -16.752   1.018
   13   2H5*    C   2          2H5*        C   2   7.237 -16.634   2.408
   14    H4*    C   2           H4*        C   2   4.668 -18.103   2.816
   15    H3*    C   2           H3*        C   2   4.869 -15.105   2.398
   16    H2*    C   2           H2*        C   2   3.437 -14.740   4.230
   17   2HO*    C   2          2HO*        C   2   2.229 -16.448   5.164
   18    H1*    C   2           H1*        C   2   4.379 -16.831   5.817
   19   1H4     C   2          1H4         C   2   7.144 -11.667   8.217
   20   2H4     C   2          2H4         C   2   8.344 -11.680   6.948
   21    H5     C   2           H5         C   2   7.969 -12.954   4.884
   22    H6     C   2           H6         C   2   7.031 -15.074   4.074
   23   1H5*    C   3          1H5*        C   3   0.063 -13.181   1.399
   24   2H5*    C   3          2H5*        C   3   1.721 -12.848   1.944
   25    H4*    C   3           H4*        C   3  -0.274 -14.312   3.680
   26    H3*    C   3           H3*        C   3   0.213 -11.340   3.395
   27    H2*    C   3           H2*        C   3   0.018 -11.079   5.724
   28   2HO*    C   3          2HO*        C   3  -1.226 -12.265   6.908
   29    H1*    C   3           H1*        C   3   1.314 -13.448   6.399
   30   1H4     C   3          1H4         C   3   5.323  -8.430   6.834
   31   2H4     C   3          2H4         C   3   6.199  -9.150   5.500
   32    H5     C   3           H5         C   3   4.928 -10.532   3.888
   33    H6     C   3           H6         C   3   3.199 -12.224   3.720
   34   1H5*    C   4          1H5*        C   4  -3.897 -10.204   4.838
   35   2H5*    C   4          2H5*        C   4  -2.127 -10.262   4.756
   36    H4*    C   4           H4*        C   4  -3.654 -10.112   7.363
   37    H3*    C   4           H3*        C   4  -2.682  -7.875   5.554
   38    H2*    C   4           H2*        C   4  -1.919  -6.681   7.421
   39   2HO*    C   4          2HO*        C   4  -4.016  -7.801   8.620
   40    H1*    C   4           H1*        C   4  -1.076  -8.868   8.917
   41   1H4     C   4          1H4         C   4   3.809  -6.014   5.773
   42   2H4     C   4          2H4         C   4   4.252  -7.667   5.429
   43    H5     C   4           H5         C   4   1.879  -8.595   4.544
   44    H6     C   4           H6         C   4  -0.173  -9.305   5.481
   45   1H5*    U   5          1H5*        U   5  -4.753  -6.017   8.514
   46   2H5*    U   5          2H5*        U   5  -5.954  -4.859   7.901
   47    H4*    U   5           H4*        U   5  -4.579  -3.669   9.439
   48    H3*    U   5           H3*        U   5  -3.784  -3.079   6.571
   49    H2*    U   5           H2*        U   5  -2.181  -1.561   7.405
   50   2HO*    U   5          2HO*        U   5  -3.553  -1.688   9.901
   51    H1*    U   5           H1*        U   5  -1.626  -3.024   9.749
   52    H3     U   5           H3         U   5   2.262  -2.412   7.516
   53    H5     U   5           H5         U   5   0.341  -5.462   5.402
   54    H6     U   5           H6         U   5  -1.632  -4.986   6.677
   55   1H5*    G   6          1H5*        G   6  -1.901   0.257   8.049
   56   2H5*    G   6          2H5*        G   6  -3.190   1.472   8.208
   57    H4*    G   6           H4*        G   6  -2.120   2.726   6.688
   58    H3*    G   6           H3*        G   6  -2.702   0.344   4.902
   59    H2*    G   6           H2*        G   6  -1.231   1.194   3.282
   60   2HO*    G   6          2HO*        G   6  -1.256   3.251   2.920
   61    H1*    G   6           H1*        G   6   0.654   2.243   5.057
   62    H8     G   6           H8         G   6  -1.023  -1.248   5.235
   63    H1     G   6           H1         G   6   4.968  -1.125   2.901
   64   1H2     G   6          1H2         G   6   5.557   1.006   2.491
   65   2H2     G   6          2H2         G   6   4.813   2.266   3.458
   66   1H5*    A   7          1H5*        A   7  -4.633   1.901   0.682
   67   2H5*    A   7          2H5*        A   7  -3.672   0.411   0.742
   68    H4*    A   7           H4*        A   7  -2.844   1.800  -1.058
   69    H3*    A   7           H3*        A   7  -1.035   1.810   1.383
   70    H2*    A   7           H2*        A   7   0.456   3.207   0.183
   71   2HO*    A   7          2HO*        A   7   0.806   2.842  -1.840
   72    H1*    A   7           H1*        A   7  -1.531   4.548  -1.255
   73    H8     A   7           H8         A   7  -2.543   4.807   2.287
   74   1H6     A   7          1H6         A   7   1.908   8.996   3.165
   75   2H6     A   7          2H6         A   7   0.279   8.574   3.643
   76    H2     A   7           H2         A   7   2.460   7.214  -0.935
   77   1H5*    A   8          1H5*        A   8   0.958   0.578  -1.593
   78   2H5*    A   8          2H5*        A   8   2.247  -0.644  -1.669
   79    H4*    A   8           H4*        A   8   3.249   1.494  -2.081
   80    H3*    A   8           H3*        A   8   3.724   0.512   0.750
   81    H2*    A   8           H2*        A   8   5.064   2.428   1.154
   82   2HO*    A   8          2HO*        A   8   5.939   3.644  -0.428
   83    H1*    A   8           H1*        A   8   3.445   4.180  -0.322
   84    H8     A   8           H8         A   8   1.224   1.990   1.745
   85   1H6     A   8          1H6         A   8   1.838   4.244   6.205
   86   2H6     A   8          2H6         A   8   1.890   5.992   6.257
   87    H2     A   8           H2         A   8   5.261   6.763   3.247
   88   1H5*    A   9          2H5*        A   9   8.351  -1.144  -1.907
   89   2H5*    A   9          1H5*        A   9   7.351  -0.143  -0.835
   90    H4*    A   9           H4*        A   9   9.509   0.706  -2.423
   91    H3*    A   9           H3*        A   9   7.290   2.193  -0.992
   92    H2*    A   9           H2*        A   9   8.072   4.207  -1.957
   93   2HO*    A   9          2HO*        A   9  10.078   4.209  -3.142
   94    H1*    A   9           H1*        A   9   8.693   3.086  -4.440
   95    H8     A   9           H8         A   9   6.288   4.579  -2.153
   96   1H6     A   9          1H6         A   9   2.113   4.469  -4.909
   97   2H6     A   9          2H6         A   9   2.173   4.672  -6.646
   98    H2     A   9           H2         A   9   5.353   1.584  -7.750
   99   1H5*    A  10          1H5*        A  10   9.911   1.288   4.082
  100   2H5*    A  10          2H5*        A  10   8.243   1.625   3.577
  101    H4*    A  10           H4*        A  10  10.160   3.920   3.741
  102    H3*    A  10           H3*        A  10   8.992   2.423   6.088
  103    H2*    A  10           H2*        A  10   8.398   4.430   7.154
  104   2HO*    A  10          2HO*        A  10  10.358   5.539   6.848
  105    H1*    A  10           H1*        A  10   7.640   5.823   4.865
  106    H8     A  10           H8         A  10   6.055   2.762   4.032
  107   1H6     A  10          1H6         A  10   1.671   3.719   7.518
  108   2H6     A  10          2H6         A  10   2.547   2.382   8.228
  109    H2     A  10           H2         A  10   5.353   6.275   9.357
  110   1H5*    A  11          1H5*        A  11   9.978   4.713   8.651
  111   2H5*    A  11          2H5*        A  11  10.709   3.782   9.979
  112    H4*    A  11           H4*        A  11   8.382   4.678  10.438
  113    H3*    A  11           H3*        A  11   8.967   1.710  10.551
  114    H2*    A  11           H2*        A  11   6.710   1.274  11.084
  115   2HO*    A  11          2HO*        A  11   5.481   2.629  12.141
  116    H1*    A  11           H1*        A  11   5.588   3.230   9.477
  117    H8     A  11           H8         A  11   8.330   1.471   7.588
  118   1H6     A  11          1H6         A  11   4.466  -3.066   6.395
  119   2H6     A  11          2H6         A  11   5.292  -1.931   5.354
  120    H2     A  11           H2         A  11   2.343  -0.186   9.236
  121   1H5*    G  12          1H5*        G  12   9.219  -1.214  13.368
  122   2H5*    G  12          2H5*        G  12   9.010  -0.319  11.853
  123    H4*    G  12           H4*        G  12   6.872   0.265  13.742
  124    H3*    G  12           H3*        G  12   7.357  -2.622  12.996
  125    H2*    G  12           H2*        G  12   5.035  -2.875  12.577
  126   2HO*    G  12          2HO*        G  12   4.829  -0.969  14.473
  127    H1*    G  12           H1*        G  12   4.659  -0.353  11.430
  128    H8     G  12           H8         G  12   7.611  -1.182   9.639
  129    H1     G  12           H1         G  12   2.966  -5.383   8.207
  130   1H2     G  12          1H2         G  12   1.244  -5.083   9.593
  131   2H2     G  12          2H2         G  12   1.555  -4.433  11.187
  132   1H5*    G  13          1H5*        G  13   4.439  -3.060  15.850
  133   2H5*    G  13          2H5*        G  13   4.944  -4.070  17.222
  134    H4*    G  13           H4*        G  13   2.885  -4.971  16.419
  135    H3*    G  13           H3*        G  13   5.275  -6.528  15.434
  136    H2*    G  13           H2*        G  13   3.860  -7.960  14.254
  137   2HO*    G  13          2HO*        G  13   1.590  -7.996  14.588
  138    H1*    G  13           H1*        G  13   1.983  -6.057  13.490
  139    H8     G  13           H8         G  13   5.417  -4.683  12.900
  140    H1     G  13           H1         G  13   3.594  -8.995   8.496
  141   1H2     G  13          1H2         G  13   1.932 -10.247   9.362
  142   2H2     G  13          2H2         G  13   0.846  -9.466  10.489
  143   1H5*    G  14          1H5*        G  14   3.616 -10.098  18.282
  144   2H5*    G  14          2H5*        G  14   4.002  -9.215  16.797
  145    H4*    G  14           H4*        G  14   1.541 -10.953  16.984
  146    H3*    G  14           H3*        G  14   4.388 -11.804  16.413
  147    H2*    G  14           H2*        G  14   3.617 -13.195  14.671
  148   2HO*    G  14          2HO*        G  14   1.010 -13.015  14.665
  149    H1*    G  14           H1*        G  14   1.622 -11.481  13.764
  150    H8     G  14           H8         G  14   4.625  -9.387  14.420
  151    H1     G  14           H1         G  14   5.129 -12.898   9.046
  152   1H2     G  14          1H2         G  14   3.196 -14.126   8.850
  153   2H2     G  14          2H2         G  14   2.665 -14.822  10.364
  154   1H5*    C  15          1H5*        C  15   2.101 -14.998  16.465
  155   2H5*    C  15          2H5*        C  15   2.580 -16.372  17.490
  156    H4*    C  15           H4*        C  15   2.173 -17.258  15.296
  157    H3*    C  15           H3*        C  15   5.134 -16.909  15.857
  158    H2*    C  15           H2*        C  15   5.589 -17.850  13.745
  159   2HO*    C  15          2HO*        C  15   4.384 -19.662  13.644
  160    H1*    C  15           H1*        C  15   3.308 -16.789  12.475
  161   1H4     C  15          1H4         C  15   8.310 -13.535  10.324
  162   2H4     C  15          2H4         C  15   8.517 -12.743  11.874
  163    H5     C  15           H5         C  15   6.847 -12.991  13.648
  164    H6     C  15           H6         C  15   5.014 -14.325  14.451
  165   2H    ASP   2          2H        ASP   2   9.915 -10.113  -1.287
  166   1H    ASP   2          1H        ASP   2   9.706 -11.699  -1.852
  167   3H    ASP   2          3H        ASP   2  11.171 -11.245  -1.122
  168    HA   ASP   2           HA       ASP   2  10.057 -12.436   0.553
  169   1HB   ASP   2          1HB       ASP   2   9.373  -9.509   0.943
  170   2HB   ASP   2          2HB       ASP   2   9.762 -10.687   2.194
  171    H    ALA   3           H        ALA   3   7.924 -11.531   2.113
  172    HA   ALA   3           HA       ALA   3   5.618 -12.324   0.403
  173   1HB   ALA   3          1HB       ALA   3   6.189 -13.594   2.458
  174   2HB   ALA   3          2HB       ALA   3   5.965 -12.127   3.410
  175   3HB   ALA   3          3HB       ALA   3   4.592 -12.855   2.578
  176    H    GLN   4           H        GLN   4   6.780  -9.681   2.431
  177    HA   GLN   4           HA       GLN   4   4.261  -8.234   2.469
  178   1HB   GLN   4          1HB       GLN   4   6.250  -8.064   4.074
  179   2HB   GLN   4          2HB       GLN   4   7.090  -7.182   2.802
  180   1HG   GLN   4          1HG       GLN   4   4.418  -6.111   3.248
  181   2HG   GLN   4          2HG       GLN   4   5.379  -6.085   4.723
  182   1HE2  GLN   4          2HE2      GLN   4   4.717  -4.287   1.966
  183   2HE2  GLN   4          1HE2      GLN   4   6.126  -3.342   1.922
  184    H    THR   5           H        THR   5   7.336  -7.612   0.758
  185    HA   THR   5           HA       THR   5   6.402  -5.603  -1.015
  186    HB   THR   5           HB       THR   5   8.392  -7.879  -1.382
  187    HG1  THR   5           HG1      THR   5   8.914  -6.464   0.281
  188   1HG2  THR   5          1HG2      THR   5   7.855  -5.407  -3.037
  189   2HG2  THR   5          2HG2      THR   5   9.383  -6.286  -3.111
  190   3HG2  THR   5          3HG2      THR   5   7.881  -7.087  -3.574
  191    H    ARG   6           H        ARG   6   5.988  -9.073  -0.953
  192    HA   ARG   6           HA       ARG   6   4.836  -9.380  -3.599
  193   1HB   ARG   6          1HB       ARG   6   5.425 -10.932  -1.196
  194   2HB   ARG   6          2HB       ARG   6   3.859 -11.369  -1.892
  195   1HG   ARG   6          1HG       ARG   6   5.370 -11.243  -4.151
  196   2HG   ARG   6          2HG       ARG   6   6.597 -11.752  -2.990
  197   1HD   ARG   6          1HD       ARG   6   3.956 -13.158  -2.898
  198   2HD   ARG   6          2HD       ARG   6   5.064 -13.556  -4.225
  199    HE   ARG   6           HE       ARG   6   5.486 -14.207  -1.426
  200   1HH1  ARG   6          1HH1      ARG   6   7.036 -13.316  -4.401
  201   2HH1  ARG   6          2HH1      ARG   6   8.539 -14.063  -3.979
  202   1HH2  ARG   6          1HH2      ARG   6   7.444 -15.174  -0.887
  203   2HH2  ARG   6          2HH2      ARG   6   8.770 -15.110  -2.000
  204    H    ARG   7           H        ARG   7   3.548  -9.136  -0.272
  205    HA   ARG   7           HA       ARG   7   0.816  -9.370  -0.987
  206   1HB   ARG   7          1HB       ARG   7   1.551  -9.537   1.307
  207   2HB   ARG   7          2HB       ARG   7   2.251  -7.917   1.257
  208   1HG   ARG   7          1HG       ARG   7  -0.088  -7.031   0.803
  209   2HG   ARG   7          2HG       ARG   7  -0.690  -8.652   1.146
  210   1HD   ARG   7          1HD       ARG   7  -0.256  -8.475   3.399
  211   2HD   ARG   7          2HD       ARG   7   1.144  -7.418   3.159
  212    HE   ARG   7           HE       ARG   7  -0.330  -5.567   3.154
  213   1HH1  ARG   7          1HH1      ARG   7  -2.061  -8.533   2.690
  214   2HH1  ARG   7          2HH1      ARG   7  -3.609  -7.772   2.798
  215   1HH2  ARG   7          2HH2      ARG   7  -2.310  -4.592   3.301
  216   2HH2  ARG   7          1HH2      ARG   7  -3.751  -5.534   3.139
  217    H    ARG   8           H        ARG   8   3.031  -6.639  -1.019
  218    HA   ARG   8           HA       ARG   8   1.243  -4.464  -1.329
  219   1HB   ARG   8          1HB       ARG   8   3.964  -4.927  -1.344
  220   2HB   ARG   8          2HB       ARG   8   3.681  -4.510  -3.027
  221   1HG   ARG   8          1HG       ARG   8   4.237  -2.532  -1.599
  222   2HG   ARG   8          2HG       ARG   8   2.676  -2.396  -2.400
  223   1HD   ARG   8          1HD       ARG   8   2.932  -1.845   0.204
  224   2HD   ARG   8          2HD       ARG   8   1.484  -2.657  -0.410
  225    HE   ARG   8           HE       ARG   8   3.655  -4.492   0.300
  226   1HH1  ARG   8          1HH1      ARG   8   0.850  -2.774   1.390
  227   2HH1  ARG   8          2HH1      ARG   8   0.533  -3.876   2.679
  228   1HH2  ARG   8          1HH2      ARG   8   3.231  -5.917   1.968
  229   2HH2  ARG   8          2HH2      ARG   8   1.876  -5.645   3.011
  230    H    GLU   9           H        GLU   9   2.508  -6.754  -3.716
  231    HA   GLU   9           HA       GLU   9   1.273  -5.543  -6.010
  232   1HB   GLU   9          1HB       GLU   9   1.898  -8.455  -5.377
  233   2HB   GLU   9          2HB       GLU   9   1.619  -7.805  -6.993
  234   1HG   GLU   9          1HG       GLU   9   3.653  -6.299  -5.522
  235   2HG   GLU   9          2HG       GLU   9   4.087  -7.996  -5.725
  236    H    ARG  10           H        ARG  10   0.192  -7.682  -3.473
  237    HA   ARG  10           HA       ARG  10  -2.436  -8.177  -4.639
  238   1HB   ARG  10          1HB       ARG  10  -0.795  -9.060  -2.441
  239   2HB   ARG  10          2HB       ARG  10  -2.370  -8.573  -1.816
  240   1HG   ARG  10          1HG       ARG  10  -3.436 -10.316  -2.808
  241   2HG   ARG  10          2HG       ARG  10  -2.506 -10.155  -4.298
  242   1HD   ARG  10          1HD       ARG  10  -0.523 -11.132  -2.931
  243   2HD   ARG  10          2HD       ARG  10  -1.769 -11.658  -1.782
  244    HE   ARG  10           HE       ARG  10  -1.360 -12.740  -4.461
  245   1HH1  ARG  10          1HH1      ARG  10  -3.674 -12.073  -1.956
  246   2HH1  ARG  10          2HH1      ARG  10  -4.768 -13.307  -2.478
  247   1HH2  ARG  10          1HH2      ARG  10  -2.791 -14.340  -5.126
  248   2HH2  ARG  10          2HH2      ARG  10  -4.272 -14.584  -4.263
  249    H    ARG  11           H        ARG  11  -0.873  -5.606  -2.993
  250    HA   ARG  11           HA       ARG  11  -3.418  -4.517  -1.924
  251   1HB   ARG  11          1HB       ARG  11  -0.520  -3.623  -1.828
  252   2HB   ARG  11          2HB       ARG  11  -1.855  -2.758  -1.066
  253   1HG   ARG  11          1HG       ARG  11  -0.945  -5.586  -0.436
  254   2HG   ARG  11          2HG       ARG  11  -0.784  -4.188   0.609
  255   1HD   ARG  11          1HD       ARG  11  -2.871  -4.528   1.418
  256   2HD   ARG  11          2HD       ARG  11  -3.550  -4.469  -0.212
  257    HE   ARG  11           HE       ARG  11  -2.124  -6.957   0.319
  258   1HH1  ARG  11          1HH1      ARG  11  -5.141  -5.262   0.624
  259   2HH1  ARG  11          2HH1      ARG  11  -6.082  -6.711   0.682
  260   1HH2  ARG  11          1HH2      ARG  11  -3.359  -8.830   0.397
  261   2HH2  ARG  11          2HH2      ARG  11  -5.081  -8.721   0.555
  262    H    ALA  12           H        ALA  12  -1.965  -4.596  -4.915
  263    HA   ALA  12           HA       ALA  12  -1.919  -1.892  -5.815
  264   1HB   ALA  12          1HB       ALA  12  -1.241  -3.933  -7.103
  265   2HB   ALA  12          2HB       ALA  12  -2.939  -4.393  -7.232
  266   3HB   ALA  12          3HB       ALA  12  -2.361  -2.926  -8.022
  267    H    GLU  13           H        GLU  13  -4.562  -4.027  -4.965
  268    HA   GLU  13           HA       GLU  13  -6.679  -2.410  -6.141
  269   1HB   GLU  13          1HB       GLU  13  -6.606  -4.553  -3.986
  270   2HB   GLU  13          2HB       GLU  13  -8.087  -3.922  -4.706
  271   1HG   GLU  13          1HG       GLU  13  -7.512  -4.776  -6.865
  272   2HG   GLU  13          2HG       GLU  13  -5.862  -5.137  -6.357
  273    H    LYS  14           H        LYS  14  -5.014  -2.650  -3.018
  274    HA   LYS  14           HA       LYS  14  -6.771  -0.725  -1.677
  275   1HB   LYS  14          1HB       LYS  14  -4.016  -1.898  -1.115
  276   2HB   LYS  14          2HB       LYS  14  -4.892  -0.870   0.023
  277   1HG   LYS  14          1HG       LYS  14  -6.086  -3.401  -1.121
  278   2HG   LYS  14          2HG       LYS  14  -5.143  -3.386   0.370
  279   1HD   LYS  14          1HD       LYS  14  -6.763  -2.268   1.551
  280   2HD   LYS  14          2HD       LYS  14  -7.313  -1.362   0.141
  281   1HE   LYS  14          1HE       LYS  14  -8.006  -3.880  -0.622
  282   2HE   LYS  14          2HE       LYS  14  -8.207  -4.009   1.137
  283   1HZ   LYS  14          1HZ       LYS  14  -9.230  -1.712  -0.434
  284   2HZ   LYS  14          2HZ       LYS  14 -10.175  -3.081  -0.103
  285   3HZ   LYS  14          3HZ       LYS  14  -9.597  -2.121   1.174
  286    H    GLN  15           H        GLN  15  -3.686  -0.795  -3.320
  287    HA   GLN  15           HA       GLN  15  -2.854   1.912  -2.907
  288   1HB   GLN  15          1HB       GLN  15  -2.153  -0.512  -4.393
  289   2HB   GLN  15          2HB       GLN  15  -1.800   0.934  -5.322
  290   1HG   GLN  15          1HG       GLN  15  -0.219   1.686  -3.803
  291   2HG   GLN  15          2HG       GLN  15  -1.009   0.884  -2.444
  292   1HE2  GLN  15          2HE2      GLN  15  -0.960  -1.621  -2.582
  293   2HE2  GLN  15          1HE2      GLN  15   0.474  -2.326  -3.161
  294    H    ALA  16           H        ALA  16  -4.410   0.290  -5.691
  295    HA   ALA  16           HA       ALA  16  -4.777   2.684  -7.244
  296   1HB   ALA  16          1HB       ALA  16  -6.297   0.049  -7.150
  297   2HB   ALA  16          2HB       ALA  16  -6.418   1.228  -8.457
  298   3HB   ALA  16          3HB       ALA  16  -4.891   0.399  -8.153
  299    H    GLN  17           H        GLN  17  -6.547   1.291  -4.551
  300    HA   GLN  17           HA       GLN  17  -8.950   2.928  -4.969
  301   1HB   GLN  17          1HB       GLN  17  -7.843   0.986  -2.973
  302   2HB   GLN  17          2HB       GLN  17  -9.100   2.088  -2.412
  303   1HG   GLN  17          1HG       GLN  17 -10.339   1.346  -4.602
  304   2HG   GLN  17          2HG       GLN  17  -9.261  -0.044  -4.520
  305   1HE2  GLN  17          2HE2      GLN  17 -12.253   0.111  -4.018
  306   2HE2  GLN  17          1HE2      GLN  17 -12.465  -0.525  -2.459
  307    H    TRP  18           H        TRP  18  -6.011   2.979  -3.054
  308    HA   TRP  18           HA       TRP  18  -6.641   5.422  -1.590
  309   1HB   TRP  18          1HB       TRP  18  -5.103   3.737  -0.715
  310   2HB   TRP  18          2HB       TRP  18  -4.127   3.822  -2.167
  311    HD1  TRP  18           HD1      TRP  18  -4.728   5.644   1.104
  312    HE1  TRP  18           HE1      TRP  18  -3.030   7.589   1.279
  313    HE3  TRP  18           HE3      TRP  18  -2.737   5.489  -3.536
  314    HZ2  TRP  18           HZ2      TRP  18  -1.066   8.875  -0.347
  315    HZ3  TRP  18           HZ3      TRP  18  -0.975   7.036  -4.201
  316    HH2  TRP  18           HH2      TRP  18  -0.122   8.709  -2.642
  317    H    LYS  19           H        LYS  19  -4.554   4.520  -4.292
  318    HA   LYS  19           HA       LYS  19  -3.473   7.072  -4.913
  319   1HB   LYS  19          1HB       LYS  19  -4.081   4.564  -6.502
  320   2HB   LYS  19          2HB       LYS  19  -3.302   5.961  -7.233
  321   1HG   LYS  19          1HG       LYS  19  -1.610   5.818  -5.310
  322   2HG   LYS  19          2HG       LYS  19  -2.257   4.207  -5.022
  323   1HD   LYS  19          1HD       LYS  19  -1.897   4.041  -7.681
  324   2HD   LYS  19          2HD       LYS  19  -0.642   5.222  -7.307
  325   1HE   LYS  19          1HE       LYS  19   0.182   3.638  -5.499
  326   2HE   LYS  19          2HE       LYS  19  -0.933   2.429  -6.165
  327   1HZ   LYS  19          1HZ       LYS  19   1.023   3.926  -7.818
  328   2HZ   LYS  19          2HZ       LYS  19   1.348   2.393  -7.160
  329   3HZ   LYS  19          3HZ       LYS  19   0.090   2.584  -8.282
  330    H    ALA  20           H        ALA  20  -6.480   5.449  -5.778
  331    HA   ALA  20           HA       ALA  20  -7.384   7.247  -7.770
  332   1HB   ALA  20          1HB       ALA  20  -8.568   5.319  -5.832
  333   2HB   ALA  20          2HB       ALA  20  -9.670   6.428  -6.646
  334   3HB   ALA  20          3HB       ALA  20  -8.664   5.330  -7.593
  335    H    ALA  21           H        ALA  21  -7.316   7.463  -4.270
  336    HA   ALA  21           HA       ALA  21  -8.612  10.150  -4.452
  337   1HB   ALA  21          1HB       ALA  21  -9.475   7.909  -3.110
  338   2HB   ALA  21          2HB       ALA  21  -8.582   8.762  -1.851
  339   3HB   ALA  21          3HB       ALA  21  -9.923   9.559  -2.674
  340    H    ASN  22           H        ASN  22  -5.774   9.300  -4.650
  341    HA   ASN  22           HA       ASN  22  -4.677  11.311  -2.794
  342   1HB   ASN  22          1HB       ASN  22  -3.873   8.388  -2.738
  343   2HB   ASN  22          2HB       ASN  22  -3.005   9.680  -1.911
  344   1HD2  ASN  22          2HD2      ASN  22  -5.267   7.336  -1.375
  345   2HD2  ASN  22          1HD2      ASN  22  -6.104   8.027  -0.071
  346    HA   PRO  23           HA       PRO  23  -2.542  10.569  -6.940
  347   1HB   PRO  23          1HB       PRO  23  -3.466  12.799  -8.239
  348   2HB   PRO  23          2HB       PRO  23  -4.286  11.226  -8.331
  349   1HG   PRO  23          1HG       PRO  23  -4.946  13.609  -6.680
  350   2HG   PRO  23          2HG       PRO  23  -6.024  12.469  -7.503
  351   1HD   PRO  23          1HD       PRO  23  -5.500  12.390  -4.825
  352   2HD   PRO  23          2HD       PRO  23  -5.955  10.963  -5.770
  353    H    LEU  24           H        LEU  24  -3.313  13.256  -4.857
  354    HA   LEU  24           HA       LEU  24  -1.216  15.077  -5.442
  355   1HB   LEU  24          1HB       LEU  24  -1.947  16.073  -3.453
  356   2HB   LEU  24          2HB       LEU  24  -3.317  15.017  -3.772
  357    HG   LEU  24           HG       LEU  24  -0.980  14.138  -2.048
  358   1HD1  LEU  24          1HD1      LEU  24  -3.507  15.604  -1.268
  359   2HD1  LEU  24          2HD1      LEU  24  -2.520  14.700  -0.119
  360   3HD1  LEU  24          3HD1      LEU  24  -1.841  16.093  -0.962
  361   1HD2  LEU  24          1HD2      LEU  24  -3.116  12.718  -3.110
  362   2HD2  LEU  24          2HD2      LEU  24  -2.194  12.235  -1.688
  363   3HD2  LEU  24          3HD2      LEU  24  -3.698  13.140  -1.503
  364    H    LEU  25           H        LEU  25  -1.298  12.116  -3.567
  365    HA   LEU  25           HA       LEU  25   1.605  12.326  -2.930
  366   1HB   LEU  25          1HB       LEU  25  -0.816  10.845  -1.925
  367   2HB   LEU  25          2HB       LEU  25   0.778  10.136  -1.645
  368    HG   LEU  25           HG       LEU  25   0.533  13.024  -1.013
  369   1HD1  LEU  25          1HD1      LEU  25  -1.293  11.021   0.097
  370   2HD1  LEU  25          2HD1      LEU  25  -0.334  11.823   1.340
  371   3HD1  LEU  25          3HD1      LEU  25  -1.332  12.778   0.245
  372   1HD2  LEU  25          1HD2      LEU  25   2.575  11.605  -0.638
  373   2HD2  LEU  25          2HD2      LEU  25   1.980  12.377   0.832
  374   3HD2  LEU  25          3HD2      LEU  25   1.654  10.669   0.539
  375    H    VAL  26           H        VAL  26   0.520  11.912  -5.562
  376    HA   VAL  26           HA       VAL  26   1.786   9.323  -6.249
  377    HB   VAL  26           HB       VAL  26  -1.061   9.993  -6.097
  378   1HG1  VAL  26          1HG1      VAL  26   0.054   9.112  -8.770
  379   2HG1  VAL  26          2HG1      VAL  26  -1.619   8.826  -8.290
  380   3HG1  VAL  26          3HG1      VAL  26  -1.012  10.478  -8.429
  381   1HG2  VAL  26          1HG2      VAL  26   0.260   7.950  -5.256
  382   2HG2  VAL  26          2HG2      VAL  26  -1.301   7.639  -6.017
  383   3HG2  VAL  26          3HG2      VAL  26   0.192   7.368  -6.920
  384    H    GLY  27           H        GLY  27   3.041   9.659  -8.069
  385   1HA   GLY  27          1HA       GLY  27   3.904  10.712  -9.987
  386   2HA   GLY  27          2HA       GLY  27   2.243  11.203 -10.334
  387    H    VAL  28           H        VAL  28   1.534  13.263  -9.674
  388    HA   VAL  28           HA       VAL  28   1.944  15.610  -9.426
  389    HB   VAL  28           HB       VAL  28   2.336  16.054  -7.093
  390   1HG1  VAL  28          1HG1      VAL  28   0.512  14.123  -8.016
  391   2HG1  VAL  28          2HG1      VAL  28   1.177  13.468  -6.520
  392   3HG1  VAL  28          3HG1      VAL  28   0.411  15.055  -6.524
  393   1HG2  VAL  28          1HG2      VAL  28   4.443  14.614  -7.010
  394   2HG2  VAL  28          2HG2      VAL  28   3.399  14.517  -5.590
  395   3HG2  VAL  28          3HG2      VAL  28   3.376  13.224  -6.788
  396    H    SER  29           H        SER  29   3.999  16.778  -7.814
  397    HA   SER  29           HA       SER  29   6.250  16.632  -9.727
  398   1HB   SER  29          1HB       SER  29   5.004  18.595  -7.987
  399   2HB   SER  29          2HB       SER  29   6.741  18.535  -7.705
  400    HG   SER  29           HG       SER  29   7.011  19.474  -9.557
  401    H    ALA  30           H        ALA  30   6.000  14.339  -8.211
  402    HA   ALA  30           HA       ALA  30   8.391  14.497  -6.419
  403   1HB   ALA  30          1HB       ALA  30   6.163  14.481  -5.203
  404   2HB   ALA  30          2HB       ALA  30   5.856  12.897  -5.916
  405   3HB   ALA  30          3HB       ALA  30   7.209  13.118  -4.804
  406    H    LYS  31           H        LYS  31   8.599  13.732  -9.049
  407    HA   LYS  31           HA       LYS  31   9.330  10.879  -8.806
  408   1HB   LYS  31          1HB       LYS  31   7.972  10.359 -10.871
  409   2HB   LYS  31          2HB       LYS  31   6.996  10.772  -9.462
  410   1HG   LYS  31          1HG       LYS  31   6.054  12.476 -10.593
  411   2HG   LYS  31          2HG       LYS  31   7.643  13.200 -10.839
  412   1HD   LYS  31          1HD       LYS  31   7.840  12.381 -12.965
  413   2HD   LYS  31          2HD       LYS  31   7.010  10.875 -12.569
  414   1HE   LYS  31          1HE       LYS  31   4.953  12.641 -12.283
  415   2HE   LYS  31          2HE       LYS  31   5.886  13.429 -13.571
  416   1HZ   LYS  31          1HZ       LYS  31   5.165  10.546 -13.540
  417   2HZ   LYS  31          2HZ       LYS  31   4.327  11.732 -14.423
  418   3HZ   LYS  31          3HZ       LYS  31   5.948  11.380 -14.793
  419    HA   PRO  32           HA       PRO  32  12.303  13.253 -11.331
  420   1HB   PRO  32          1HB       PRO  32  14.468  11.719 -10.652
  421   2HB   PRO  32          2HB       PRO  32  13.877  13.058  -9.648
  422   1HG   PRO  32          1HG       PRO  32  13.446  10.128  -9.338
  423   2HG   PRO  32          2HG       PRO  32  13.745  11.362  -8.104
  424   1HD   PRO  32          1HD       PRO  32  11.276  10.349  -8.631
  425   2HD   PRO  32          2HD       PRO  32  11.543  11.994  -8.014
  426    H    VAL  33           H        VAL  33  13.168  12.685 -13.381
  427    HA   VAL  33           HA       VAL  33  12.056  10.386 -14.700
  428    HB   VAL  33           HB       VAL  33  12.634  12.532 -15.782
  429   1HG1  VAL  33          1HG1      VAL  33  14.878  12.534 -14.315
  430   2HG1  VAL  33          2HG1      VAL  33  15.535  11.831 -15.792
  431   3HG1  VAL  33          3HG1      VAL  33  14.761  13.416 -15.837
  432   1HG2  VAL  33          1HG2      VAL  33  12.790  10.132 -16.914
  433   2HG2  VAL  33          2HG2      VAL  33  13.266  11.581 -17.800
  434   3HG2  VAL  33          3HG2      VAL  33  14.494  10.559 -17.053
  435    H    ASN  34           H        ASN  34  15.152  10.982 -13.125
  436    HA   ASN  34           HA       ASN  34  16.989   9.552 -12.707
  437   1HB   ASN  34          1HB       ASN  34  14.466   7.976 -12.611
  438   2HB   ASN  34          2HB       ASN  34  15.965   7.047 -12.638
  439   1HD2  ASN  34          2HD2      ASN  34  14.357   7.026 -10.307
  440   2HD2  ASN  34          1HD2      ASN  34  15.158   7.871  -9.072
  441    H    ARG  35           H        ARG  35  17.249  10.277 -15.262
  442    HA   ARG  35           HA       ARG  35  17.253   7.858 -16.987
  443   1HB   ARG  35          1HB       ARG  35  17.104  10.766 -17.292
  444   2HB   ARG  35          2HB       ARG  35  18.228  10.024 -18.432
  445   1HG   ARG  35          1HG       ARG  35  16.516   8.507 -19.228
  446   2HG   ARG  35          2HG       ARG  35  15.393   9.054 -17.982
  447   1HD   ARG  35          1HD       ARG  35  15.653  11.406 -19.004
  448   2HD   ARG  35          2HD       ARG  35  16.390  10.585 -20.394
  449    HE   ARG  35           HE       ARG  35  14.023   9.169 -19.758
  450   1HH1  ARG  35          1HH1      ARG  35  14.999  12.313 -20.857
  451   2HH1  ARG  35          2HH1      ARG  35  13.538  12.585 -21.743
  452   1HH2  ARG  35          1HH2      ARG  35  12.128   9.533 -20.912
  453   2HH2  ARG  35          2HH2      ARG  35  11.920  11.021 -21.775
  454    HA   PRO  36           HA       PRO  36  21.857   8.982 -17.167
  455   1HB   PRO  36          1HB       PRO  36  22.808  11.122 -15.759
  456   2HB   PRO  36          2HB       PRO  36  22.171  11.260 -17.409
  457   1HG   PRO  36          1HG       PRO  36  20.900  11.964 -14.825
  458   2HG   PRO  36          2HG       PRO  36  20.754  12.742 -16.408
  459   1HD   PRO  36          1HD       PRO  36  18.876  11.054 -15.300
  460   2HD   PRO  36          2HD       PRO  36  19.029  11.408 -17.033
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  11.756 -15.421   1.468
    2   2H5*    G   1          2H5*        G   1  13.063 -15.996   2.528
    3    H4*    G   1           H4*        G   1  11.289 -18.172   2.263
    4    H3*    G   1           H3*        G   1   9.831 -15.532   2.612
    5    H2*    G   1           H2*        G   1   8.482 -16.497   4.296
    6   2HO*    G   1          2HO*        G   1   8.953 -18.778   2.867
    7    H1*    G   1           H1*        G   1  10.465 -18.085   5.426
    8    H8     G   1           H8         G   1  11.866 -14.683   4.729
    9    H1     G   1           H1         G   1   7.946 -14.830   9.817
   10   1H2     G   1          1H2         G   1   6.742 -16.694   9.781
   11   2H2     G   1          2H2         G   1   7.261 -18.067   8.830
   12   1H5*    C   2          1H5*        C   2   6.486 -19.064   3.311
   13   2H5*    C   2          2H5*        C   2   5.756 -18.613   1.753
   14    H4*    C   2           H4*        C   2   4.044 -18.664   3.506
   15    H3*    C   2           H3*        C   2   4.813 -15.891   2.526
   16    H2*    C   2           H2*        C   2   3.215 -14.964   3.984
   17   2HO*    C   2          2HO*        C   2   1.395 -16.086   3.722
   18    H1*    C   2           H1*        C   2   3.560 -16.846   6.045
   19   1H4     C   2          1H4         C   2   6.651 -11.829   8.312
   20   2H4     C   2          2H4         C   2   7.697 -11.745   6.914
   21    H5     C   2           H5         C   2   7.369 -13.172   4.964
   22    H6     C   2           H6         C   2   6.428 -15.335   4.263
   23   1H5*    C   3          1H5*        C   3   0.327 -14.191   1.270
   24   2H5*    C   3          2H5*        C   3   1.351 -12.815   1.722
   25    H4*    C   3           H4*        C   3  -0.440 -14.508   3.411
   26    H3*    C   3           H3*        C   3   0.382 -11.609   3.197
   27    H2*    C   3           H2*        C   3  -0.025 -11.266   5.470
   28   2HO*    C   3          2HO*        C   3  -1.316 -12.467   6.711
   29    H1*    C   3           H1*        C   3   0.879 -13.734   6.370
   30   1H4     C   3          1H4         C   3   5.717  -9.703   7.342
   31   2H4     C   3          2H4         C   3   6.128  -9.752   5.643
   32    H5     C   3           H5         C   3   5.113 -11.470   4.213
   33    H6     C   3           H6         C   3   3.181 -12.872   3.884
   34   1H5*    C   4          1H5*        C   4  -3.921 -10.169   4.162
   35   2H5*    C   4          2H5*        C   4  -2.159 -10.373   4.148
   36    H4*    C   4           H4*        C   4  -3.769 -10.066   6.693
   37    H3*    C   4           H3*        C   4  -2.483  -7.972   4.916
   38    H2*    C   4           H2*        C   4  -1.785  -6.798   6.829
   39   2HO*    C   4          2HO*        C   4  -2.584  -7.671   8.961
   40    H1*    C   4           H1*        C   4  -1.192  -9.036   8.365
   41   1H4     C   4          1H4         C   4   4.319  -6.871   6.044
   42   2H4     C   4          2H4         C   4   3.994  -7.628   4.508
   43    H5     C   4           H5         C   4   2.047  -9.017   4.185
   44    H6     C   4           H6         C   4  -0.118  -9.543   4.996
   45   1H5*    U   5          1H5*        U   5  -4.670  -6.162   7.716
   46   2H5*    U   5          2H5*        U   5  -5.755  -4.846   7.226
   47    H4*    U   5           H4*        U   5  -4.355  -4.025   9.003
   48    H3*    U   5           H3*        U   5  -3.503  -3.016   6.268
   49    H2*    U   5           H2*        U   5  -1.832  -1.741   7.326
   50   2HO*    U   5          2HO*        U   5  -3.009  -0.740   8.938
   51    H1*    U   5           H1*        U   5  -1.369  -3.577   9.416
   52    H3     U   5           H3         U   5   2.504  -2.686   7.161
   53    H5     U   5           H5         U   5   0.604  -5.677   4.947
   54    H6     U   5           H6         U   5  -1.371  -5.243   6.229
   55   1H5*    G   6          1H5*        G   6  -1.532   0.100   8.139
   56   2H5*    G   6          2H5*        G   6  -2.793   1.352   8.219
   57    H4*    G   6           H4*        G   6  -1.482   2.551   6.825
   58    H3*    G   6           H3*        G   6  -2.344   0.340   4.919
   59    H2*    G   6           H2*        G   6  -0.847   1.177   3.328
   60   2HO*    G   6          2HO*        G   6  -0.394   3.239   3.136
   61    H1*    G   6           H1*        G   6   1.111   2.023   5.169
   62    H8     G   6           H8         G   6  -0.603  -1.453   5.040
   63    H1     G   6           H1         G   6   5.220  -1.059   2.337
   64   1H2     G   6          1H2         G   6   5.818   1.106   2.186
   65   2H2     G   6          2H2         G   6   5.095   2.254   3.295
   66   1H5*    A   7          1H5*        A   7  -4.386   1.634   0.995
   67   2H5*    A   7          2H5*        A   7  -3.340   0.201   0.952
   68    H4*    A   7           H4*        A   7  -2.714   1.689  -0.851
   69    H3*    A   7           H3*        A   7  -0.739   1.733   1.457
   70    H2*    A   7           H2*        A   7   0.585   3.247   0.192
   71   2HO*    A   7          2HO*        A   7   0.824   2.818  -1.835
   72    H1*    A   7           H1*        A   7  -1.571   4.516  -1.042
   73    H8     A   7           H8         A   7  -2.324   4.572   2.575
   74   1H6     A   7          1H6         A   7   1.830   9.126   3.233
   75   2H6     A   7          2H6         A   7   0.457   8.322   3.964
   76    H2     A   7           H2         A   7   2.285   7.408  -0.886
   77   1H5*    A   8          1H5*        A   8   1.122   0.808  -1.638
   78   2H5*    A   8          2H5*        A   8   2.468  -0.330  -1.884
   79    H4*    A   8           H4*        A   8   3.350   1.871  -2.213
   80    H3*    A   8           H3*        A   8   3.983   0.753   0.541
   81    H2*    A   8           H2*        A   8   5.236   2.698   1.040
   82   2HO*    A   8          2HO*        A   8   4.971   3.936  -1.411
   83    H1*    A   8           H1*        A   8   3.475   4.460  -0.257
   84    H8     A   8           H8         A   8   1.384   2.052   1.652
   85   1H6     A   8          1H6         A   8   2.563   5.386   6.747
   86   2H6     A   8          2H6         A   8   1.560   4.133   6.053
   87    H2     A   8           H2         A   8   5.364   6.742   3.520
   88   1H5*    A   9          2H5*        A   9   8.555  -0.598  -2.353
   89   2H5*    A   9          1H5*        A   9   7.553   0.297  -1.191
   90    H4*    A   9           H4*        A   9   9.626   1.342  -2.745
   91    H3*    A   9           H3*        A   9   7.310   2.634  -1.280
   92    H2*    A   9           H2*        A   9   7.993   4.733  -2.135
   93   2HO*    A   9          2HO*        A   9  10.406   3.709  -1.982
   94    H1*    A   9           H1*        A   9   8.663   3.761  -4.667
   95    H8     A   9           H8         A   9   6.237   5.047  -2.316
   96   1H6     A   9          1H6         A   9   2.376   5.701  -5.831
   97   2H6     A   9          2H6         A   9   1.625   4.121  -5.823
   98    H2     A   9           H2         A   9   5.313   2.175  -7.980
   99   1H5*    A  10          1H5*        A  10  10.239   1.423   3.668
  100   2H5*    A  10          2H5*        A  10   8.527   1.723   3.300
  101    H4*    A  10           H4*        A  10  10.352   4.067   3.722
  102    H3*    A  10           H3*        A  10   9.266   2.238   5.867
  103    H2*    A  10           H2*        A  10   8.621   4.077   7.175
  104   2HO*    A  10          2HO*        A  10  10.499   5.468   5.613
  105    H1*    A  10           H1*        A  10   7.788   5.721   5.084
  106    H8     A  10           H8         A  10   6.319   2.687   3.930
  107   1H6     A  10          1H6         A  10   2.270   2.550   6.902
  108   2H6     A  10          2H6         A  10   2.460   2.382   8.634
  109    H2     A  10           H2         A  10   5.432   5.731   9.521
  110   1H5*    A  11          1H5*        A  11  10.417   4.288   8.741
  111   2H5*    A  11          2H5*        A  11  11.078   3.141   9.929
  112    H4*    A  11           H4*        A  11   8.754   4.149  10.410
  113    H3*    A  11           H3*        A  11   9.315   1.175  10.408
  114    H2*    A  11           H2*        A  11   7.052   0.739  10.912
  115   2HO*    A  11          2HO*        A  11   5.644   2.309  11.660
  116    H1*    A  11           H1*        A  11   5.960   2.763   9.375
  117    H8     A  11           H8         A  11   8.679   1.069   7.395
  118   1H6     A  11          1H6         A  11   4.741  -3.379   6.057
  119   2H6     A  11          2H6         A  11   5.604  -2.226   5.067
  120    H2     A  11           H2         A  11   2.670  -0.570   9.001
  121   1H5*    G  12          1H5*        G  12   9.386  -1.811  13.158
  122   2H5*    G  12          2H5*        G  12   9.212  -0.831  11.689
  123    H4*    G  12           H4*        G  12   7.057  -0.298  13.562
  124    H3*    G  12           H3*        G  12   7.523  -3.157  12.708
  125    H2*    G  12           H2*        G  12   5.209  -3.398  12.301
  126   2HO*    G  12          2HO*        G  12   4.001  -1.224  12.895
  127    H1*    G  12           H1*        G  12   4.852  -0.842  11.219
  128    H8     G  12           H8         G  12   7.833  -1.723   9.453
  129    H1     G  12           H1         G  12   3.075  -5.738   7.870
  130   1H2     G  12          1H2         G  12   1.558  -5.774   9.508
  131   2H2     G  12          2H2         G  12   1.373  -4.343  10.498
  132   1H5*    G  13          1H5*        G  13   5.114  -4.458  16.846
  133   2H5*    G  13          2H5*        G  13   5.686  -4.524  15.174
  134    H4*    G  13           H4*        G  13   2.775  -4.641  16.009
  135    H3*    G  13           H3*        G  13   4.770  -6.816  15.377
  136    H2*    G  13           H2*        G  13   3.126  -7.993  14.172
  137   2HO*    G  13          2HO*        G  13   0.913  -6.577  14.482
  138    H1*    G  13           H1*        G  13   1.872  -5.777  13.063
  139    H8     G  13           H8         G  13   5.504  -5.133  12.806
  140    H1     G  13           H1         G  13   3.470  -9.472   8.527
  141   1H2     G  13          1H2         G  13   1.198  -9.764   8.876
  142   2H2     G  13          2H2         G  13   0.837  -9.952  10.577
  143   1H5*    G  14          1H5*        G  14   1.842  -8.444  16.805
  144   2H5*    G  14          2H5*        G  14   1.549  -9.305  18.333
  145    H4*    G  14           H4*        G  14   0.802 -10.952  16.936
  146    H3*    G  14           H3*        G  14   3.798 -11.268  16.676
  147    H2*    G  14           H2*        G  14   3.406 -12.997  15.117
  148   2HO*    G  14          2HO*        G  14   0.671 -13.041  15.201
  149    H1*    G  14           H1*        G  14   1.212 -11.750  13.909
  150    H8     G  14           H8         G  14   4.127  -9.380  14.508
  151    H1     G  14           H1         G  14   4.629 -12.991   9.198
  152   1H2     G  14          1H2         G  14   3.228 -14.790   9.460
  153   2H2     G  14          2H2         G  14   1.685 -14.382  10.176
  154   1H5*    C  15          2H5*        C  15   3.910 -15.245  17.965
  155   2H5*    C  15          1H5*        C  15   3.772 -13.911  16.797
  156    H4*    C  15           H4*        C  15   2.836 -16.616  15.912
  157    H3*    C  15           H3*        C  15   5.756 -15.858  16.288
  158    H2*    C  15           H2*        C  15   6.246 -16.946  14.259
  159   2HO*    C  15          2HO*        C  15   4.400 -18.219  13.278
  160    H1*    C  15           H1*        C  15   3.813 -16.292  12.999
  161   1H4     C  15          1H4         C  15   8.219 -12.570  10.360
  162   2H4     C  15          2H4         C  15   8.495 -11.735  11.878
  163    H5     C  15           H5         C  15   6.888 -12.003  13.722
  164    H6     C  15           H6         C  15   5.203 -13.452  14.673
  165   2H    ASP   2          2H        ASP   2   9.982 -12.387  -1.971
  166   1H    ASP   2          1H        ASP   2   9.734 -13.993  -1.475
  167   3H    ASP   2          3H        ASP   2  11.173 -13.188  -1.067
  168    HA   ASP   2           HA       ASP   2   9.952 -13.080   0.907
  169   1HB   ASP   2          1HB       ASP   2   9.242 -10.583  -0.653
  170   2HB   ASP   2          2HB       ASP   2   9.531 -10.707   1.081
  171    H    ALA   3           H        ALA   3   7.715 -11.494   1.438
  172    HA   ALA   3           HA       ALA   3   5.469 -12.858   0.005
  173   1HB   ALA   3          1HB       ALA   3   6.397 -13.117   2.765
  174   2HB   ALA   3          2HB       ALA   3   4.697 -12.659   2.674
  175   3HB   ALA   3          3HB       ALA   3   5.259 -14.125   1.872
  176    H    GLN   4           H        GLN   4   6.450 -10.222   2.179
  177    HA   GLN   4           HA       GLN   4   3.960  -8.779   2.002
  178   1HB   GLN   4          1HB       GLN   4   5.682  -8.471   3.765
  179   2HB   GLN   4          2HB       GLN   4   6.805  -7.863   2.554
  180   1HG   GLN   4          1HG       GLN   4   5.283  -5.994   2.058
  181   2HG   GLN   4          2HG       GLN   4   4.141  -6.597   3.259
  182   1HE2  GLN   4          2HE2      GLN   4   5.536  -3.990   3.350
  183   2HE2  GLN   4          1HE2      GLN   4   6.464  -3.995   4.768
  184    H    THR   5           H        THR   5   7.121  -8.199   0.476
  185    HA   THR   5           HA       THR   5   6.411  -6.144  -1.302
  186    HB   THR   5           HB       THR   5   8.174  -8.560  -1.848
  187    HG1  THR   5           HG1      THR   5   9.464  -7.721  -0.436
  188   1HG2  THR   5          1HG2      THR   5   7.901  -5.819  -3.054
  189   2HG2  THR   5          2HG2      THR   5   9.416  -6.720  -3.174
  190   3HG2  THR   5          3HG2      THR   5   7.934  -7.384  -3.868
  191    H    ARG   6           H        ARG   6   5.825  -9.604  -1.457
  192    HA   ARG   6           HA       ARG   6   4.640  -9.660  -4.115
  193   1HB   ARG   6          1HB       ARG   6   5.241 -11.423  -1.887
  194   2HB   ARG   6          2HB       ARG   6   3.593 -11.705  -2.462
  195   1HG   ARG   6          1HG       ARG   6   4.306 -12.580  -4.443
  196   2HG   ARG   6          2HG       ARG   6   5.603 -11.398  -4.610
  197   1HD   ARG   6          1HD       ARG   6   6.806 -13.390  -4.262
  198   2HD   ARG   6          2HD       ARG   6   6.686 -12.752  -2.610
  199    HE   ARG   6           HE       ARG   6   5.204 -14.517  -2.101
  200   1HH1  ARG   6          1HH1      ARG   6   5.423 -14.027  -5.532
  201   2HH1  ARG   6          2HH1      ARG   6   4.442 -15.401  -5.909
  202   1HH2  ARG   6          1HH2      ARG   6   3.928 -16.300  -2.604
  203   2HH2  ARG   6          2HH2      ARG   6   3.599 -16.682  -4.260
  204    H    ARG   7           H        ARG   7   3.447  -9.615  -0.771
  205    HA   ARG   7           HA       ARG   7   0.681  -9.656  -1.331
  206   1HB   ARG   7          1HB       ARG   7   1.410 -10.003   0.889
  207   2HB   ARG   7          2HB       ARG   7   2.449  -8.584   0.854
  208   1HG   ARG   7          1HG       ARG   7   0.166  -7.280   0.556
  209   2HG   ARG   7          2HG       ARG   7  -0.521  -8.741   1.266
  210   1HD   ARG   7          1HD       ARG   7   0.175  -8.116   3.323
  211   2HD   ARG   7          2HD       ARG   7   1.839  -7.929   2.742
  212    HE   ARG   7           HE       ARG   7  -0.108  -5.760   3.005
  213   1HH1  ARG   7          1HH1      ARG   7   2.676  -6.942   1.314
  214   2HH1  ARG   7          2HH1      ARG   7   3.205  -5.370   0.853
  215   1HH2  ARG   7          1HH2      ARG   7   0.585  -3.722   2.404
  216   2HH2  ARG   7          2HH2      ARG   7   2.028  -3.548   1.467
  217    H    ARG   8           H        ARG   8   3.024  -7.026  -1.354
  218    HA   ARG   8           HA       ARG   8   1.326  -4.756  -1.443
  219   1HB   ARG   8          1HB       ARG   8   3.955  -5.130  -1.467
  220   2HB   ARG   8          2HB       ARG   8   3.748  -5.042  -3.214
  221   1HG   ARG   8          1HG       ARG   8   4.176  -2.807  -2.597
  222   2HG   ARG   8          2HG       ARG   8   2.421  -2.869  -2.751
  223   1HD   ARG   8          1HD       ARG   8   3.165  -1.708  -0.651
  224   2HD   ARG   8          2HD       ARG   8   2.192  -3.152  -0.318
  225    HE   ARG   8           HE       ARG   8   4.122  -4.176   0.578
  226   1HH1  ARG   8          1HH1      ARG   8   4.965  -1.473  -1.424
  227   2HH1  ARG   8          2HH1      ARG   8   6.648  -1.559  -1.036
  228   1HH2  ARG   8          1HH2      ARG   8   6.312  -4.280   1.078
  229   2HH2  ARG   8          2HH2      ARG   8   7.409  -3.139   0.374
  230    H    GLU   9           H        GLU   9   2.356  -6.963  -4.017
  231    HA   GLU   9           HA       GLU   9   1.030  -5.581  -6.160
  232   1HB   GLU   9          1HB       GLU   9   1.508  -8.563  -5.780
  233   2HB   GLU   9          2HB       GLU   9   1.281  -7.737  -7.322
  234   1HG   GLU   9          1HG       GLU   9   3.346  -6.294  -6.300
  235   2HG   GLU   9          2HG       GLU   9   3.680  -7.871  -5.586
  236    H    ARG  10           H        ARG  10   0.034  -7.804  -3.671
  237    HA   ARG  10           HA       ARG  10  -2.678  -8.179  -4.673
  238   1HB   ARG  10          1HB       ARG  10  -0.932  -9.106  -2.542
  239   2HB   ARG  10          2HB       ARG  10  -2.512  -8.672  -1.892
  240   1HG   ARG  10          1HG       ARG  10  -3.636 -10.223  -3.270
  241   2HG   ARG  10          2HG       ARG  10  -2.264 -10.372  -4.368
  242   1HD   ARG  10          1HD       ARG  10  -1.151 -11.857  -2.993
  243   2HD   ARG  10          2HD       ARG  10  -1.806 -11.130  -1.513
  244    HE   ARG  10           HE       ARG  10  -3.879 -12.346  -3.154
  245   1HH1  ARG  10          1HH1      ARG  10  -1.415 -12.918  -0.774
  246   2HH1  ARG  10          2HH1      ARG  10  -2.188 -14.334  -0.145
  247   1HH2  ARG  10          1HH2      ARG  10  -4.873 -14.188  -2.327
  248   2HH2  ARG  10          2HH2      ARG  10  -4.135 -15.049  -1.018
  249    H    ARG  11           H        ARG  11  -0.923  -5.727  -2.991
  250    HA   ARG  11           HA       ARG  11  -3.346  -4.591  -1.732
  251   1HB   ARG  11          1HB       ARG  11  -0.444  -3.726  -1.889
  252   2HB   ARG  11          2HB       ARG  11  -1.693  -2.858  -1.003
  253   1HG   ARG  11          1HG       ARG  11  -0.738  -5.687  -0.478
  254   2HG   ARG  11          2HG       ARG  11  -0.491  -4.285   0.553
  255   1HD   ARG  11          1HD       ARG  11  -2.476  -4.672   1.576
  256   2HD   ARG  11          2HD       ARG  11  -3.316  -4.574   0.020
  257    HE   ARG  11           HE       ARG  11  -1.905  -7.074   0.211
  258   1HH1  ARG  11          1HH1      ARG  11  -4.697  -5.378   1.384
  259   2HH1  ARG  11          2HH1      ARG  11  -5.608  -6.824   1.655
  260   1HH2  ARG  11          1HH2      ARG  11  -3.099  -8.946   0.567
  261   2HH2  ARG  11          2HH2      ARG  11  -4.709  -8.834   1.195
  262    H    ALA  12           H        ALA  12  -2.106  -4.621  -4.837
  263    HA   ALA  12           HA       ALA  12  -2.123  -1.899  -5.683
  264   1HB   ALA  12          1HB       ALA  12  -1.571  -3.989  -7.018
  265   2HB   ALA  12          2HB       ALA  12  -3.300  -4.315  -7.121
  266   3HB   ALA  12          3HB       ALA  12  -2.630  -2.867  -7.871
  267    H    GLU  13           H        GLU  13  -4.705  -4.046  -4.692
  268    HA   GLU  13           HA       GLU  13  -6.888  -2.387  -5.683
  269   1HB   GLU  13          1HB       GLU  13  -6.715  -4.593  -3.595
  270   2HB   GLU  13          2HB       GLU  13  -8.220  -3.950  -4.255
  271   1HG   GLU  13          1HG       GLU  13  -6.659  -4.574  -6.504
  272   2HG   GLU  13          2HG       GLU  13  -6.415  -5.924  -5.395
  273    H    LYS  14           H        LYS  14  -4.970  -2.693  -2.725
  274    HA   LYS  14           HA       LYS  14  -6.639  -0.821  -1.190
  275   1HB   LYS  14          1HB       LYS  14  -3.837  -1.969  -0.828
  276   2HB   LYS  14          2HB       LYS  14  -4.711  -1.060   0.406
  277   1HG   LYS  14          1HG       LYS  14  -5.787  -3.592  -0.858
  278   2HG   LYS  14          2HG       LYS  14  -4.851  -3.579   0.637
  279   1HD   LYS  14          1HD       LYS  14  -6.533  -2.563   1.850
  280   2HD   LYS  14          2HD       LYS  14  -7.185  -1.722   0.443
  281   1HE   LYS  14          1HE       LYS  14  -8.112  -3.835  -0.422
  282   2HE   LYS  14          2HE       LYS  14  -7.432  -4.708   0.967
  283   1HZ   LYS  14          1HZ       LYS  14  -8.650  -3.146   2.424
  284   2HZ   LYS  14          2HZ       LYS  14  -9.411  -2.493   1.052
  285   3HZ   LYS  14          3HZ       LYS  14  -9.683  -4.112   1.480
  286    H    GLN  15           H        GLN  15  -3.693  -0.851  -3.076
  287    HA   GLN  15           HA       GLN  15  -2.831   1.852  -2.623
  288   1HB   GLN  15          1HB       GLN  15  -2.183  -0.534  -4.183
  289   2HB   GLN  15          2HB       GLN  15  -1.905   0.925  -5.116
  290   1HG   GLN  15          1HG       GLN  15  -0.272   1.708  -3.663
  291   2HG   GLN  15          2HG       GLN  15  -0.944   0.831  -2.288
  292   1HE2  GLN  15          2HE2      GLN  15  -0.846  -1.688  -2.582
  293   2HE2  GLN  15          1HE2      GLN  15   0.586  -2.305  -3.253
  294    H    ALA  16           H        ALA  16  -4.534   0.285  -5.349
  295    HA   ALA  16           HA       ALA  16  -5.001   2.740  -6.799
  296   1HB   ALA  16          1HB       ALA  16  -6.437   0.056  -6.779
  297   2HB   ALA  16          2HB       ALA  16  -6.635   1.289  -8.025
  298   3HB   ALA  16          3HB       ALA  16  -5.074   0.495  -7.809
  299    H    GLN  17           H        GLN  17  -6.630   1.191  -4.099
  300    HA   GLN  17           HA       GLN  17  -9.100   2.761  -4.384
  301   1HB   GLN  17          1HB       GLN  17  -7.891   0.731  -2.589
  302   2HB   GLN  17          2HB       GLN  17  -8.979   1.858  -1.790
  303   1HG   GLN  17          1HG       GLN  17  -9.999  -0.315  -2.778
  304   2HG   GLN  17          2HG       GLN  17 -10.825   1.206  -3.092
  305   1HE2  GLN  17          2HE2      GLN  17 -11.718   0.703  -5.157
  306   2HE2  GLN  17          1HE2      GLN  17 -10.769   0.339  -6.517
  307    H    TRP  18           H        TRP  18  -6.119   2.806  -2.526
  308    HA   TRP  18           HA       TRP  18  -6.710   5.180  -0.970
  309   1HB   TRP  18          1HB       TRP  18  -5.040   3.520  -0.292
  310   2HB   TRP  18          2HB       TRP  18  -4.169   3.737  -1.796
  311    HD1  TRP  18           HD1      TRP  18  -4.657   5.348   1.597
  312    HE1  TRP  18           HE1      TRP  18  -3.065   7.377   1.780
  313    HE3  TRP  18           HE3      TRP  18  -2.968   5.560  -3.155
  314    HZ2  TRP  18           HZ2      TRP  18  -1.293   8.873   0.109
  315    HZ3  TRP  18           HZ3      TRP  18  -1.349   7.252  -3.848
  316    HH2  TRP  18           HH2      TRP  18  -0.490   8.887  -2.245
  317    H    LYS  19           H        LYS  19  -4.745   4.495  -3.832
  318    HA   LYS  19           HA       LYS  19  -3.844   7.127  -4.399
  319   1HB   LYS  19          1HB       LYS  19  -4.382   4.646  -6.052
  320   2HB   LYS  19          2HB       LYS  19  -3.738   6.115  -6.774
  321   1HG   LYS  19          1HG       LYS  19  -1.927   6.033  -4.971
  322   2HG   LYS  19          2HG       LYS  19  -2.462   4.384  -4.663
  323   1HD   LYS  19          1HD       LYS  19  -2.040   5.022  -7.514
  324   2HD   LYS  19          2HD       LYS  19  -0.578   5.077  -6.530
  325   1HE   LYS  19          1HE       LYS  19  -2.104   2.754  -5.775
  326   2HE   LYS  19          2HE       LYS  19  -1.881   2.758  -7.535
  327   1HZ   LYS  19          1HZ       LYS  19   0.488   3.373  -7.092
  328   2HZ   LYS  19          2HZ       LYS  19   0.213   3.045  -5.450
  329   3HZ   LYS  19          3HZ       LYS  19   0.065   1.802  -6.600
  330    H    ALA  20           H        ALA  20  -6.794   5.374  -5.187
  331    HA   ALA  20           HA       ALA  20  -7.888   7.255  -7.016
  332   1HB   ALA  20          1HB       ALA  20  -8.886   5.104  -5.199
  333   2HB   ALA  20          2HB       ALA  20 -10.070   6.172  -5.952
  334   3HB   ALA  20          3HB       ALA  20  -8.987   5.210  -6.957
  335    H    ALA  21           H        ALA  21  -7.710   7.163  -3.514
  336    HA   ALA  21           HA       ALA  21  -9.221   9.739  -3.405
  337   1HB   ALA  21          1HB       ALA  21 -10.283   7.745  -2.318
  338   2HB   ALA  21          2HB       ALA  21  -8.870   7.616  -1.270
  339   3HB   ALA  21          3HB       ALA  21  -9.918   9.030  -1.166
  340    H    ASN  22           H        ASN  22  -6.354   9.246  -3.859
  341    HA   ASN  22           HA       ASN  22  -5.332  11.158  -1.863
  342   1HB   ASN  22          1HB       ASN  22  -4.268   8.336  -2.160
  343   2HB   ASN  22          2HB       ASN  22  -3.406   9.627  -1.326
  344   1HD2  ASN  22          2HD2      ASN  22  -5.476   7.097  -0.768
  345   2HD2  ASN  22          1HD2      ASN  22  -6.190   7.624   0.679
  346    HA   PRO  23           HA       PRO  23  -3.446  11.089  -6.191
  347   1HB   PRO  23          1HB       PRO  23  -4.710  13.312  -7.186
  348   2HB   PRO  23          2HB       PRO  23  -5.348  11.668  -7.402
  349   1HG   PRO  23          1HG       PRO  23  -6.152  13.770  -5.456
  350   2HG   PRO  23          2HG       PRO  23  -7.153  12.609  -6.344
  351   1HD   PRO  23          1HD       PRO  23  -6.452  12.291  -3.731
  352   2HD   PRO  23          2HD       PRO  23  -6.785  10.932  -4.816
  353    H    LEU  24           H        LEU  24  -4.365  13.411  -3.767
  354    HA   LEU  24           HA       LEU  24  -2.533  15.520  -4.268
  355   1HB   LEU  24          1HB       LEU  24  -3.217  16.212  -2.133
  356   2HB   LEU  24          2HB       LEU  24  -4.492  15.057  -2.498
  357    HG   LEU  24           HG       LEU  24  -1.968  14.262  -1.011
  358   1HD1  LEU  24          1HD1      LEU  24  -4.478  15.570  -0.041
  359   2HD1  LEU  24          2HD1      LEU  24  -3.713  14.345   0.972
  360   3HD1  LEU  24          3HD1      LEU  24  -2.816  15.790   0.506
  361   1HD2  LEU  24          1HD2      LEU  24  -4.002  12.728  -2.128
  362   2HD2  LEU  24          2HD2      LEU  24  -2.930  12.197  -0.832
  363   3HD2  LEU  24          3HD2      LEU  24  -4.510  12.887  -0.452
  364    H    LEU  25           H        LEU  25  -2.168  12.394  -2.739
  365    HA   LEU  25           HA       LEU  25   0.736  12.851  -2.264
  366   1HB   LEU  25          1HB       LEU  25  -1.437  11.008  -1.291
  367   2HB   LEU  25          2HB       LEU  25   0.236  10.448  -1.206
  368    HG   LEU  25           HG       LEU  25  -0.581  13.143  -0.118
  369   1HD1  LEU  25          1HD1      LEU  25  -1.801  11.010   0.858
  370   2HD1  LEU  25          2HD1      LEU  25  -0.249  10.747   1.653
  371   3HD1  LEU  25          3HD1      LEU  25  -1.149  12.234   1.946
  372   1HD2  LEU  25          1HD2      LEU  25   1.870  12.235  -0.597
  373   2HD2  LEU  25          2HD2      LEU  25   1.522  13.152   0.869
  374   3HD2  LEU  25          3HD2      LEU  25   1.613  11.391   0.931
  375    H    VAL  26           H        VAL  26  -0.466  12.658  -4.850
  376    HA   VAL  26           HA       VAL  26   1.031  10.389  -5.980
  377    HB   VAL  26           HB       VAL  26  -1.856  10.512  -5.436
  378   1HG1  VAL  26          1HG1      VAL  26  -0.913  10.062  -8.275
  379   2HG1  VAL  26          2HG1      VAL  26  -2.415   9.369  -7.661
  380   3HG1  VAL  26          3HG1      VAL  26  -2.204  11.122  -7.698
  381   1HG2  VAL  26          1HG2      VAL  26   0.198   8.449  -6.228
  382   2HG2  VAL  26          2HG2      VAL  26  -0.642   8.635  -4.686
  383   3HG2  VAL  26          3HG2      VAL  26  -1.513   8.031  -6.098
  384    H    GLY  27           H        GLY  27   2.157  11.495  -7.539
  385   1HA   GLY  27          1HA       GLY  27   2.548  12.848  -9.433
  386   2HA   GLY  27          2HA       GLY  27   0.802  12.839  -9.706
  387    H    VAL  28           H        VAL  28  -0.449  14.220  -8.015
  388    HA   VAL  28           HA       VAL  28   0.360  16.950  -8.187
  389    HB   VAL  28           HB       VAL  28  -1.496  15.598  -6.200
  390   1HG1  VAL  28          1HG1      VAL  28  -1.155  18.433  -7.183
  391   2HG1  VAL  28          2HG1      VAL  28  -2.677  17.876  -6.488
  392   3HG1  VAL  28          3HG1      VAL  28  -1.203  17.849  -5.520
  393   1HG2  VAL  28          1HG2      VAL  28  -1.766  16.316  -9.102
  394   2HG2  VAL  28          2HG2      VAL  28  -2.381  14.905  -8.239
  395   3HG2  VAL  28          3HG2      VAL  28  -3.177  16.468  -8.057
  396    H    SER  29           H        SER  29   0.836  18.360  -6.230
  397    HA   SER  29           HA       SER  29   2.302  18.886  -4.443
  398   1HB   SER  29          1HB       SER  29   1.630  17.779  -2.535
  399   2HB   SER  29          2HB       SER  29   0.368  17.207  -3.619
  400    HG   SER  29           HG       SER  29   1.322  15.288  -3.737
  401    H    ALA  30           H        ALA  30   3.935  17.221  -2.901
  402    HA   ALA  30           HA       ALA  30   6.090  16.246  -2.960
  403   1HB   ALA  30          1HB       ALA  30   4.352  14.529  -3.991
  404   2HB   ALA  30          2HB       ALA  30   5.231  14.858  -5.484
  405   3HB   ALA  30          3HB       ALA  30   6.082  14.197  -4.088
  406    H    LYS  31           H        LYS  31   6.184  18.756  -3.989
  407    HA   LYS  31           HA       LYS  31   8.286  18.546  -6.039
  408   1HB   LYS  31          1HB       LYS  31   7.006  20.089  -7.572
  409   2HB   LYS  31          2HB       LYS  31   6.266  18.498  -7.396
  410   1HG   LYS  31          1HG       LYS  31   4.421  19.341  -6.381
  411   2HG   LYS  31          2HG       LYS  31   5.367  20.435  -5.373
  412   1HD   LYS  31          1HD       LYS  31   5.715  21.839  -7.493
  413   2HD   LYS  31          2HD       LYS  31   4.436  20.863  -8.216
  414   1HE   LYS  31          1HE       LYS  31   2.812  21.627  -6.649
  415   2HE   LYS  31          2HE       LYS  31   4.057  22.284  -5.567
  416   1HZ   LYS  31          1HZ       LYS  31   4.739  23.767  -7.402
  417   2HZ   LYS  31          2HZ       LYS  31   3.414  23.223  -8.312
  418   3HZ   LYS  31          3HZ       LYS  31   3.157  24.073  -6.863
  419    HA   PRO  32           HA       PRO  32   8.623  22.071  -3.066
  420   1HB   PRO  32          1HB       PRO  32  11.125  21.461  -2.152
  421   2HB   PRO  32          2HB       PRO  32   9.647  20.778  -1.446
  422   1HG   PRO  32          1HG       PRO  32  11.607  19.541  -3.292
  423   2HG   PRO  32          2HG       PRO  32  10.650  18.807  -2.000
  424   1HD   PRO  32          1HD       PRO  32  10.079  18.633  -4.703
  425   2HD   PRO  32          2HD       PRO  32   8.914  18.354  -3.393
  426    H    VAL  33           H        VAL  33   9.189  23.930  -4.125
  427    HA   VAL  33           HA       VAL  33  11.659  23.905  -5.831
  428    HB   VAL  33           HB       VAL  33  10.408  25.478  -7.298
  429   1HG1  VAL  33          1HG1      VAL  33   9.365  22.740  -6.674
  430   2HG1  VAL  33          2HG1      VAL  33   8.487  23.733  -7.837
  431   3HG1  VAL  33          3HG1      VAL  33  10.177  23.325  -8.126
  432   1HG2  VAL  33          1HG2      VAL  33   8.948  26.334  -5.406
  433   2HG2  VAL  33          2HG2      VAL  33   8.082  25.970  -6.899
  434   3HG2  VAL  33          3HG2      VAL  33   8.018  24.843  -5.544
  435    H    ASN  34           H        ASN  34  12.959  25.797  -5.694
  436    HA   ASN  34           HA       ASN  34  12.873  27.277  -3.221
  437   1HB   ASN  34          1HB       ASN  34  14.726  28.541  -4.323
  438   2HB   ASN  34          2HB       ASN  34  14.929  26.795  -4.471
  439   1HD2  ASN  34          2HD2      ASN  34  15.069  29.622  -6.264
  440   2HD2  ASN  34          1HD2      ASN  34  14.795  28.975  -7.809
  441    H    ARG  35           H        ARG  35  10.599  28.094  -3.375
  442    HA   ARG  35           HA       ARG  35  10.487  30.650  -4.935
  443   1HB   ARG  35          1HB       ARG  35   8.767  28.233  -4.997
  444   2HB   ARG  35          2HB       ARG  35   7.906  29.771  -4.971
  445   1HG   ARG  35          1HG       ARG  35   8.233  29.680  -7.231
  446   2HG   ARG  35          2HG       ARG  35   9.818  30.331  -6.813
  447   1HD   ARG  35          1HD       ARG  35  10.403  27.744  -6.485
  448   2HD   ARG  35          2HD       ARG  35   9.079  27.556  -7.652
  449    HE   ARG  35           HE       ARG  35  11.676  28.757  -8.210
  450   1HH1  ARG  35          1HH1      ARG  35   8.292  28.745  -8.996
  451   2HH1  ARG  35          2HH1      ARG  35   8.543  29.364 -10.592
  452   1HH2  ARG  35          1HH2      ARG  35  11.985  29.561 -10.287
  453   2HH2  ARG  35          2HH2      ARG  35  10.620  29.823 -11.319
  454    HA   PRO  36           HA       PRO  36   8.845  32.430  -1.267
  455   1HB   PRO  36          1HB       PRO  36   6.762  33.972  -2.146
  456   2HB   PRO  36          2HB       PRO  36   8.462  34.390  -2.438
  457   1HG   PRO  36          1HG       PRO  36   6.483  33.128  -4.268
  458   2HG   PRO  36          2HG       PRO  36   7.731  34.334  -4.614
  459   1HD   PRO  36          1HD       PRO  36   7.992  31.688  -5.204
  460   2HD   PRO  36          2HD       PRO  36   9.370  32.758  -4.862
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  12.297 -13.057   2.525
    2   2H5*    G   1          2H5*        G   1  13.329 -14.324   1.825
    3    H4*    G   1           H4*        G   1  11.784 -16.031   2.348
    4    H3*    G   1           H3*        G   1   9.775 -13.794   2.776
    5    H2*    G   1           H2*        G   1   8.675 -15.118   4.391
    6   2HO*    G   1          2HO*        G   1   8.465 -17.126   3.678
    7    H1*    G   1           H1*        G   1  10.992 -16.223   5.470
    8    H8     G   1           H8         G   1  11.450 -12.526   4.948
    9    H1     G   1           H1         G   1   7.738 -14.002   9.981
   10   1H2     G   1          1H2         G   1   6.922 -16.135   9.623
   11   2H2     G   1          2H2         G   1   8.146 -17.234   9.030
   12   1H5*    C   2          1H5*        C   2   6.402 -16.525   0.863
   13   2H5*    C   2          2H5*        C   2   7.124 -15.408   2.041
   14    H4*    C   2           H4*        C   2   5.416 -17.810   2.766
   15    H3*    C   2           H3*        C   2   4.750 -14.864   2.479
   16    H2*    C   2           H2*        C   2   3.374 -14.977   4.374
   17   2HO*    C   2          2HO*        C   2   3.533 -17.813   4.233
   18    H1*    C   2           H1*        C   2   4.936 -16.799   5.811
   19   1H4     C   2          1H4         C   2   6.079 -11.118   8.390
   20   2H4     C   2          2H4         C   2   7.293 -10.792   7.177
   21    H5     C   2           H5         C   2   7.384 -12.090   5.103
   22    H6     C   2           H6         C   2   6.952 -14.298   4.155
   23   1H5*    C   3          1H5*        C   3  -0.108 -13.873   1.409
   24   2H5*    C   3          2H5*        C   3   1.403 -13.143   1.989
   25    H4*    C   3           H4*        C   3  -0.639 -14.574   3.716
   26    H3*    C   3           H3*        C   3   0.013 -11.653   3.277
   27    H2*    C   3           H2*        C   3  -0.334 -11.210   5.558
   28   2HO*    C   3          2HO*        C   3  -1.172 -13.747   6.268
   29    H1*    C   3           H1*        C   3   0.784 -13.577   6.505
   30   1H4     C   3          1H4         C   3   5.038  -8.762   6.873
   31   2H4     C   3          2H4         C   3   5.939  -9.595   5.626
   32    H5     C   3           H5         C   3   4.584 -10.890   3.978
   33    H6     C   3           H6         C   3   2.857 -12.581   3.834
   34   1H5*    C   4          1H5*        C   4  -3.954 -10.208   4.490
   35   2H5*    C   4          2H5*        C   4  -2.210 -10.528   4.579
   36    H4*    C   4           H4*        C   4  -3.855 -10.302   7.090
   37    H3*    C   4           H3*        C   4  -2.825  -8.017   5.376
   38    H2*    C   4           H2*        C   4  -2.080  -6.896   7.292
   39   2HO*    C   4          2HO*        C   4  -3.445  -8.725   8.971
   40    H1*    C   4           H1*        C   4  -1.292  -9.140   8.732
   41   1H4     C   4          1H4         C   4   3.688  -6.286   5.729
   42   2H4     C   4          2H4         C   4   4.140  -7.945   5.428
   43    H5     C   4           H5         C   4   1.765  -8.823   4.449
   44    H6     C   4           H6         C   4  -0.311  -9.524   5.324
   45   1H5*    U   5          1H5*        U   5  -4.600  -6.207   8.575
   46   2H5*    U   5          2H5*        U   5  -5.771  -4.997   8.014
   47    H4*    U   5           H4*        U   5  -4.275  -3.903   9.527
   48    H3*    U   5           H3*        U   5  -3.634  -3.239   6.638
   49    H2*    U   5           H2*        U   5  -1.949  -1.780   7.432
   50   2HO*    U   5          2HO*        U   5  -1.905  -1.326   9.786
   51    H1*    U   5           H1*        U   5  -1.307  -3.334   9.696
   52    H3     U   5           H3         U   5   2.467  -2.697   7.296
   53    H5     U   5           H5         U   5   0.413  -5.656   5.184
   54    H6     U   5           H6         U   5  -1.482  -5.236   6.598
   55   1H5*    G   6          1H5*        G   6  -1.810   0.077   8.192
   56   2H5*    G   6          2H5*        G   6  -3.134   1.262   8.133
   57    H4*    G   6           H4*        G   6  -1.696   2.449   6.836
   58    H3*    G   6           H3*        G   6  -2.612   0.296   4.896
   59    H2*    G   6           H2*        G   6  -1.066   1.093   3.324
   60   2HO*    G   6          2HO*        G   6  -1.547   3.300   3.442
   61    H1*    G   6           H1*        G   6   0.914   1.830   5.173
   62    H8     G   6           H8         G   6  -0.993  -1.542   5.034
   63    H1     G   6           H1         G   6   4.860  -1.505   2.367
   64   1H2     G   6          1H2         G   6   5.562   0.653   2.176
   65   2H2     G   6          2H2         G   6   5.002   1.766   3.408
   66   1H5*    A   7          1H5*        A   7  -4.482   1.922   0.899
   67   2H5*    A   7          2H5*        A   7  -3.609   0.378   0.954
   68    H4*    A   7           H4*        A   7  -2.785   1.692  -0.908
   69    H3*    A   7           H3*        A   7  -0.858   1.606   1.439
   70    H2*    A   7           H2*        A   7   0.657   2.888   0.150
   71   2HO*    A   7          2HO*        A   7  -0.506   3.057  -2.235
   72    H1*    A   7           H1*        A   7  -1.312   4.345  -1.207
   73    H8     A   7           H8         A   7  -2.113   4.689   2.376
   74   1H6     A   7          1H6         A   7   1.629   9.172   2.767
   75   2H6     A   7          2H6         A   7   1.936   7.768   3.763
   76    H2     A   7           H2         A   7   2.847   6.793  -1.117
   77   1H5*    A   8          1H5*        A   8   1.054   0.509  -1.639
   78   2H5*    A   8          2H5*        A   8   2.326  -0.731  -1.681
   79    H4*    A   8           H4*        A   8   3.295   1.442  -2.188
   80    H3*    A   8           H3*        A   8   3.939   0.340   0.567
   81    H2*    A   8           H2*        A   8   5.254   2.236   1.062
   82   2HO*    A   8          2HO*        A   8   5.687   3.789  -0.667
   83    H1*    A   8           H1*        A   8   3.611   4.081  -0.253
   84    H8     A   8           H8         A   8   1.401   1.769   1.678
   85   1H6     A   8          1H6         A   8   2.799   4.968   6.774
   86   2H6     A   8          2H6         A   8   1.493   4.115   5.982
   87    H2     A   8           H2         A   8   5.504   6.387   3.468
   88   1H5*    A   9          2H5*        A   9   8.321  -1.311  -2.484
   89   2H5*    A   9          1H5*        A   9   7.409  -0.392  -1.269
   90    H4*    A   9           H4*        A   9   9.476   0.589  -2.853
   91    H3*    A   9           H3*        A   9   7.236   1.967  -1.348
   92    H2*    A   9           H2*        A   9   8.046   4.041  -2.165
   93   2HO*    A   9          2HO*        A   9  10.247   2.903  -3.447
   94    H1*    A   9           H1*        A   9   8.622   3.067  -4.720
   95    H8     A   9           H8         A   9   6.312   4.448  -2.302
   96   1H6     A   9          1H6         A   9   2.334   5.302  -6.337
   97   2H6     A   9          2H6         A   9   1.763   4.102  -5.199
   98    H2     A   9           H2         A   9   5.136   1.793  -8.025
   99   1H5*    A  10          1H5*        A  10  10.211   0.756   3.645
  100   2H5*    A  10          2H5*        A  10   8.498   1.091   3.317
  101    H4*    A  10           H4*        A  10  10.418   3.391   3.488
  102    H3*    A  10           H3*        A  10   9.348   1.773   5.802
  103    H2*    A  10           H2*        A  10   8.818   3.728   6.991
  104   2HO*    A  10          2HO*        A  10  10.556   5.029   5.170
  105    H1*    A  10           H1*        A  10   7.972   5.240   4.810
  106    H8     A  10           H8         A  10   6.341   2.188   3.942
  107   1H6     A  10          1H6         A  10   2.799   1.852   7.317
  108   2H6     A  10          2H6         A  10   2.250   3.012   8.505
  109    H2     A  10           H2         A  10   5.788   5.675   9.311
  110   1H5*    A  11          1H5*        A  11  10.335   4.281   8.556
  111   2H5*    A  11          2H5*        A  11  11.147   3.249   9.757
  112    H4*    A  11           H4*        A  11   8.832   4.055  10.407
  113    H3*    A  11           H3*        A  11   9.472   1.100  10.233
  114    H2*    A  11           H2*        A  11   7.268   0.572  10.849
  115   2HO*    A  11          2HO*        A  11   6.901   3.290  11.585
  116    H1*    A  11           H1*        A  11   6.019   2.652   9.490
  117    H8     A  11           H8         A  11   8.670   0.977   7.350
  118   1H6     A  11          1H6         A  11   4.633  -3.425   6.122
  119   2H6     A  11          2H6         A  11   5.514  -2.296   5.120
  120    H2     A  11           H2         A  11   2.690  -0.588   9.115
  121   1H5*    G  12          1H5*        G  12   9.040  -1.825  13.501
  122   2H5*    G  12          2H5*        G  12   8.940  -1.011  11.931
  123    H4*    G  12           H4*        G  12   6.844  -0.137  13.771
  124    H3*    G  12           H3*        G  12   7.098  -3.080  13.106
  125    H2*    G  12           H2*        G  12   4.796  -3.189  12.617
  126   2HO*    G  12          2HO*        G  12   4.590  -1.404  14.543
  127    H1*    G  12           H1*        G  12   4.594  -0.673  11.427
  128    H8     G  12           H8         G  12   7.519  -1.582   9.694
  129    H1     G  12           H1         G  12   2.825  -5.696   8.185
  130   1H2     G  12          1H2         G  12   1.112  -5.422   9.558
  131   2H2     G  12          2H2         G  12   1.359  -4.694  11.129
  132   1H5*    G  13          1H5*        G  13   4.254  -3.266  15.992
  133   2H5*    G  13          2H5*        G  13   4.549  -4.408  17.319
  134    H4*    G  13           H4*        G  13   2.455  -4.984  16.248
  135    H3*    G  13           H3*        G  13   4.739  -6.832  15.498
  136    H2*    G  13           H2*        G  13   3.263  -8.045  14.148
  137   2HO*    G  13          2HO*        G  13   1.043  -6.679  15.244
  138    H1*    G  13           H1*        G  13   1.715  -5.875  13.301
  139    H8     G  13           H8         G  13   5.229  -4.853  12.796
  140    H1     G  13           H1         G  13   3.271  -9.212   8.504
  141   1H2     G  13          1H2         G  13   1.107  -9.792   9.049
  142   2H2     G  13          2H2         G  13   0.880 -10.023  10.769
  143   1H5*    G  14          1H5*        G  14   0.046  -9.718  17.406
  144   2H5*    G  14          2H5*        G  14   1.462 -10.383  18.251
  145    H4*    G  14           H4*        G  14   0.018 -12.009  16.829
  146    H3*    G  14           H3*        G  14   3.021 -11.765  16.509
  147    H2*    G  14           H2*        G  14   2.931 -13.497  14.896
  148   2HO*    G  14          2HO*        G  14   0.458 -14.056  16.100
  149    H1*    G  14           H1*        G  14   0.555 -12.645  13.707
  150    H8     G  14           H8         G  14   2.810  -9.726  14.490
  151    H1     G  14           H1         G  14   4.437 -12.884   9.123
  152   1H2     G  14          1H2         G  14   3.426 -14.862   9.099
  153   2H2     G  14          2H2         G  14   1.963 -15.104  10.029
  154   1H5*    C  15          1H5*        C  15   2.179 -15.496  16.729
  155   2H5*    C  15          2H5*        C  15   3.064 -16.543  17.864
  156    H4*    C  15           H4*        C  15   3.276 -17.590  15.739
  157    H3*    C  15           H3*        C  15   5.750 -15.969  16.404
  158    H2*    C  15           H2*        C  15   6.711 -16.718  14.383
  159   2HO*    C  15          2HO*        C  15   6.466 -18.775  14.005
  160    H1*    C  15           H1*        C  15   4.283 -16.806  12.949
  161   1H4     C  15          1H4         C  15   7.383 -11.790  10.663
  162   2H4     C  15          2H4         C  15   7.370 -10.988  12.222
  163    H5     C  15           H5         C  15   5.902 -11.824  14.020
  164    H6     C  15           H6         C  15   4.781 -13.781  14.883
  165   2H    ASP   2          2H        ASP   2   9.724 -10.452  -1.536
  166   1H    ASP   2          1H        ASP   2   9.739 -12.139  -1.693
  167   3H    ASP   2          3H        ASP   2  11.097 -11.335  -1.065
  168    HA   ASP   2           HA       ASP   2  10.029 -12.227   0.821
  169   1HB   ASP   2          1HB       ASP   2   9.027  -9.389   0.478
  170   2HB   ASP   2          2HB       ASP   2   9.477 -10.183   1.983
  171    H    ALA   3           H        ALA   3   7.751 -11.226   2.070
  172    HA   ALA   3           HA       ALA   3   5.575 -12.545   0.496
  173   1HB   ALA   3          1HB       ALA   3   6.064 -12.014   3.434
  174   2HB   ALA   3          2HB       ALA   3   4.568 -12.717   2.816
  175   3HB   ALA   3          3HB       ALA   3   6.098 -13.572   2.611
  176    H    GLN   4           H        GLN   4   6.341  -9.644   2.384
  177    HA   GLN   4           HA       GLN   4   3.734  -8.430   2.135
  178   1HB   GLN   4          1HB       GLN   4   5.613  -7.907   3.776
  179   2HB   GLN   4          2HB       GLN   4   6.445  -7.103   2.449
  180   1HG   GLN   4          1HG       GLN   4   4.319  -5.719   2.138
  181   2HG   GLN   4          2HG       GLN   4   3.799  -6.352   3.701
  182   1HE2  GLN   4          2HE2      GLN   4   5.315  -3.715   2.365
  183   2HE2  GLN   4          1HE2      GLN   4   6.260  -3.237   3.688
  184    H    THR   5           H        THR   5   6.805  -7.847   0.416
  185    HA   THR   5           HA       THR   5   5.919  -5.983  -1.498
  186    HB   THR   5           HB       THR   5   7.791  -8.362  -1.814
  187    HG1  THR   5           HG1      THR   5   8.959  -7.222  -0.515
  188   1HG2  THR   5          1HG2      THR   5   7.379  -5.854  -3.450
  189   2HG2  THR   5          2HG2      THR   5   8.837  -6.843  -3.564
  190   3HG2  THR   5          3HG2      THR   5   7.270  -7.529  -3.995
  191    H    ARG   6           H        ARG   6   5.429  -9.454  -1.275
  192    HA   ARG   6           HA       ARG   6   4.151  -9.794  -3.874
  193   1HB   ARG   6          1HB       ARG   6   4.934 -11.332  -1.548
  194   2HB   ARG   6          2HB       ARG   6   3.267 -11.716  -1.986
  195   1HG   ARG   6          1HG       ARG   6   4.127 -13.091  -3.562
  196   2HG   ARG   6          2HG       ARG   6   4.595 -11.635  -4.441
  197   1HD   ARG   6          1HD       ARG   6   6.646 -12.766  -4.253
  198   2HD   ARG   6          2HD       ARG   6   6.698 -11.709  -2.829
  199    HE   ARG   6           HE       ARG   6   5.385 -13.899  -1.852
  200   1HH1  ARG   6          1HH1      ARG   6   8.305 -13.521  -3.699
  201   2HH1  ARG   6          2HH1      ARG   6   9.044 -14.937  -3.035
  202   1HH2  ARG   6          1HH2      ARG   6   6.360 -15.736  -1.001
  203   2HH2  ARG   6          2HH2      ARG   6   7.951 -16.183  -1.519
  204    H    ARG   7           H        ARG   7   3.095  -9.537  -0.496
  205    HA   ARG   7           HA       ARG   7   0.308  -9.709  -0.958
  206   1HB   ARG   7          1HB       ARG   7   1.326  -9.878   1.243
  207   2HB   ARG   7          2HB       ARG   7   1.980  -8.247   1.109
  208   1HG   ARG   7          1HG       ARG   7  -0.467  -7.468   0.852
  209   2HG   ARG   7          2HG       ARG   7  -0.907  -9.073   1.435
  210   1HD   ARG   7          1HD       ARG   7  -0.192  -8.632   3.564
  211   2HD   ARG   7          2HD       ARG   7   1.161  -7.632   3.016
  212    HE   ARG   7           HE       ARG   7  -0.277  -5.767   3.120
  213   1HH1  ARG   7          1HH1      ARG   7  -2.097  -8.708   2.977
  214   2HH1  ARG   7          2HH1      ARG   7  -3.614  -7.906   3.186
  215   1HH2  ARG   7          1HH2      ARG   7  -2.208  -4.736   3.387
  216   2HH2  ARG   7          2HH2      ARG   7  -3.674  -5.647   3.418
  217    H    ARG   8           H        ARG   8   2.576  -7.035  -1.254
  218    HA   ARG   8           HA       ARG   8   0.796  -4.829  -1.389
  219   1HB   ARG   8          1HB       ARG   8   3.484  -5.280  -1.609
  220   2HB   ARG   8          2HB       ARG   8   3.083  -4.936  -3.290
  221   1HG   ARG   8          1HG       ARG   8   3.565  -2.811  -2.390
  222   2HG   ARG   8          2HG       ARG   8   1.806  -2.887  -2.357
  223   1HD   ARG   8          1HD       ARG   8   2.808  -2.043  -0.201
  224   2HD   ARG   8          2HD       ARG   8   1.833  -3.509   0.011
  225    HE   ARG   8           HE       ARG   8   3.811  -4.672   0.562
  226   1HH1  ARG   8          1HH1      ARG   8   4.538  -1.776  -1.191
  227   2HH1  ARG   8          2HH1      ARG   8   6.249  -1.967  -1.029
  228   1HH2  ARG   8          1HH2      ARG   8   6.034  -4.914   0.769
  229   2HH2  ARG   8          2HH2      ARG   8   7.095  -3.733   0.074
  230    H    GLU   9           H        GLU   9   1.752  -7.187  -3.860
  231    HA   GLU   9           HA       GLU   9   0.374  -5.925  -6.044
  232   1HB   GLU   9          1HB       GLU   9   0.957  -8.848  -5.425
  233   2HB   GLU   9          2HB       GLU   9   0.481  -8.237  -7.009
  234   1HG   GLU   9          1HG       GLU   9   2.649  -6.624  -6.125
  235   2HG   GLU   9          2HG       GLU   9   3.106  -8.301  -5.829
  236    H    ARG  10           H        ARG  10  -0.571  -7.937  -3.367
  237    HA   ARG  10           HA       ARG  10  -3.318  -8.356  -4.257
  238   1HB   ARG  10          1HB       ARG  10  -1.500  -9.187  -2.159
  239   2HB   ARG  10          2HB       ARG  10  -3.024  -8.661  -1.449
  240   1HG   ARG  10          1HG       ARG  10  -4.250 -10.323  -2.505
  241   2HG   ARG  10          2HG       ARG  10  -3.106 -10.458  -3.843
  242   1HD   ARG  10          1HD       ARG  10  -1.506 -11.631  -2.456
  243   2HD   ARG  10          2HD       ARG  10  -2.476 -11.328  -1.001
  244    HE   ARG  10           HE       ARG  10  -4.202 -12.585  -2.828
  245   1HH1  ARG  10          1HH1      ARG  10  -1.227 -13.282  -1.182
  246   2HH1  ARG  10          2HH1      ARG  10  -1.517 -14.987  -1.132
  247   1HH2  ARG  10          1HH2      ARG  10  -4.569 -14.803  -2.758
  248   2HH2  ARG  10          2HH2      ARG  10  -3.399 -15.846  -2.020
  249    H    ARG  11           H        ARG  11  -1.489  -5.818  -2.860
  250    HA   ARG  11           HA       ARG  11  -3.876  -4.543  -1.636
  251   1HB   ARG  11          1HB       ARG  11  -0.922  -3.854  -1.734
  252   2HB   ARG  11          2HB       ARG  11  -2.140  -2.910  -0.875
  253   1HG   ARG  11          1HG       ARG  11  -1.395  -5.805  -0.332
  254   2HG   ARG  11          2HG       ARG  11  -1.037  -4.436   0.704
  255   1HD   ARG  11          1HD       ARG  11  -3.102  -4.542   1.648
  256   2HD   ARG  11          2HD       ARG  11  -3.887  -4.556   0.065
  257    HE   ARG  11           HE       ARG  11  -2.551  -7.074   0.625
  258   1HH1  ARG  11          1HH1      ARG  11  -5.422  -5.195   1.163
  259   2HH1  ARG  11          2HH1      ARG  11  -6.421  -6.583   1.423
  260   1HH2  ARG  11          1HH2      ARG  11  -3.863  -8.868   0.965
  261   2HH2  ARG  11          2HH2      ARG  11  -5.546  -8.650   1.312
  262    H    ALA  12           H        ALA  12  -2.675  -4.791  -4.707
  263    HA   ALA  12           HA       ALA  12  -2.441  -2.108  -5.665
  264   1HB   ALA  12          1HB       ALA  12  -2.024  -4.208  -6.958
  265   2HB   ALA  12          2HB       ALA  12  -3.755  -4.542  -6.948
  266   3HB   ALA  12          3HB       ALA  12  -3.134  -3.137  -7.815
  267    H    GLU  13           H        GLU  13  -5.191  -3.979  -4.582
  268    HA   GLU  13           HA       GLU  13  -7.227  -2.192  -5.663
  269   1HB   GLU  13          1HB       GLU  13  -7.196  -4.354  -3.525
  270   2HB   GLU  13          2HB       GLU  13  -8.666  -3.569  -4.104
  271   1HG   GLU  13          1HG       GLU  13  -7.884  -4.277  -6.465
  272   2HG   GLU  13          2HG       GLU  13  -6.779  -5.366  -5.625
  273    H    LYS  14           H        LYS  14  -5.371  -2.546  -2.669
  274    HA   LYS  14           HA       LYS  14  -6.876  -0.474  -1.233
  275   1HB   LYS  14          1HB       LYS  14  -4.217  -1.890  -0.803
  276   2HB   LYS  14          2HB       LYS  14  -4.956  -0.803   0.375
  277   1HG   LYS  14          1HG       LYS  14  -6.465  -3.170  -0.725
  278   2HG   LYS  14          2HG       LYS  14  -5.379  -3.337   0.656
  279   1HD   LYS  14          1HD       LYS  14  -6.677  -1.934   2.013
  280   2HD   LYS  14          2HD       LYS  14  -7.466  -1.169   0.632
  281   1HE   LYS  14          1HE       LYS  14  -8.358  -3.629   0.182
  282   2HE   LYS  14          2HE       LYS  14  -8.061  -3.811   1.923
  283   1HZ   LYS  14          1HZ       LYS  14  -9.264  -1.685   2.246
  284   2HZ   LYS  14          2HZ       LYS  14  -9.680  -1.700   0.599
  285   3HZ   LYS  14          3HZ       LYS  14 -10.250  -2.921   1.633
  286    H    GLN  15           H        GLN  15  -3.932  -0.839  -3.070
  287    HA   GLN  15           HA       GLN  15  -2.844   1.799  -2.712
  288   1HB   GLN  15          1HB       GLN  15  -2.390  -0.703  -4.171
  289   2HB   GLN  15          2HB       GLN  15  -1.951   0.694  -5.138
  290   1HG   GLN  15          1HG       GLN  15  -0.258   1.331  -3.696
  291   2HG   GLN  15          2HG       GLN  15  -1.070   0.641  -2.290
  292   1HE2  GLN  15          2HE2      GLN  15  -1.351  -1.910  -2.542
  293   2HE2  GLN  15          1HE2      GLN  15   0.035  -2.736  -3.069
  294    H    ALA  16           H        ALA  16  -4.641   0.250  -5.384
  295    HA   ALA  16           HA       ALA  16  -4.847   2.619  -6.998
  296   1HB   ALA  16          1HB       ALA  16  -6.534   0.100  -6.772
  297   2HB   ALA  16          2HB       ALA  16  -6.692   1.272  -8.080
  298   3HB   ALA  16          3HB       ALA  16  -5.190   0.370  -7.880
  299    H    GLN  17           H        GLN  17  -6.672   1.466  -4.214
  300    HA   GLN  17           HA       GLN  17  -8.910   3.327  -4.650
  301   1HB   GLN  17          1HB       GLN  17  -7.979   1.321  -2.633
  302   2HB   GLN  17          2HB       GLN  17  -9.096   2.563  -2.067
  303   1HG   GLN  17          1HG       GLN  17  -9.648   0.983  -4.578
  304   2HG   GLN  17          2HG       GLN  17 -10.128   0.384  -2.991
  305   1HE2  GLN  17          2HE2      GLN  17 -11.519   1.833  -5.521
  306   2HE2  GLN  17          1HE2      GLN  17 -12.607   2.879  -4.745
  307    H    TRP  18           H        TRP  18  -5.951   3.128  -2.776
  308    HA   TRP  18           HA       TRP  18  -6.299   5.651  -1.364
  309   1HB   TRP  18          1HB       TRP  18  -4.881   3.847  -0.505
  310   2HB   TRP  18          2HB       TRP  18  -3.952   3.831  -1.987
  311    HD1  TRP  18           HD1      TRP  18  -4.281   5.745   1.271
  312    HE1  TRP  18           HE1      TRP  18  -2.411   7.535   1.352
  313    HE3  TRP  18           HE3      TRP  18  -2.515   5.371  -3.436
  314    HZ2  TRP  18           HZ2      TRP  18  -0.413   8.627  -0.378
  315    HZ3  TRP  18           HZ3      TRP  18  -0.663   6.744  -4.215
  316    HH2  TRP  18           HH2      TRP  18   0.411   8.362  -2.717
  317    H    LYS  19           H        LYS  19  -4.411   4.502  -4.116
  318    HA   LYS  19           HA       LYS  19  -3.098   6.913  -4.838
  319   1HB   LYS  19          1HB       LYS  19  -4.053   4.486  -6.388
  320   2HB   LYS  19          2HB       LYS  19  -3.080   5.755  -7.117
  321   1HG   LYS  19          1HG       LYS  19  -1.257   5.342  -5.587
  322   2HG   LYS  19          2HG       LYS  19  -2.233   4.199  -4.667
  323   1HD   LYS  19          1HD       LYS  19  -2.223   2.601  -6.402
  324   2HD   LYS  19          2HD       LYS  19  -1.720   3.786  -7.608
  325   1HE   LYS  19          1HE       LYS  19   0.507   3.865  -6.756
  326   2HE   LYS  19          2HE       LYS  19   0.042   3.036  -5.257
  327   1HZ   LYS  19          1HZ       LYS  19  -0.622   1.112  -6.591
  328   2HZ   LYS  19          2HZ       LYS  19  -0.083   1.894  -8.000
  329   3HZ   LYS  19          3HZ       LYS  19   1.029   1.464  -6.793
  330    H    ALA  20           H        ALA  20  -6.272   5.584  -5.611
  331    HA   ALA  20           HA       ALA  20  -7.041   7.469  -7.578
  332   1HB   ALA  20          1HB       ALA  20  -8.285   5.544  -5.730
  333   2HB   ALA  20          2HB       ALA  20  -9.350   6.849  -6.248
  334   3HB   ALA  20          3HB       ALA  20  -8.591   5.802  -7.448
  335    H    ALA  21           H        ALA  21  -6.935   7.647  -4.072
  336    HA   ALA  21           HA       ALA  21  -7.982  10.441  -4.222
  337   1HB   ALA  21          1HB       ALA  21  -9.400   8.772  -3.021
  338   2HB   ALA  21          2HB       ALA  21  -8.050   8.456  -1.931
  339   3HB   ALA  21          3HB       ALA  21  -8.818  10.044  -1.943
  340    H    ASN  22           H        ASN  22  -5.222   9.388  -4.505
  341    HA   ASN  22           HA       ASN  22  -3.924  11.309  -2.688
  342   1HB   ASN  22          1HB       ASN  22  -3.345   8.332  -2.608
  343   2HB   ASN  22          2HB       ASN  22  -2.364   9.564  -1.819
  344   1HD2  ASN  22          2HD2      ASN  22  -4.798   7.412  -1.212
  345   2HD2  ASN  22          1HD2      ASN  22  -5.545   8.178   0.105
  346    HA   PRO  23           HA       PRO  23  -1.932  10.380  -6.851
  347   1HB   PRO  23          1HB       PRO  23  -2.721  12.647  -8.172
  348   2HB   PRO  23          2HB       PRO  23  -3.654  11.137  -8.213
  349   1HG   PRO  23          1HG       PRO  23  -4.114  13.602  -6.625
  350   2HG   PRO  23          2HG       PRO  23  -5.283  12.499  -7.366
  351   1HD   PRO  23          1HD       PRO  23  -4.639  12.500  -4.697
  352   2HD   PRO  23          2HD       PRO  23  -5.287  11.096  -5.558
  353    H    LEU  24           H        LEU  24  -2.410  13.138  -4.759
  354    HA   LEU  24           HA       LEU  24  -0.197  14.774  -5.498
  355   1HB   LEU  24          1HB       LEU  24  -0.733  15.872  -3.491
  356   2HB   LEU  24          2HB       LEU  24  -2.210  14.947  -3.730
  357    HG   LEU  24           HG       LEU  24   0.114  13.894  -2.084
  358   1HD1  LEU  24          1HD1      LEU  24  -1.582  16.089  -1.460
  359   2HD1  LEU  24          2HD1      LEU  24  -2.097  14.728  -0.464
  360   3HD1  LEU  24          3HD1      LEU  24  -0.422  15.278  -0.408
  361   1HD2  LEU  24          1HD2      LEU  24  -2.184  12.641  -3.039
  362   2HD2  LEU  24          2HD2      LEU  24  -1.220  12.088  -1.671
  363   3HD2  LEU  24          3HD2      LEU  24  -2.636  13.106  -1.402
  364    H    LEU  25           H        LEU  25  -0.431  11.880  -3.531
  365    HA   LEU  25           HA       LEU  25   2.501  11.852  -3.027
  366   1HB   LEU  25          1HB       LEU  25   0.007  10.572  -1.949
  367   2HB   LEU  25          2HB       LEU  25   1.510   9.655  -1.811
  368    HG   LEU  25           HG       LEU  25   1.659  12.515  -1.021
  369   1HD1  LEU  25          1HD1      LEU  25  -0.055  10.473   0.365
  370   2HD1  LEU  25          2HD1      LEU  25   0.825  11.662   1.327
  371   3HD1  LEU  25          3HD1      LEU  25  -0.350  12.195   0.125
  372   1HD2  LEU  25          1HD2      LEU  25   2.841   9.872  -0.276
  373   2HD2  LEU  25          2HD2      LEU  25   3.645  11.412  -0.583
  374   3HD2  LEU  25          3HD2      LEU  25   2.821  11.137   0.952
  375    H    VAL  26           H        VAL  26   1.334  11.660  -5.605
  376    HA   VAL  26           HA       VAL  26   2.463   9.156  -6.618
  377    HB   VAL  26           HB       VAL  26  -0.405   9.699  -6.027
  378   1HG1  VAL  26          1HG1      VAL  26   0.448   8.649  -8.739
  379   2HG1  VAL  26          2HG1      VAL  26  -1.161   8.398  -8.057
  380   3HG1  VAL  26          3HG1      VAL  26  -0.590  10.035  -8.389
  381   1HG2  VAL  26          1HG2      VAL  26   1.341   7.269  -6.502
  382   2HG2  VAL  26          2HG2      VAL  26   0.583   7.800  -4.999
  383   3HG2  VAL  26          3HG2      VAL  26  -0.407   7.134  -6.298
  384    H    GLY  27           H        GLY  27   2.470   9.312  -9.082
  385   1HA   GLY  27          1HA       GLY  27   2.780  10.574 -11.051
  386   2HA   GLY  27          2HA       GLY  27   1.350  11.470 -10.540
  387    H    VAL  28           H        VAL  28   1.887  13.041  -8.599
  388    HA   VAL  28           HA       VAL  28   3.326  15.242  -9.273
  389    HB   VAL  28           HB       VAL  28   2.427  13.939  -6.839
  390   1HG1  VAL  28          1HG1      VAL  28   4.924  15.653  -6.674
  391   2HG1  VAL  28          2HG1      VAL  28   3.888  15.286  -5.294
  392   3HG1  VAL  28          3HG1      VAL  28   4.746  13.986  -6.124
  393   1HG2  VAL  28          1HG2      VAL  28   2.795  16.808  -7.742
  394   2HG2  VAL  28          2HG2      VAL  28   1.303  15.867  -7.766
  395   3HG2  VAL  28          3HG2      VAL  28   2.012  16.357  -6.227
  396    H    SER  29           H        SER  29   5.533  16.010  -8.825
  397    HA   SER  29           HA       SER  29   7.573  14.019  -9.369
  398   1HB   SER  29          1HB       SER  29   7.618  16.957  -8.626
  399   2HB   SER  29          2HB       SER  29   9.056  16.054  -9.090
  400    HG   SER  29           HG       SER  29   6.813  16.793 -10.608
  401    H    ALA  30           H        ALA  30   6.413  13.077  -7.108
  402    HA   ALA  30           HA       ALA  30   6.600  13.027  -4.660
  403   1HB   ALA  30          1HB       ALA  30   8.955  11.857  -6.154
  404   2HB   ALA  30          2HB       ALA  30   8.638  11.509  -4.455
  405   3HB   ALA  30          3HB       ALA  30   7.460  11.043  -5.685
  406    H    LYS  31           H        LYS  31   6.964  15.509  -4.513
  407    HA   LYS  31           HA       LYS  31   9.705  16.018  -3.417
  408   1HB   LYS  31          1HB       LYS  31   9.292  18.374  -4.317
  409   2HB   LYS  31          2HB       LYS  31   9.511  17.130  -5.547
  410   1HG   LYS  31          1HG       LYS  31   7.331  17.252  -6.251
  411   2HG   LYS  31          2HG       LYS  31   6.720  17.558  -4.625
  412   1HD   LYS  31          1HD       LYS  31   6.408  19.561  -5.980
  413   2HD   LYS  31          2HD       LYS  31   7.641  19.879  -4.759
  414   1HE   LYS  31          1HE       LYS  31   9.348  19.150  -6.578
  415   2HE   LYS  31          2HE       LYS  31   8.012  19.407  -7.719
  416   1HZ   LYS  31          1HZ       LYS  31   8.910  21.383  -5.688
  417   2HZ   LYS  31          2HZ       LYS  31   9.320  21.444  -7.332
  418   3HZ   LYS  31          3HZ       LYS  31   7.697  21.617  -6.855
  419    HA   PRO  32           HA       PRO  32   7.613  17.455   0.145
  420   1HB   PRO  32          1HB       PRO  32   9.105  19.625   0.910
  421   2HB   PRO  32          2HB       PRO  32   9.664  17.950   1.096
  422   1HG   PRO  32          1HG       PRO  32  10.354  19.953  -0.995
  423   2HG   PRO  32          2HG       PRO  32  11.385  18.759  -0.191
  424   1HD   PRO  32          1HD       PRO  32  10.383  18.424  -2.700
  425   2HD   PRO  32          2HD       PRO  32  10.763  17.072  -1.610
  426    H    VAL  33           H        VAL  33   5.747  18.124  -1.267
  427    HA   VAL  33           HA       VAL  33   5.514  21.107  -1.495
  428    HB   VAL  33           HB       VAL  33   5.503  19.893  -3.631
  429   1HG1  VAL  33          1HG1      VAL  33   3.712  18.111  -2.104
  430   2HG1  VAL  33          2HG1      VAL  33   3.178  18.448  -3.751
  431   3HG1  VAL  33          3HG1      VAL  33   4.771  17.748  -3.467
  432   1HG2  VAL  33          1HG2      VAL  33   2.777  20.892  -2.756
  433   2HG2  VAL  33          2HG2      VAL  33   4.059  21.845  -3.500
  434   3HG2  VAL  33          3HG2      VAL  33   3.231  20.600  -4.434
  435    H    ASN  34           H        ASN  34   3.470  22.029  -0.838
  436    HA   ASN  34           HA       ASN  34   2.014  20.370   1.169
  437   1HB   ASN  34          1HB       ASN  34   2.934  23.103   0.908
  438   2HB   ASN  34          2HB       ASN  34   1.199  23.083   1.220
  439   1HD2  ASN  34          2HD2      ASN  34   0.473  22.352   3.300
  440   2HD2  ASN  34          1HD2      ASN  34   1.543  21.961   4.558
  441    H    ARG  35           H        ARG  35   1.218  19.546  -1.272
  442    HA   ARG  35           HA       ARG  35  -0.780  21.022  -2.653
  443   1HB   ARG  35          1HB       ARG  35  -0.400  18.052  -2.168
  444   2HB   ARG  35          2HB       ARG  35  -1.483  18.722  -3.389
  445   1HG   ARG  35          1HG       ARG  35   1.301  19.756  -3.404
  446   2HG   ARG  35          2HG       ARG  35   1.093  18.079  -3.907
  447   1HD   ARG  35          1HD       ARG  35  -0.598  20.331  -5.036
  448   2HD   ARG  35          2HD       ARG  35   0.912  19.787  -5.794
  449    HE   ARG  35           HE       ARG  35  -0.708  17.502  -5.208
  450   1HH1  ARG  35          1HH1      ARG  35  -0.551  20.262  -7.305
  451   2HH1  ARG  35          2HH1      ARG  35  -1.409  19.484  -8.590
  452   1HH2  ARG  35          1HH2      ARG  35  -1.823  16.497  -6.883
  453   2HH2  ARG  35          2HH2      ARG  35  -2.126  17.362  -8.353
  454    HA   PRO  36           HA       PRO  36  -3.728  20.895   0.766
  455   1HB   PRO  36          1HB       PRO  36  -5.512  22.644  -0.355
  456   2HB   PRO  36          2HB       PRO  36  -4.041  23.171   0.487
  457   1HG   PRO  36          1HG       PRO  36  -4.562  22.924  -2.435
  458   2HG   PRO  36          2HG       PRO  36  -3.666  24.169  -1.550
  459   1HD   PRO  36          1HD       PRO  36  -2.460  22.149  -2.921
  460   2HD   PRO  36          2HD       PRO  36  -1.738  22.930  -1.497
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  12.570 -17.903   1.097
    2   2H5*    G   1          2H5*        G   1  12.498 -16.691   2.392
    3    H4*    G   1           H4*        G   1  11.658 -19.603   2.588
    4    H3*    G   1           H3*        G   1  10.103 -17.006   2.399
    5    H2*    G   1           H2*        G   1   8.520 -17.824   3.957
    6   2HO*    G   1          2HO*        G   1   7.935 -19.823   3.593
    7    H1*    G   1           H1*        G   1  10.310 -19.230   5.529
    8    H8     G   1           H8         G   1  11.719 -15.851   4.710
    9    H1     G   1           H1         G   1   7.224 -15.743   9.297
   10   1H2     G   1          1H2         G   1   5.999 -17.636   9.152
   11   2H2     G   1          2H2         G   1   6.828 -19.080   8.615
   12   1H5*    C   2          1H5*        C   2   6.055 -17.596   0.794
   13   2H5*    C   2          2H5*        C   2   6.800 -16.353   1.821
   14    H4*    C   2           H4*        C   2   4.671 -18.357   2.619
   15    H3*    C   2           H3*        C   2   4.728 -15.350   2.262
   16    H2*    C   2           H2*        C   2   3.286 -15.081   4.097
   17   2HO*    C   2          2HO*        C   2   2.330 -17.064   5.054
   18    H1*    C   2           H1*        C   2   4.327 -17.137   5.663
   19   1H4     C   2          1H4         C   2   7.138 -12.028   8.111
   20   2H4     C   2          2H4         C   2   7.750 -11.534   6.548
   21    H5     C   2           H5         C   2   7.898 -13.258   4.771
   22    H6     C   2           H6         C   2   7.085 -15.502   4.125
   23   1H5*    C   3          1H5*        C   3   0.422 -13.509   1.497
   24   2H5*    C   3          2H5*        C   3   1.666 -12.347   1.994
   25    H4*    C   3           H4*        C   3  -0.029 -14.156   3.715
   26    H3*    C   3           H3*        C   3   0.585 -11.202   3.551
   27    H2*    C   3           H2*        C   3   0.397 -10.982   5.872
   28   2HO*    C   3          2HO*        C   3  -0.386 -12.775   7.166
   29    H1*    C   3           H1*        C   3   1.549 -13.417   6.549
   30   1H4     C   3          1H4         C   3   6.021  -8.879   7.152
   31   2H4     C   3          2H4         C   3   6.525  -9.191   5.507
   32    H5     C   3           H5         C   3   5.369 -10.773   4.081
   33    H6     C   3           H6         C   3   3.537 -12.332   3.900
   34   1H5*    C   4          1H5*        C   4  -3.850 -10.140   4.871
   35   2H5*    C   4          2H5*        C   4  -2.091 -10.085   4.668
   36    H4*    C   4           H4*        C   4  -3.574  -9.809   7.301
   37    H3*    C   4           H3*        C   4  -2.290  -7.785   5.440
   38    H2*    C   4           H2*        C   4  -1.601  -6.542   7.313
   39   2HO*    C   4          2HO*        C   4  -3.718  -7.851   8.545
   40    H1*    C   4           H1*        C   4  -0.983  -8.735   8.908
   41   1H4     C   4          1H4         C   4   4.099  -6.169   5.757
   42   2H4     C   4          2H4         C   4   4.554  -7.849   5.640
   43    H5     C   4           H5         C   4   2.165  -8.761   4.654
   44    H6     C   4           H6         C   4   0.034  -9.321   5.530
   45   1H5*    U   5          1H5*        U   5  -4.556  -5.790   8.091
   46   2H5*    U   5          2H5*        U   5  -5.540  -4.434   7.498
   47    H4*    U   5           H4*        U   5  -4.114  -3.650   9.291
   48    H3*    U   5           H3*        U   5  -3.189  -2.739   6.542
   49    H2*    U   5           H2*        U   5  -1.477  -1.523   7.591
   50   2HO*    U   5          2HO*        U   5  -3.251  -1.538   9.750
   51    H1*    U   5           H1*        U   5  -1.119  -3.342   9.719
   52    H3     U   5           H3         U   5   2.732  -2.463   7.402
   53    H5     U   5           H5         U   5   0.861  -5.568   5.321
   54    H6     U   5           H6         U   5  -1.114  -5.107   6.596
   55   1H5*    G   6          1H5*        G   6  -2.380  -0.079   7.604
   56   2H5*    G   6          2H5*        G   6  -2.755   1.426   8.459
   57    H4*    G   6           H4*        G   6  -2.019   2.747   6.713
   58    H3*    G   6           H3*        G   6  -2.705   0.421   4.876
   59    H2*    G   6           H2*        G   6  -1.129   1.214   3.347
   60   2HO*    G   6          2HO*        G   6  -0.687   3.278   3.086
   61    H1*    G   6           H1*        G   6   0.673   2.223   5.271
   62    H8     G   6           H8         G   6  -0.876  -1.315   5.245
   63    H1     G   6           H1         G   6   5.023  -0.840   2.726
   64   1H2     G   6          1H2         G   6   5.526   1.329   2.421
   65   2H2     G   6          2H2         G   6   4.779   2.498   3.496
   66   1H5*    A   7          1H5*        A   7  -4.668   1.570   0.801
   67   2H5*    A   7          2H5*        A   7  -3.607   0.147   0.810
   68    H4*    A   7           H4*        A   7  -2.918   1.620  -0.978
   69    H3*    A   7           H3*        A   7  -1.055   1.712   1.421
   70    H2*    A   7           H2*        A   7   0.316   3.216   0.207
   71   2HO*    A   7          2HO*        A   7  -0.682   3.406  -2.187
   72    H1*    A   7           H1*        A   7  -1.793   4.450  -1.154
   73    H8     A   7           H8         A   7  -2.700   4.536   2.430
   74   1H6     A   7          1H6         A   7   1.428   9.022   3.303
   75   2H6     A   7          2H6         A   7  -0.203   8.568   3.743
   76    H2     A   7           H2         A   7   1.949   7.458  -0.901
   77   1H5*    A   8          1H5*        A   8   0.900   0.920  -1.598
   78   2H5*    A   8          2H5*        A   8   2.272  -0.174  -1.871
   79    H4*    A   8           H4*        A   8   3.097   2.050  -2.160
   80    H3*    A   8           H3*        A   8   3.777   0.886   0.561
   81    H2*    A   8           H2*        A   8   4.983   2.846   1.099
   82   2HO*    A   8          2HO*        A   8   5.845   4.144  -0.362
   83    H1*    A   8           H1*        A   8   3.191   4.604  -0.154
   84    H8     A   8           H8         A   8   1.129   2.146   1.702
   85   1H6     A   8          1H6         A   8   1.539   3.933   6.251
   86   2H6     A   8          2H6         A   8   2.141   5.480   6.803
   87    H2     A   8           H2         A   8   5.123   6.776   3.686
   88   1H5*    A   9          2H5*        A   9   8.382  -0.170  -2.393
   89   2H5*    A   9          1H5*        A   9   7.334   0.614  -1.191
   90    H4*    A   9           H4*        A   9   9.391   1.819  -2.655
   91    H3*    A   9           H3*        A   9   7.050   2.929  -1.088
   92    H2*    A   9           H2*        A   9   7.649   5.105  -1.799
   93   2HO*    A   9          2HO*        A   9   9.635   5.474  -2.898
   94    H1*    A   9           H1*        A   9   8.358   4.348  -4.394
   95    H8     A   9           H8         A   9   5.873   5.388  -1.986
   96   1H6     A   9          1H6         A   9   1.327   4.559  -5.695
   97   2H6     A   9          2H6         A   9   2.029   6.134  -5.405
   98    H2     A   9           H2         A   9   5.107   2.880  -7.842
   99   1H5*    A  10          1H5*        A  10   9.890   1.389   3.803
  100   2H5*    A  10          2H5*        A  10   8.245   1.824   3.299
  101    H4*    A  10           H4*        A  10  10.199   4.057   3.547
  102    H3*    A  10           H3*        A  10   9.177   2.439   5.884
  103    H2*    A  10           H2*        A  10   8.664   4.391   7.083
  104   2HO*    A  10          2HO*        A  10   9.646   6.268   5.361
  105    H1*    A  10           H1*        A  10   7.777   5.907   4.921
  106    H8     A  10           H8         A  10   6.073   2.955   4.001
  107   1H6     A  10          1H6         A  10   2.836   2.338   8.281
  108   2H6     A  10          2H6         A  10   1.943   3.801   7.933
  109    H2     A  10           H2         A  10   5.772   6.165   9.555
  110   1H5*    A  11          1H5*        A  11  10.516   4.776   8.968
  111   2H5*    A  11          2H5*        A  11  11.113   3.431   9.969
  112    H4*    A  11           H4*        A  11   8.787   4.605  10.490
  113    H3*    A  11           H3*        A  11   9.408   1.645  10.576
  114    H2*    A  11           H2*        A  11   7.160   1.169  11.092
  115   2HO*    A  11          2HO*        A  11   6.560   3.901  11.433
  116    H1*    A  11           H1*        A  11   6.015   3.124   9.503
  117    H8     A  11           H8         A  11   8.784   1.433   7.587
  118   1H6     A  11          1H6         A  11   4.984  -3.149   6.366
  119   2H6     A  11          2H6         A  11   5.760  -1.988   5.315
  120    H2     A  11           H2         A  11   2.812  -0.292   9.209
  121   1H5*    G  12          1H5*        G  12   9.587  -1.258  13.358
  122   2H5*    G  12          2H5*        G  12   9.376  -0.298  11.882
  123    H4*    G  12           H4*        G  12   7.201   0.188  13.739
  124    H3*    G  12           H3*        G  12   7.753  -2.673  12.937
  125    H2*    G  12           H2*        G  12   5.428  -2.980  12.596
  126   2HO*    G  12          2HO*        G  12   4.305  -2.082  14.166
  127    H1*    G  12           H1*        G  12   5.013  -0.465  11.441
  128    H8     G  12           H8         G  12   7.992  -1.366   9.673
  129    H1     G  12           H1         G  12   3.254  -5.465   8.252
  130   1H2     G  12          1H2         G  12   1.740  -5.447   9.884
  131   2H2     G  12          2H2         G  12   1.583  -4.018  10.882
  132   1H5*    G  13          2H5*        G  13   5.190  -3.908  17.357
  133   2H5*    G  13          1H5*        G  13   6.165  -4.127  15.890
  134    H4*    G  13           H4*        G  13   3.186  -4.612  16.200
  135    H3*    G  13           H3*        G  13   5.569  -6.389  15.609
  136    H2*    G  13           H2*        G  13   4.155  -7.740  14.298
  137   2HO*    G  13          2HO*        G  13   1.752  -7.051  14.431
  138    H1*    G  13           H1*        G  13   2.540  -5.629  13.353
  139    H8     G  13           H8         G  13   6.081  -4.641  12.822
  140    H1     G  13           H1         G  13   4.027  -9.012   8.584
  141   1H2     G  13          1H2         G  13   1.964  -9.665   9.146
  142   2H2     G  13          2H2         G  13   1.507  -9.609  10.833
  143   1H5*    G  14          1H5*        G  14   1.351  -8.525  16.692
  144   2H5*    G  14          2H5*        G  14   2.012  -9.757  17.792
  145    H4*    G  14           H4*        G  14   0.441 -10.746  16.139
  146    H3*    G  14           H3*        G  14   3.357 -11.515  15.843
  147    H2*    G  14           H2*        G  14   2.706 -12.982  14.097
  148   2HO*    G  14          2HO*        G  14   0.322 -13.136  13.687
  149    H1*    G  14           H1*        G  14   0.806 -11.264  12.997
  150    H8     G  14           H8         G  14   3.734  -9.126  13.755
  151    H1     G  14           H1         G  14   4.704 -12.983   8.691
  152   1H2     G  14          1H2         G  14   2.667 -14.161   8.401
  153   2H2     G  14          2H2         G  14   2.287 -14.913   9.934
  154   1H5*    C  15          1H5*        C  15   1.186 -14.808  15.661
  155   2H5*    C  15          2H5*        C  15   1.573 -16.037  16.890
  156    H4*    C  15           H4*        C  15   1.493 -17.265  14.876
  157    H3*    C  15           H3*        C  15   4.349 -16.475  15.510
  158    H2*    C  15           H2*        C  15   5.047 -17.634  13.578
  159   2HO*    C  15          2HO*        C  15   4.039 -19.354  12.816
  160    H1*    C  15           H1*        C  15   2.740 -17.059  12.064
  161   1H4     C  15          1H4         C  15   7.352 -13.435   9.659
  162   2H4     C  15          2H4         C  15   7.482 -12.522  11.156
  163    H5     C  15           H5         C  15   5.659 -12.689  12.812
  164    H6     C  15           H6         C  15   3.953 -14.127  13.700
  165   2H    ASP   2          2H        ASP   2  10.185 -12.953  -1.558
  166   1H    ASP   2          1H        ASP   2  10.179 -14.277  -0.499
  167   3H    ASP   2          3H        ASP   2  11.514 -13.229  -0.537
  168    HA   ASP   2           HA       ASP   2  10.324 -12.595   1.386
  169   1HB   ASP   2          1HB       ASP   2   9.434 -10.811  -0.897
  170   2HB   ASP   2          2HB       ASP   2   9.746 -10.326   0.768
  171    H    ALA   3           H        ALA   3   8.002 -11.038   1.435
  172    HA   ALA   3           HA       ALA   3   5.763 -12.685   0.426
  173   1HB   ALA   3          1HB       ALA   3   6.373 -12.287   3.371
  174   2HB   ALA   3          2HB       ALA   3   4.930 -13.074   2.732
  175   3HB   ALA   3          3HB       ALA   3   6.514 -13.806   2.489
  176    H    GLN   4           H        GLN   4   6.756  -9.971   2.507
  177    HA   GLN   4           HA       GLN   4   4.209  -8.617   2.393
  178   1HB   GLN   4          1HB       GLN   4   6.042  -8.262   4.077
  179   2HB   GLN   4          2HB       GLN   4   7.010  -7.517   2.810
  180   1HG   GLN   4          1HG       GLN   4   5.257  -5.810   2.472
  181   2HG   GLN   4          2HG       GLN   4   4.302  -6.540   3.760
  182   1HE2  GLN   4          2HE2      GLN   4   5.537  -3.801   3.686
  183   2HE2  GLN   4          1HE2      GLN   4   6.548  -3.725   5.046
  184    H    THR   5           H        THR   5   7.298  -7.993   0.731
  185    HA   THR   5           HA       THR   5   6.456  -5.981  -1.051
  186    HB   THR   5           HB       THR   5   8.260  -8.359  -1.641
  187    HG1  THR   5           HG1      THR   5   9.424  -7.541  -0.114
  188   1HG2  THR   5          1HG2      THR   5   7.923  -5.604  -2.813
  189   2HG2  THR   5          2HG2      THR   5   9.421  -6.519  -3.014
  190   3HG2  THR   5          3HG2      THR   5   7.903  -7.163  -3.643
  191    H    ARG   6           H        ARG   6   6.011  -9.469  -1.134
  192    HA   ARG   6           HA       ARG   6   4.720  -9.648  -3.724
  193   1HB   ARG   6          1HB       ARG   6   5.420 -11.303  -1.447
  194   2HB   ARG   6          2HB       ARG   6   3.755 -11.632  -1.944
  195   1HG   ARG   6          1HG       ARG   6   5.014 -11.530  -4.373
  196   2HG   ARG   6          2HG       ARG   6   6.299 -12.192  -3.362
  197   1HD   ARG   6          1HD       ARG   6   3.471 -13.304  -3.440
  198   2HD   ARG   6          2HD       ARG   6   4.837 -13.979  -4.351
  199    HE   ARG   6           HE       ARG   6   5.743 -13.711  -1.706
  200   1HH1  ARG   6          1HH1      ARG   6   3.224 -15.388  -3.407
  201   2HH1  ARG   6          2HH1      ARG   6   3.186 -16.708  -2.289
  202   1HH2  ARG   6          1HH2      ARG   6   5.685 -15.431  -0.259
  203   2HH2  ARG   6          2HH2      ARG   6   4.571 -16.733  -0.515
  204    H    ARG   7           H        ARG   7   3.633  -9.466  -0.350
  205    HA   ARG   7           HA       ARG   7   0.853  -9.590  -0.794
  206   1HB   ARG   7          1HB       ARG   7   1.738  -9.789   1.408
  207   2HB   ARG   7          2HB       ARG   7   2.642  -8.289   1.260
  208   1HG   ARG   7          1HG       ARG   7   0.232  -7.221   0.973
  209   2HG   ARG   7          2HG       ARG   7  -0.280  -8.687   1.806
  210   1HD   ARG   7          1HD       ARG   7   0.360  -7.780   3.775
  211   2HD   ARG   7          2HD       ARG   7   2.021  -7.640   3.170
  212    HE   ARG   7           HE       ARG   7   0.014  -5.488   3.164
  213   1HH1  ARG   7          1HH1      ARG   7   2.952  -6.754   1.827
  214   2HH1  ARG   7          2HH1      ARG   7   3.501  -5.218   1.276
  215   1HH2  ARG   7          1HH2      ARG   7   0.733  -3.494   2.445
  216   2HH2  ARG   7          2HH2      ARG   7   2.252  -3.374   1.623
  217    H    ARG   8           H        ARG   8   3.112  -6.889  -1.028
  218    HA   ARG   8           HA       ARG   8   1.320  -4.689  -1.230
  219   1HB   ARG   8          1HB       ARG   8   3.953  -4.943  -1.217
  220   2HB   ARG   8          2HB       ARG   8   3.767  -5.004  -2.967
  221   1HG   ARG   8          1HG       ARG   8   4.078  -2.714  -2.561
  222   2HG   ARG   8          2HG       ARG   8   2.325  -2.862  -2.667
  223   1HD   ARG   8          1HD       ARG   8   3.068  -1.498  -0.690
  224   2HD   ARG   8          2HD       ARG   8   2.159  -2.943  -0.214
  225    HE   ARG   8           HE       ARG   8   4.148  -3.814   0.715
  226   1HH1  ARG   8          1HH1      ARG   8   4.840  -1.263  -1.531
  227   2HH1  ARG   8          2HH1      ARG   8   6.534  -1.258  -1.178
  228   1HH2  ARG   8          1HH2      ARG   8   6.351  -3.797   1.163
  229   2HH2  ARG   8          2HH2      ARG   8   7.386  -2.682   0.336
  230    H    GLU   9           H        GLU   9   2.452  -6.972  -3.693
  231    HA   GLU   9           HA       GLU   9   1.085  -5.753  -5.901
  232   1HB   GLU   9          1HB       GLU   9   1.785  -8.654  -5.296
  233   2HB   GLU   9          2HB       GLU   9   1.320  -8.052  -6.888
  234   1HG   GLU   9          1HG       GLU   9   3.417  -6.387  -5.828
  235   2HG   GLU   9          2HG       GLU   9   3.918  -8.075  -5.737
  236    H    ARG  10           H        ARG  10   0.123  -7.829  -3.281
  237    HA   ARG  10           HA       ARG  10  -2.559  -8.354  -4.310
  238   1HB   ARG  10          1HB       ARG  10  -0.817  -9.134  -2.125
  239   2HB   ARG  10          2HB       ARG  10  -2.409  -8.699  -1.503
  240   1HG   ARG  10          1HG       ARG  10  -3.497 -10.345  -2.784
  241   2HG   ARG  10          2HG       ARG  10  -2.139 -10.498  -3.900
  242   1HD   ARG  10          1HD       ARG  10  -0.866 -11.767  -2.376
  243   2HD   ARG  10          2HD       ARG  10  -1.802 -11.197  -0.981
  244    HE   ARG  10           HE       ARG  10  -3.592 -12.511  -2.761
  245   1HH1  ARG  10          1HH1      ARG  10  -0.904 -13.193  -0.673
  246   2HH1  ARG  10          2HH1      ARG  10  -1.421 -14.812  -0.344
  247   1HH2  ARG  10          1HH2      ARG  10  -4.253 -14.614  -2.327
  248   2HH2  ARG  10          2HH2      ARG  10  -3.307 -15.613  -1.276
  249    H    ARG  11           H        ARG  11  -0.909  -5.761  -2.762
  250    HA   ARG  11           HA       ARG  11  -3.376  -4.632  -1.580
  251   1HB   ARG  11          1HB       ARG  11  -0.494  -3.706  -1.757
  252   2HB   ARG  11          2HB       ARG  11  -1.769  -2.827  -0.922
  253   1HG   ARG  11          1HG       ARG  11  -0.768  -5.612  -0.266
  254   2HG   ARG  11          2HG       ARG  11  -0.532  -4.161   0.700
  255   1HD   ARG  11          1HD       ARG  11  -2.529  -4.482   1.730
  256   2HD   ARG  11          2HD       ARG  11  -3.361  -4.539   0.169
  257    HE   ARG  11           HE       ARG  11  -1.898  -6.974   0.530
  258   1HH1  ARG  11          1HH1      ARG  11  -4.678  -5.263   1.712
  259   2HH1  ARG  11          2HH1      ARG  11  -5.529  -6.707   2.142
  260   1HH2  ARG  11          1HH2      ARG  11  -3.015  -8.843   1.094
  261   2HH2  ARG  11          2HH2      ARG  11  -4.594  -8.722   1.795
  262    H    ALA  12           H        ALA  12  -2.101  -4.785  -4.672
  263    HA   ALA  12           HA       ALA  12  -2.160  -2.116  -5.655
  264   1HB   ALA  12          1HB       ALA  12  -1.570  -4.268  -6.872
  265   2HB   ALA  12          2HB       ALA  12  -3.297  -4.613  -6.982
  266   3HB   ALA  12          3HB       ALA  12  -2.627  -3.199  -7.795
  267    H    GLU  13           H        GLU  13  -4.730  -4.244  -4.587
  268    HA   GLU  13           HA       GLU  13  -6.922  -2.658  -5.677
  269   1HB   GLU  13          1HB       GLU  13  -6.767  -4.737  -3.462
  270   2HB   GLU  13          2HB       GLU  13  -8.255  -4.170  -4.220
  271   1HG   GLU  13          1HG       GLU  13  -6.861  -4.872  -6.430
  272   2HG   GLU  13          2HG       GLU  13  -6.181  -6.016  -5.273
  273    H    LYS  14           H        LYS  14  -5.056  -2.832  -2.669
  274    HA   LYS  14           HA       LYS  14  -6.755  -0.909  -1.244
  275   1HB   LYS  14          1HB       LYS  14  -3.940  -1.982  -0.781
  276   2HB   LYS  14          2HB       LYS  14  -4.894  -1.094   0.409
  277   1HG   LYS  14          1HG       LYS  14  -5.778  -3.700  -0.857
  278   2HG   LYS  14          2HG       LYS  14  -4.971  -3.589   0.709
  279   1HD   LYS  14          1HD       LYS  14  -6.786  -2.105   1.522
  280   2HD   LYS  14          2HD       LYS  14  -7.605  -2.277  -0.031
  281   1HE   LYS  14          1HE       LYS  14  -7.025  -4.915   0.829
  282   2HE   LYS  14          2HE       LYS  14  -7.687  -4.061   2.238
  283   1HZ   LYS  14          1HZ       LYS  14  -8.864  -3.963  -0.489
  284   2HZ   LYS  14          2HZ       LYS  14  -9.427  -4.975   0.756
  285   3HZ   LYS  14          3HZ       LYS  14  -9.517  -3.286   0.923
  286    H    GLN  15           H        GLN  15  -3.810  -0.977  -3.115
  287    HA   GLN  15           HA       GLN  15  -2.980   1.758  -2.735
  288   1HB   GLN  15          1HB       GLN  15  -2.257  -0.686  -4.159
  289   2HB   GLN  15          2HB       GLN  15  -1.994   0.726  -5.168
  290   1HG   GLN  15          1HG       GLN  15  -0.411   1.635  -3.722
  291   2HG   GLN  15          2HG       GLN  15  -1.074   0.794  -2.322
  292   1HE2  GLN  15          2HE2      GLN  15  -0.916  -1.742  -2.546
  293   2HE2  GLN  15          1HE2      GLN  15   0.549  -2.337  -3.162
  294    H    ALA  16           H        ALA  16  -4.630   0.038  -5.389
  295    HA   ALA  16           HA       ALA  16  -5.055   2.402  -6.995
  296   1HB   ALA  16          1HB       ALA  16  -5.085   0.063  -7.829
  297   2HB   ALA  16          2HB       ALA  16  -6.537  -0.253  -6.878
  298   3HB   ALA  16          3HB       ALA  16  -6.594   0.891  -8.220
  299    H    GLN  17           H        GLN  17  -6.812   0.949  -4.301
  300    HA   GLN  17           HA       GLN  17  -9.230   2.558  -4.751
  301   1HB   GLN  17          1HB       GLN  17  -8.125   0.684  -2.673
  302   2HB   GLN  17          2HB       GLN  17  -9.490   1.710  -2.242
  303   1HG   GLN  17          1HG       GLN  17  -9.904   0.493  -4.847
  304   2HG   GLN  17          2HG       GLN  17  -9.607  -0.737  -3.618
  305   1HE2  GLN  17          2HE2      GLN  17 -11.320   2.440  -3.455
  306   2HE2  GLN  17          1HE2      GLN  17 -12.760   1.792  -2.834
  307    H    TRP  18           H        TRP  18  -6.279   2.676  -2.873
  308    HA   TRP  18           HA       TRP  18  -6.955   5.087  -1.369
  309   1HB   TRP  18          1HB       TRP  18  -5.338   3.428  -0.549
  310   2HB   TRP  18          2HB       TRP  18  -4.391   3.593  -2.012
  311    HD1  TRP  18           HD1      TRP  18  -5.015   5.311   1.307
  312    HE1  TRP  18           HE1      TRP  18  -3.408   7.326   1.498
  313    HE3  TRP  18           HE3      TRP  18  -3.130   5.366  -3.367
  314    HZ2  TRP  18           HZ2      TRP  18  -1.549   8.752  -0.140
  315    HZ3  TRP  18           HZ3      TRP  18  -1.463   7.010  -4.047
  316    HH2  TRP  18           HH2      TRP  18  -0.655   8.693  -2.463
  317    H    LYS  19           H        LYS  19  -4.881   4.265  -4.104
  318    HA   LYS  19           HA       LYS  19  -3.890   6.853  -4.723
  319   1HB   LYS  19          1HB       LYS  19  -4.420   4.330  -6.314
  320   2HB   LYS  19          2HB       LYS  19  -3.674   5.746  -7.037
  321   1HG   LYS  19          1HG       LYS  19  -1.863   5.671  -5.380
  322   2HG   LYS  19          2HG       LYS  19  -2.603   4.256  -4.633
  323   1HD   LYS  19          1HD       LYS  19  -1.277   3.067  -6.039
  324   2HD   LYS  19          2HD       LYS  19  -2.475   3.484  -7.264
  325   1HE   LYS  19          1HE       LYS  19  -1.121   5.095  -8.235
  326   2HE   LYS  19          2HE       LYS  19  -0.301   5.472  -6.706
  327   1HZ   LYS  19          1HZ       LYS  19   0.670   3.215  -6.778
  328   2HZ   LYS  19          2HZ       LYS  19   0.009   3.002  -8.329
  329   3HZ   LYS  19          3HZ       LYS  19   1.186   4.196  -8.067
  330    H    ALA  20           H        ALA  20  -6.848   5.146  -5.588
  331    HA   ALA  20           HA       ALA  20  -7.787   6.932  -7.576
  332   1HB   ALA  20          1HB       ALA  20  -8.948   4.972  -5.653
  333   2HB   ALA  20          2HB       ALA  20 -10.058   6.044  -6.505
  334   3HB   ALA  20          3HB       ALA  20  -8.998   4.967  -7.417
  335    H    ALA  21           H        ALA  21  -7.796   7.106  -4.067
  336    HA   ALA  21           HA       ALA  21  -9.165   9.757  -4.252
  337   1HB   ALA  21          1HB       ALA  21 -10.154   7.602  -3.039
  338   2HB   ALA  21          2HB       ALA  21  -9.087   8.133  -1.739
  339   3HB   ALA  21          3HB       ALA  21 -10.358   9.205  -2.329
  340    H    ASN  22           H        ASN  22  -6.296   9.044  -4.417
  341    HA   ASN  22           HA       ASN  22  -5.335  11.046  -2.474
  342   1HB   ASN  22          1HB       ASN  22  -4.398   8.167  -2.523
  343   2HB   ASN  22          2HB       ASN  22  -3.571   9.462  -1.660
  344   1HD2  ASN  22          2HD2      ASN  22  -5.695   7.010  -1.138
  345   2HD2  ASN  22          1HD2      ASN  22  -6.571   7.642   0.172
  346    HA   PRO  23           HA       PRO  23  -3.096  10.641  -6.613
  347   1HB   PRO  23          1HB       PRO  23  -4.135  12.879  -7.812
  348   2HB   PRO  23          2HB       PRO  23  -4.852  11.266  -8.003
  349   1HG   PRO  23          1HG       PRO  23  -5.687  13.510  -6.238
  350   2HG   PRO  23          2HG       PRO  23  -6.678  12.358  -7.148
  351   1HD   PRO  23          1HD       PRO  23  -6.210  12.153  -4.470
  352   2HD   PRO  23          2HD       PRO  23  -6.546  10.754  -5.505
  353    H    LEU  24           H        LEU  24  -4.044  13.132  -4.373
  354    HA   LEU  24           HA       LEU  24  -2.018  15.093  -4.828
  355   1HB   LEU  24          1HB       LEU  24  -2.875  15.987  -2.848
  356   2HB   LEU  24          2HB       LEU  24  -4.181  14.879  -3.249
  357    HG   LEU  24           HG       LEU  24  -1.865  14.087  -1.454
  358   1HD1  LEU  24          1HD1      LEU  24  -3.449  16.094  -0.748
  359   2HD1  LEU  24          2HD1      LEU  24  -4.561  14.779  -0.368
  360   3HD1  LEU  24          3HD1      LEU  24  -2.982  14.852   0.416
  361   1HD2  LEU  24          1HD2      LEU  24  -3.886  12.582  -2.669
  362   2HD2  LEU  24          2HD2      LEU  24  -2.923  12.077  -1.282
  363   3HD2  LEU  24          3HD2      LEU  24  -4.490  12.853  -1.039
  364    H    LEU  25           H        LEU  25  -2.033  12.034  -3.119
  365    HA   LEU  25           HA       LEU  25   0.821  12.366  -2.331
  366   1HB   LEU  25          1HB       LEU  25  -1.545  10.690  -1.524
  367   2HB   LEU  25          2HB       LEU  25   0.076  10.055  -1.218
  368    HG   LEU  25           HG       LEU  25  -0.511  12.877  -0.412
  369   1HD1  LEU  25          1HD1      LEU  25  -2.321  11.044   0.355
  370   2HD1  LEU  25          2HD1      LEU  25  -1.083  10.725   1.571
  371   3HD1  LEU  25          3HD1      LEU  25  -1.783  12.338   1.428
  372   1HD2  LEU  25          1HD2      LEU  25   1.141  10.600   0.730
  373   2HD2  LEU  25          2HD2      LEU  25   1.755  11.989  -0.169
  374   3HD2  LEU  25          3HD2      LEU  25   1.045  12.215   1.430
  375    H    VAL  26           H        VAL  26  -0.200  12.027  -5.023
  376    HA   VAL  26           HA       VAL  26   1.264   9.570  -5.817
  377    HB   VAL  26           HB       VAL  26  -1.618  10.122  -5.801
  378   1HG1  VAL  26          1HG1      VAL  26  -0.290   9.462  -8.442
  379   2HG1  VAL  26          2HG1      VAL  26  -1.974   9.064  -8.099
  380   3HG1  VAL  26          3HG1      VAL  26  -1.448  10.749  -8.095
  381   1HG2  VAL  26          1HG2      VAL  26  -0.227   8.080  -5.017
  382   2HG2  VAL  26          2HG2      VAL  26  -1.760   7.771  -5.835
  383   3HG2  VAL  26          3HG2      VAL  26  -0.238   7.598  -6.715
  384    H    GLY  27           H        GLY  27   2.604  10.099  -7.527
  385   1HA   GLY  27          1HA       GLY  27   3.580  11.390  -9.230
  386   2HA   GLY  27          2HA       GLY  27   1.926  11.738  -9.738
  387    H    VAL  28           H        VAL  28   2.917  12.542  -6.536
  388    HA   VAL  28           HA       VAL  28   2.532  15.430  -7.078
  389    HB   VAL  28           HB       VAL  28   1.572  13.875  -5.176
  390   1HG1  VAL  28          1HG1      VAL  28   4.135  13.382  -4.601
  391   2HG1  VAL  28          2HG1      VAL  28   3.937  14.840  -3.628
  392   3HG1  VAL  28          3HG1      VAL  28   2.901  13.442  -3.341
  393   1HG2  VAL  28          1HG2      VAL  28   2.341  16.700  -5.275
  394   2HG2  VAL  28          2HG2      VAL  28   0.828  15.966  -4.747
  395   3HG2  VAL  28          3HG2      VAL  28   2.183  16.095  -3.626
  396    H    SER  29           H        SER  29   4.223  16.350  -4.969
  397    HA   SER  29           HA       SER  29   6.765  16.521  -6.344
  398   1HB   SER  29          1HB       SER  29   7.324  17.609  -4.014
  399   2HB   SER  29          2HB       SER  29   6.180  18.407  -5.089
  400    HG   SER  29           HG       SER  29   5.652  16.753  -2.848
  401    H    ALA  30           H        ALA  30   6.597  13.883  -6.174
  402    HA   ALA  30           HA       ALA  30   8.675  13.130  -4.212
  403   1HB   ALA  30          1HB       ALA  30   5.811  12.185  -4.256
  404   2HB   ALA  30          2HB       ALA  30   7.079  11.103  -3.678
  405   3HB   ALA  30          3HB       ALA  30   6.800  12.645  -2.868
  406    H    LYS  31           H        LYS  31   8.942  13.369  -6.946
  407    HA   LYS  31           HA       LYS  31   8.711  10.588  -8.027
  408   1HB   LYS  31          1HB       LYS  31   9.010  13.338  -9.256
  409   2HB   LYS  31          2HB       LYS  31   9.100  11.853 -10.205
  410   1HG   LYS  31          1HG       LYS  31   6.764  12.351  -8.370
  411   2HG   LYS  31          2HG       LYS  31   6.794  13.049  -9.989
  412   1HD   LYS  31          1HD       LYS  31   7.441  10.142  -9.685
  413   2HD   LYS  31          2HD       LYS  31   5.753  10.642  -9.570
  414   1HE   LYS  31          1HE       LYS  31   7.486  11.590 -11.858
  415   2HE   LYS  31          2HE       LYS  31   6.637  10.032 -11.931
  416   1HZ   LYS  31          1HZ       LYS  31   5.380  12.652 -11.301
  417   2HZ   LYS  31          2HZ       LYS  31   5.247  11.831 -12.783
  418   3HZ   LYS  31          3HZ       LYS  31   4.578  11.159 -11.372
  419    HA   PRO  32           HA       PRO  32  13.186  10.860  -7.239
  420   1HB   PRO  32          1HB       PRO  32  13.566   8.156  -7.053
  421   2HB   PRO  32          2HB       PRO  32  13.001   9.145  -5.693
  422   1HG   PRO  32          1HG       PRO  32  11.464   7.371  -7.512
  423   2HG   PRO  32          2HG       PRO  32  11.247   7.678  -5.782
  424   1HD   PRO  32          1HD       PRO  32   9.698   8.793  -7.755
  425   2HD   PRO  32          2HD       PRO  32   9.930   9.504  -6.144
  426    H    VAL  33           H        VAL  33  14.436  11.154  -9.051
  427    HA   VAL  33           HA       VAL  33  13.882   9.468 -11.459
  428    HB   VAL  33           HB       VAL  33  15.233  12.159 -11.070
  429   1HG1  VAL  33          1HG1      VAL  33  14.869  10.370 -13.448
  430   2HG1  VAL  33          2HG1      VAL  33  14.764  12.116 -13.680
  431   3HG1  VAL  33          3HG1      VAL  33  16.236  11.401 -13.022
  432   1HG2  VAL  33          1HG2      VAL  33  12.471  11.249 -11.757
  433   2HG2  VAL  33          2HG2      VAL  33  12.991  12.656 -10.827
  434   3HG2  VAL  33          3HG2      VAL  33  13.089  12.676 -12.588
  435    H    ASN  34           H        ASN  34  15.276   7.841 -10.042
  436    HA   ASN  34           HA       ASN  34  17.335   6.718  -9.726
  437   1HB   ASN  34          1HB       ASN  34  17.089   7.808 -12.406
  438   2HB   ASN  34          2HB       ASN  34  18.785   7.698 -11.939
  439   1HD2  ASN  34          2HD2      ASN  34  17.234   5.975 -13.879
  440   2HD2  ASN  34          1HD2      ASN  34  17.421   4.387 -13.308
  441    H    ARG  35           H        ARG  35  17.598   8.384  -7.858
  442    HA   ARG  35           HA       ARG  35  20.300   9.326  -7.790
  443   1HB   ARG  35          1HB       ARG  35  18.458  10.999  -9.164
  444   2HB   ARG  35          2HB       ARG  35  18.807  11.794  -7.629
  445   1HG   ARG  35          1HG       ARG  35  20.894  12.339  -8.283
  446   2HG   ARG  35          2HG       ARG  35  21.224  10.695  -8.830
  447   1HD   ARG  35          1HD       ARG  35  20.100  11.138 -10.963
  448   2HD   ARG  35          2HD       ARG  35  19.662  12.767 -10.410
  449    HE   ARG  35           HE       ARG  35  22.533  11.954 -10.451
  450   1HH1  ARG  35          1HH1      ARG  35  19.935  14.013 -11.517
  451   2HH1  ARG  35          2HH1      ARG  35  21.000  15.156 -12.256
  452   1HH2  ARG  35          1HH2      ARG  35  23.891  13.452 -11.418
  453   2HH2  ARG  35          2HH2      ARG  35  23.222  14.844 -12.202
  454    HA   PRO  36           HA       PRO  36  18.046  10.924  -3.900
  455   1HB   PRO  36          1HB       PRO  36  15.316  10.788  -3.801
  456   2HB   PRO  36          2HB       PRO  36  16.191  12.197  -4.432
  457   1HG   PRO  36          1HG       PRO  36  14.857   9.983  -5.905
  458   2HG   PRO  36          2HG       PRO  36  14.924  11.710  -6.282
  459   1HD   PRO  36          1HD       PRO  36  16.468   9.842  -7.521
  460   2HD   PRO  36          2HD       PRO  36  16.950  11.539  -7.325
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  11.845 -16.081   1.076
    2   2H5*    G   1          2H5*        G   1  12.950 -16.570   2.380
    3    H4*    G   1           H4*        G   1  11.017 -18.664   1.909
    4    H3*    G   1           H3*        G   1   9.920 -15.872   2.400
    5    H2*    G   1           H2*        G   1   8.323 -16.806   3.877
    6   2HO*    G   1          2HO*        G   1   7.491 -18.675   3.443
    7    H1*    G   1           H1*        G   1  10.065 -18.677   4.978
    8    H8     G   1           H8         G   1  11.826 -15.377   4.692
    9    H1     G   1           H1         G   1   7.516 -15.593   9.452
   10   1H2     G   1          1H2         G   1   6.146 -17.323   9.131
   11   2H2     G   1          2H2         G   1   6.669 -18.672   8.149
   12   1H5*    C   2          1H5*        C   2   6.125 -16.650   0.791
   13   2H5*    C   2          2H5*        C   2   7.193 -16.454   2.199
   14    H4*    C   2           H4*        C   2   4.714 -18.099   2.533
   15    H3*    C   2           H3*        C   2   4.764 -15.083   2.223
   16    H2*    C   2           H2*        C   2   3.295 -14.853   4.045
   17   2HO*    C   2          2HO*        C   2   2.421 -17.284   3.212
   18    H1*    C   2           H1*        C   2   4.321 -16.946   5.578
   19   1H4     C   2          1H4         C   2   6.773 -11.706   8.157
   20   2H4     C   2          2H4         C   2   7.999 -11.631   6.916
   21    H5     C   2           H5         C   2   7.808 -12.934   4.857
   22    H6     C   2           H6         C   2   6.870 -14.970   3.897
   23   1H5*    C   3          1H5*        C   3  -0.110 -13.465   1.698
   24   2H5*    C   3          2H5*        C   3   1.497 -12.876   2.174
   25    H4*    C   3           H4*        C   3  -0.426 -14.305   4.034
   26    H3*    C   3           H3*        C   3   0.144 -11.370   3.581
   27    H2*    C   3           H2*        C   3   0.040 -10.958   5.885
   28   2HO*    C   3          2HO*        C   3  -0.683 -13.474   6.716
   29    H1*    C   3           H1*        C   3   1.259 -13.323   6.697
   30   1H4     C   3          1H4         C   3   5.546  -8.557   6.738
   31   2H4     C   3          2H4         C   3   6.167  -9.175   5.226
   32    H5     C   3           H5         C   3   4.750 -10.578   3.810
   33    H6     C   3           H6         C   3   3.033 -12.278   3.829
   34   1H5*    C   4          1H5*        C   4  -3.802 -10.058   5.038
   35   2H5*    C   4          2H5*        C   4  -2.040 -10.261   5.033
   36    H4*    C   4           H4*        C   4  -3.587  -9.980   7.609
   37    H3*    C   4           H3*        C   4  -2.622  -7.783   5.742
   38    H2*    C   4           H2*        C   4  -1.862  -6.551   7.586
   39   2HO*    C   4          2HO*        C   4  -2.820  -8.129   9.614
   40    H1*    C   4           H1*        C   4  -1.049  -8.722   9.137
   41   1H4     C   4          1H4         C   4   4.405  -6.584   6.763
   42   2H4     C   4          2H4         C   4   3.874  -6.852   5.122
   43    H5     C   4           H5         C   4   2.039  -8.521   4.871
   44    H6     C   4           H6         C   4  -0.002  -9.278   5.785
   45   1H5*    U   5          1H5*        U   5  -4.658  -5.878   8.683
   46   2H5*    U   5          2H5*        U   5  -5.869  -4.733   8.062
   47    H4*    U   5           H4*        U   5  -4.490  -3.506   9.555
   48    H3*    U   5           H3*        U   5  -3.697  -2.987   6.674
   49    H2*    U   5           H2*        U   5  -2.096  -1.451   7.467
   50   2HO*    U   5          2HO*        U   5  -2.497  -1.287  10.076
   51    H1*    U   5           H1*        U   5  -1.541  -2.850   9.849
   52    H3     U   5           H3         U   5   2.323  -2.219   7.573
   53    H5     U   5           H5         U   5   0.494  -5.436   5.633
   54    H6     U   5           H6         U   5  -1.498  -4.936   6.872
   55   1H5*    G   6          1H5*        G   6  -1.825   0.393   8.129
   56   2H5*    G   6          2H5*        G   6  -3.106   1.624   8.187
   57    H4*    G   6           H4*        G   6  -1.928   2.795   6.674
   58    H3*    G   6           H3*        G   6  -2.596   0.393   4.940
   59    H2*    G   6           H2*        G   6  -1.094   1.166   3.311
   60   2HO*    G   6          2HO*        G   6  -1.819   3.588   4.255
   61    H1*    G   6           H1*        G   6   0.797   2.225   5.088
   62    H8     G   6           H8         G   6  -0.878  -1.259   5.310
   63    H1     G   6           H1         G   6   5.088  -1.157   2.911
   64   1H2     G   6          1H2         G   6   5.677   0.970   2.483
   65   2H2     G   6          2H2         G   6   4.930   2.238   3.436
   66   1H5*    A   7          1H5*        A   7  -4.562   1.756   0.754
   67   2H5*    A   7          2H5*        A   7  -3.597   0.268   0.822
   68    H4*    A   7           H4*        A   7  -2.804   1.615  -1.020
   69    H3*    A   7           H3*        A   7  -0.950   1.691   1.386
   70    H2*    A   7           H2*        A   7   0.517   3.055   0.121
   71   2HO*    A   7          2HO*        A   7   0.568   3.093  -2.051
   72    H1*    A   7           H1*        A   7  -1.500   4.355  -1.313
   73    H8     A   7           H8         A   7  -2.424   4.707   2.251
   74   1H6     A   7          1H6         A   7   1.400   8.043   3.666
   75   2H6     A   7          2H6         A   7   1.069   9.413   2.630
   76    H2     A   7           H2         A   7   2.480   7.026  -1.181
   77   1H5*    A   8          1H5*        A   8   0.995   0.433  -1.576
   78   2H5*    A   8          2H5*        A   8   2.289  -0.783  -1.660
   79    H4*    A   8           H4*        A   8   3.276   1.351  -2.110
   80    H3*    A   8           H3*        A   8   3.798   0.397   0.720
   81    H2*    A   8           H2*        A   8   5.110   2.327   1.110
   82   2HO*    A   8          2HO*        A   8   6.263   3.189  -0.409
   83    H1*    A   8           H1*        A   8   3.498   4.054  -0.416
   84    H8     A   8           H8         A   8   1.315   1.910   1.744
   85   1H6     A   8          1H6         A   8   2.341   5.966   6.316
   86   2H6     A   8          2H6         A   8   1.514   4.488   5.875
   87    H2     A   8           H2         A   8   5.247   6.837   3.008
   88   1H5*    A   9          2H5*        A   9   8.382  -1.250  -1.946
   89   2H5*    A   9          1H5*        A   9   7.391  -0.228  -0.886
   90    H4*    A   9           H4*        A   9   9.579   0.557  -2.506
   91    H3*    A   9           H3*        A   9   7.472   2.106  -0.968
   92    H2*    A   9           H2*        A   9   8.368   4.101  -1.880
   93   2HO*    A   9          2HO*        A   9  10.595   3.455  -1.563
   94    H1*    A   9           H1*        A   9   8.838   3.024  -4.415
   95    H8     A   9           H8         A   9   6.612   4.586  -1.996
   96   1H6     A   9          1H6         A   9   2.829   5.753  -5.684
   97   2H6     A   9          2H6         A   9   1.943   4.296  -5.293
   98    H2     A   9           H2         A   9   5.356   1.969  -7.722
   99   1H5*    A  10          1H5*        A  10   9.969   1.436   4.097
  100   2H5*    A  10          2H5*        A  10   8.290   1.709   3.592
  101    H4*    A  10           H4*        A  10  10.147   4.060   3.675
  102    H3*    A  10           H3*        A  10   9.012   2.610   6.068
  103    H2*    A  10           H2*        A  10   8.364   4.630   7.067
  104   2HO*    A  10          2HO*        A  10  10.526   5.596   6.259
  105    H1*    A  10           H1*        A  10   7.571   5.930   4.736
  106    H8     A  10           H8         A  10   6.072   2.809   3.991
  107   1H6     A  10          1H6         A  10   2.334   2.907   8.630
  108   2H6     A  10          2H6         A  10   1.875   3.318   6.992
  109    H2     A  10           H2         A  10   5.223   6.513   9.167
  110   1H5*    A  11          1H5*        A  11  10.065   4.987   8.706
  111   2H5*    A  11          2H5*        A  11  10.709   3.968  10.014
  112    H4*    A  11           H4*        A  11   8.369   4.984  10.353
  113    H3*    A  11           H3*        A  11   8.949   2.027  10.621
  114    H2*    A  11           H2*        A  11   6.679   1.613  11.105
  115   2HO*    A  11          2HO*        A  11   6.232   4.400  11.345
  116    H1*    A  11           H1*        A  11   5.608   3.490   9.376
  117    H8     A  11           H8         A  11   8.390   1.674   7.622
  118   1H6     A  11          1H6         A  11   4.589  -2.958   6.583
  119   2H6     A  11          2H6         A  11   5.423  -1.868   5.501
  120    H2     A  11           H2         A  11   2.383   0.048   9.227
  121   1H5*    G  12          1H5*        G  12   8.923  -0.711  13.747
  122   2H5*    G  12          2H5*        G  12   8.811   0.050  12.151
  123    H4*    G  12           H4*        G  12   6.620   0.876  13.876
  124    H3*    G  12           H3*        G  12   7.054  -2.081  13.474
  125    H2*    G  12           H2*        G  12   4.771  -2.349  12.921
  126   2HO*    G  12          2HO*        G  12   3.212  -0.990  13.546
  127    H1*    G  12           H1*        G  12   4.492   0.062  11.528
  128    H8     G  12           H8         G  12   7.492  -0.847   9.940
  129    H1     G  12           H1         G  12   2.949  -5.163   8.520
  130   1H2     G  12          1H2         G  12   1.233  -4.937   9.876
  131   2H2     G  12          2H2         G  12   1.377  -4.041  11.373
  132   1H5*    G  13          1H5*        G  13   6.912  -5.071  16.517
  133   2H5*    G  13          2H5*        G  13   6.771  -4.168  14.998
  134    H4*    G  13           H4*        G  13   4.233  -4.940  16.362
  135    H3*    G  13           H3*        G  13   6.120  -6.921  15.071
  136    H2*    G  13           H2*        G  13   4.320  -7.921  13.950
  137   2HO*    G  13          2HO*        G  13   2.416  -6.429  15.396
  138    H1*    G  13           H1*        G  13   2.877  -5.606  13.453
  139    H8     G  13           H8         G  13   6.238  -4.585  12.536
  140    H1     G  13           H1         G  13   3.897  -8.956   8.460
  141   1H2     G  13          1H2         G  13   1.905  -9.670   9.231
  142   2H2     G  13          2H2         G  13   1.695  -9.721  10.966
  143   1H5*    G  14          1H5*        G  14   1.705  -9.381  17.644
  144   2H5*    G  14          2H5*        G  14   3.058 -10.474  18.013
  145    H4*    G  14           H4*        G  14   0.867 -11.334  16.739
  146    H3*    G  14           H3*        G  14   3.742 -12.095  16.187
  147    H2*    G  14           H2*        G  14   3.030 -13.456  14.394
  148   2HO*    G  14          2HO*        G  14   0.612 -13.433  15.778
  149    H1*    G  14           H1*        G  14   1.018 -11.759  13.485
  150    H8     G  14           H8         G  14   3.916  -9.582  14.271
  151    H1     G  14           H1         G  14   4.769 -13.020   8.894
  152   1H2     G  14          1H2         G  14   3.407 -14.875   9.055
  153   2H2     G  14          2H2         G  14   1.805 -14.475   9.630
  154   1H5*    C  15          1H5*        C  15   1.621 -15.327  16.110
  155   2H5*    C  15          2H5*        C  15   2.088 -16.719  17.118
  156    H4*    C  15           H4*        C  15   1.816 -17.564  14.893
  157    H3*    C  15           H3*        C  15   4.735 -17.108  15.581
  158    H2*    C  15           H2*        C  15   5.311 -17.972  13.464
  159   2HO*    C  15          2HO*        C  15   2.709 -18.840  12.875
  160    H1*    C  15           H1*        C  15   3.037 -16.975  12.131
  161   1H4     C  15          1H4         C  15   7.949 -13.437  10.244
  162   2H4     C  15          2H4         C  15   8.103 -12.716  11.833
  163    H5     C  15           H5         C  15   6.361 -13.061  13.530
  164    H6     C  15           H6         C  15   4.543 -14.480  14.221
  165   2H    ASP   2          2H        ASP   2   9.968  -8.621   0.530
  166   1H    ASP   2          1H        ASP   2   9.816  -9.487  -0.923
  167   3H    ASP   2          3H        ASP   2  11.279  -9.522  -0.066
  168    HA   ASP   2           HA       ASP   2  10.253 -11.575   0.433
  169   1HB   ASP   2          1HB       ASP   2   9.548  -9.614   2.634
  170   2HB   ASP   2          2HB       ASP   2   9.974 -11.312   2.826
  171    H    ALA   3           H        ALA   3   8.171 -11.958   2.265
  172    HA   ALA   3           HA       ALA   3   5.879 -12.253   0.603
  173   1HB   ALA   3          1HB       ALA   3   6.210 -12.073   3.614
  174   2HB   ALA   3          2HB       ALA   3   4.753 -12.661   2.813
  175   3HB   ALA   3          3HB       ALA   3   6.271 -13.539   2.637
  176    H    GLN   4           H        GLN   4   6.962  -9.554   2.580
  177    HA   GLN   4           HA       GLN   4   4.427  -8.146   2.597
  178   1HB   GLN   4          1HB       GLN   4   6.471  -7.915   4.154
  179   2HB   GLN   4          2HB       GLN   4   7.219  -6.990   2.854
  180   1HG   GLN   4          1HG       GLN   4   4.522  -6.049   3.363
  181   2HG   GLN   4          2HG       GLN   4   5.485  -6.006   4.834
  182   1HE2  GLN   4          2HE2      GLN   4   4.849  -4.334   1.919
  183   2HE2  GLN   4          1HE2      GLN   4   6.166  -3.266   1.971
  184    H    THR   5           H        THR   5   7.469  -7.520   0.819
  185    HA   THR   5           HA       THR   5   6.454  -5.578  -0.990
  186    HB   THR   5           HB       THR   5   8.502  -7.806  -1.322
  187    HG1  THR   5           HG1      THR   5   9.231  -6.441   0.187
  188   1HG2  THR   5          1HG2      THR   5   7.998  -5.350  -3.025
  189   2HG2  THR   5          2HG2      THR   5   9.404  -6.406  -3.174
  190   3HG2  THR   5          3HG2      THR   5   7.791  -7.030  -3.522
  191    H    ARG   6           H        ARG   6   6.133  -9.047  -0.811
  192    HA   ARG   6           HA       ARG   6   4.946  -9.485  -3.421
  193   1HB   ARG   6          1HB       ARG   6   5.617 -10.932  -0.971
  194   2HB   ARG   6          2HB       ARG   6   4.061 -11.444  -1.639
  195   1HG   ARG   6          1HG       ARG   6   5.079 -11.945  -3.780
  196   2HG   ARG   6          2HG       ARG   6   6.611 -11.231  -3.277
  197   1HD   ARG   6          1HD       ARG   6   6.768 -13.673  -3.090
  198   2HD   ARG   6          2HD       ARG   6   6.747 -12.977  -1.457
  199    HE   ARG   6           HE       ARG   6   4.613 -13.933  -1.134
  200   1HH1  ARG   6          1HH1      ARG   6   5.417 -13.774  -4.510
  201   2HH1  ARG   6          2HH1      ARG   6   4.007 -14.647  -5.007
  202   1HH2  ARG   6          1HH2      ARG   6   2.786 -15.068  -1.796
  203   2HH2  ARG   6          2HH2      ARG   6   2.527 -15.376  -3.480
  204    H    ARG   7           H        ARG   7   3.694  -9.184  -0.080
  205    HA   ARG   7           HA       ARG   7   0.958  -9.499  -0.759
  206   1HB   ARG   7          1HB       ARG   7   1.708  -9.600   1.534
  207   2HB   ARG   7          2HB       ARG   7   2.394  -7.980   1.438
  208   1HG   ARG   7          1HG       ARG   7   0.046  -7.113   1.006
  209   2HG   ARG   7          2HG       ARG   7  -0.544  -8.730   1.388
  210   1HD   ARG   7          1HD       ARG   7  -0.078  -8.508   3.634
  211   2HD   ARG   7          2HD       ARG   7   1.318  -7.458   3.353
  212    HE   ARG   7           HE       ARG   7  -0.157  -5.600   3.339
  213   1HH1  ARG   7          1HH1      ARG   7  -1.898  -8.576   2.993
  214   2HH1  ARG   7          2HH1      ARG   7  -3.443  -7.811   3.130
  215   1HH2  ARG   7          1HH2      ARG   7  -2.129  -4.622   3.515
  216   2HH2  ARG   7          2HH2      ARG   7  -3.573  -5.566   3.425
  217    H    ARG   8           H        ARG   8   3.125  -6.738  -0.894
  218    HA   ARG   8           HA       ARG   8   1.315  -4.588  -1.221
  219   1HB   ARG   8          1HB       ARG   8   4.046  -5.045  -1.318
  220   2HB   ARG   8          2HB       ARG   8   3.695  -4.647  -2.993
  221   1HG   ARG   8          1HG       ARG   8   4.299  -2.662  -1.577
  222   2HG   ARG   8          2HG       ARG   8   2.733  -2.528  -2.368
  223   1HD   ARG   8          1HD       ARG   8   3.009  -1.948   0.225
  224   2HD   ARG   8          2HD       ARG   8   1.556  -2.765  -0.366
  225    HE   ARG   8           HE       ARG   8   3.718  -4.608   0.337
  226   1HH1  ARG   8          1HH1      ARG   8   0.961  -2.833   1.459
  227   2HH1  ARG   8          2HH1      ARG   8   0.669  -3.899   2.785
  228   1HH2  ARG   8          1HH2      ARG   8   3.329  -5.981   2.056
  229   2HH2  ARG   8          2HH2      ARG   8   2.001  -5.672   3.123
  230    H    GLU   9           H        GLU   9   2.547  -6.917  -3.593
  231    HA   GLU   9           HA       GLU   9   1.224  -5.773  -5.871
  232   1HB   GLU   9          1HB       GLU   9   1.961  -8.640  -5.163
  233   2HB   GLU   9          2HB       GLU   9   1.511  -8.103  -6.782
  234   1HG   GLU   9          1HG       GLU   9   3.561  -6.364  -5.748
  235   2HG   GLU   9          2HG       GLU   9   4.088  -8.038  -5.591
  236    H    ARG  10           H        ARG  10   0.253  -7.901  -3.274
  237    HA   ARG  10           HA       ARG  10  -2.404  -8.447  -4.336
  238   1HB   ARG  10          1HB       ARG  10  -0.696  -9.202  -2.123
  239   2HB   ARG  10          2HB       ARG  10  -2.294  -8.764  -1.519
  240   1HG   ARG  10          1HG       ARG  10  -3.330 -10.515  -2.587
  241   2HG   ARG  10          2HG       ARG  10  -2.209 -10.482  -3.948
  242   1HD   ARG  10          1HD       ARG  10  -0.449 -11.496  -2.527
  243   2HD   ARG  10          2HD       ARG  10  -1.593 -11.558  -1.172
  244    HE   ARG  10           HE       ARG  10  -1.619 -13.315  -3.498
  245   1HH1  ARG  10          1HH1      ARG  10  -3.531 -11.763  -1.051
  246   2HH1  ARG  10          2HH1      ARG  10  -4.795 -12.943  -1.125
  247   1HH2  ARG  10          1HH2      ARG  10  -3.266 -14.841  -3.585
  248   2HH2  ARG  10          2HH2      ARG  10  -4.647 -14.677  -2.552
  249    H    ARG  11           H        ARG  11  -0.834  -5.810  -2.794
  250    HA   ARG  11           HA       ARG  11  -3.366  -4.722  -1.701
  251   1HB   ARG  11          1HB       ARG  11  -0.478  -3.797  -1.703
  252   2HB   ARG  11          2HB       ARG  11  -1.801  -2.923  -0.929
  253   1HG   ARG  11          1HG       ARG  11  -0.847  -5.726  -0.247
  254   2HG   ARG  11          2HG       ARG  11  -0.675  -4.297   0.753
  255   1HD   ARG  11          1HD       ARG  11  -2.736  -4.638   1.627
  256   2HD   ARG  11          2HD       ARG  11  -3.458  -4.631   0.014
  257    HE   ARG  11           HE       ARG  11  -1.990  -7.088   0.585
  258   1HH1  ARG  11          1HH1      ARG  11  -5.021  -5.417   0.882
  259   2HH1  ARG  11          2HH1      ARG  11  -5.945  -6.874   0.996
  260   1HH2  ARG  11          1HH2      ARG  11  -3.206  -8.971   0.735
  261   2HH2  ARG  11          2HH2      ARG  11  -4.927  -8.875   0.914
  262    H    ALA  12           H        ALA  12  -2.016  -4.873  -4.729
  263    HA   ALA  12           HA       ALA  12  -2.001  -2.201  -5.717
  264   1HB   ALA  12          1HB       ALA  12  -1.409  -4.347  -6.927
  265   2HB   ALA  12          2HB       ALA  12  -3.133  -4.698  -7.048
  266   3HB   ALA  12          3HB       ALA  12  -2.462  -3.287  -7.865
  267    H    GLU  13           H        GLU  13  -4.623  -4.288  -4.694
  268    HA   GLU  13           HA       GLU  13  -6.774  -2.691  -5.846
  269   1HB   GLU  13          1HB       GLU  13  -6.670  -4.763  -3.621
  270   2HB   GLU  13          2HB       GLU  13  -8.148  -4.172  -4.380
  271   1HG   GLU  13          1HG       GLU  13  -7.916  -5.714  -6.000
  272   2HG   GLU  13          2HG       GLU  13  -6.392  -4.964  -6.477
  273    H    LYS  14           H        LYS  14  -4.997  -2.866  -2.784
  274    HA   LYS  14           HA       LYS  14  -6.698  -0.904  -1.421
  275   1HB   LYS  14          1HB       LYS  14  -3.935  -2.076  -0.910
  276   2HB   LYS  14          2HB       LYS  14  -4.802  -1.052   0.238
  277   1HG   LYS  14          1HG       LYS  14  -5.932  -3.630  -0.873
  278   2HG   LYS  14          2HG       LYS  14  -5.051  -3.530   0.652
  279   1HD   LYS  14          1HD       LYS  14  -6.733  -1.664   1.273
  280   2HD   LYS  14          2HD       LYS  14  -7.701  -2.282  -0.065
  281   1HE   LYS  14          1HE       LYS  14  -7.455  -4.600   1.022
  282   2HE   LYS  14          2HE       LYS  14  -6.871  -3.734   2.459
  283   1HZ   LYS  14          1HZ       LYS  14  -9.394  -3.086   1.030
  284   2HZ   LYS  14          2HZ       LYS  14  -9.319  -4.040   2.430
  285   3HZ   LYS  14          3HZ       LYS  14  -8.845  -2.410   2.488
  286    H    GLN  15           H        GLN  15  -3.698  -1.037  -3.199
  287    HA   GLN  15           HA       GLN  15  -2.832   1.681  -2.851
  288   1HB   GLN  15          1HB       GLN  15  -2.166  -0.786  -4.288
  289   2HB   GLN  15          2HB       GLN  15  -1.823   0.637  -5.257
  290   1HG   GLN  15          1HG       GLN  15  -0.212   1.415  -3.783
  291   2HG   GLN  15          2HG       GLN  15  -0.983   0.653  -2.392
  292   1HE2  GLN  15          2HE2      GLN  15  -0.947  -1.855  -2.467
  293   2HE2  GLN  15          1HE2      GLN  15   0.473  -2.583  -3.049
  294    H    ALA  16           H        ALA  16  -4.459  -0.022  -5.538
  295    HA   ALA  16           HA       ALA  16  -4.860   2.319  -7.165
  296   1HB   ALA  16          1HB       ALA  16  -4.987  -0.118  -7.845
  297   2HB   ALA  16          2HB       ALA  16  -6.530  -0.217  -6.998
  298   3HB   ALA  16          3HB       ALA  16  -6.359   0.842  -8.398
  299    H    GLN  17           H        GLN  17  -6.602   0.973  -4.420
  300    HA   GLN  17           HA       GLN  17  -8.998   2.612  -4.839
  301   1HB   GLN  17          1HB       GLN  17  -7.849   0.782  -2.742
  302   2HB   GLN  17          2HB       GLN  17  -9.200   1.827  -2.308
  303   1HG   GLN  17          1HG       GLN  17 -10.602   0.870  -3.995
  304   2HG   GLN  17          2HG       GLN  17  -9.244   0.022  -4.734
  305   1HE2  GLN  17          2HE2      GLN  17 -10.044   0.267  -1.240
  306   2HE2  GLN  17          1HE2      GLN  17 -10.239  -1.404  -1.011
  307    H    TRP  18           H        TRP  18  -6.035   2.708  -2.963
  308    HA   TRP  18           HA       TRP  18  -6.637   5.186  -1.549
  309   1HB   TRP  18          1HB       TRP  18  -5.071   3.535  -0.668
  310   2HB   TRP  18          2HB       TRP  18  -4.133   3.582  -2.144
  311    HD1  TRP  18           HD1      TRP  18  -4.658   5.493   1.090
  312    HE1  TRP  18           HE1      TRP  18  -2.954   7.438   1.174
  313    HE3  TRP  18           HE3      TRP  18  -2.783   5.217  -3.587
  314    HZ2  TRP  18           HZ2      TRP  18  -1.031   8.683  -0.538
  315    HZ3  TRP  18           HZ3      TRP  18  -1.045   6.741  -4.347
  316    HH2  TRP  18           HH2      TRP  18  -0.144   8.458  -2.852
  317    H    LYS  19           H        LYS  19  -4.604   4.230  -4.271
  318    HA   LYS  19           HA       LYS  19  -3.537   6.760  -4.980
  319   1HB   LYS  19          1HB       LYS  19  -4.222   4.240  -6.520
  320   2HB   LYS  19          2HB       LYS  19  -3.417   5.609  -7.273
  321   1HG   LYS  19          1HG       LYS  19  -1.607   5.453  -5.577
  322   2HG   LYS  19          2HG       LYS  19  -2.382   4.014  -4.920
  323   1HD   LYS  19          1HD       LYS  19  -2.229   2.977  -7.209
  324   2HD   LYS  19          2HD       LYS  19  -1.268   4.366  -7.712
  325   1HE   LYS  19          1HE       LYS  19  -0.235   3.276  -5.223
  326   2HE   LYS  19          2HE       LYS  19  -0.293   2.030  -6.485
  327   1HZ   LYS  19          1HZ       LYS  19   0.685   3.701  -8.020
  328   2HZ   LYS  19          2HZ       LYS  19   0.916   4.734  -6.692
  329   3HZ   LYS  19          3HZ       LYS  19   1.727   3.242  -6.763
  330    H    ALA  20           H        ALA  20  -6.561   5.121  -5.754
  331    HA   ALA  20           HA       ALA  20  -7.516   6.903  -7.734
  332   1HB   ALA  20          1HB       ALA  20  -8.727   5.072  -5.690
  333   2HB   ALA  20          2HB       ALA  20  -9.777   6.074  -6.692
  334   3HB   ALA  20          3HB       ALA  20  -8.698   4.898  -7.445
  335    H    ALA  21           H        ALA  21  -7.387   7.133  -4.235
  336    HA   ALA  21           HA       ALA  21  -8.698   9.813  -4.403
  337   1HB   ALA  21          1HB       ALA  21  -9.603   7.646  -3.070
  338   2HB   ALA  21          2HB       ALA  21  -8.543   8.321  -1.833
  339   3HB   ALA  21          3HB       ALA  21  -9.866   9.289  -2.482
  340    H    ASN  22           H        ASN  22  -5.860   9.009  -4.692
  341    HA   ASN  22           HA       ASN  22  -4.730  11.043  -2.885
  342   1HB   ASN  22          1HB       ASN  22  -3.896   8.129  -2.825
  343   2HB   ASN  22          2HB       ASN  22  -3.004   9.437  -2.050
  344   1HD2  ASN  22          2HD2      ASN  22  -5.278   7.103  -1.432
  345   2HD2  ASN  22          1HD2      ASN  22  -6.050   7.801  -0.091
  346    HA   PRO  23           HA       PRO  23  -2.707  10.288  -7.078
  347   1HB   PRO  23          1HB       PRO  23  -3.720  12.467  -8.396
  348   2HB   PRO  23          2HB       PRO  23  -4.505  10.874  -8.431
  349   1HG   PRO  23          1HG       PRO  23  -5.175  13.279  -6.818
  350   2HG   PRO  23          2HG       PRO  23  -6.247  12.088  -7.572
  351   1HD   PRO  23          1HD       PRO  23  -5.618  12.105  -4.910
  352   2HD   PRO  23          2HD       PRO  23  -6.096  10.649  -5.794
  353    H    LEU  24           H        LEU  24  -3.459  12.981  -5.003
  354    HA   LEU  24           HA       LEU  24  -1.445  14.843  -5.707
  355   1HB   LEU  24          1HB       LEU  24  -2.066  15.835  -3.667
  356   2HB   LEU  24          2HB       LEU  24  -3.450  14.784  -3.943
  357    HG   LEU  24           HG       LEU  24  -1.050  13.888  -2.317
  358   1HD1  LEU  24          1HD1      LEU  24  -3.443  15.517  -1.524
  359   2HD1  LEU  24          2HD1      LEU  24  -2.723  14.392  -0.373
  360   3HD1  LEU  24          3HD1      LEU  24  -1.757  15.708  -1.042
  361   1HD2  LEU  24          1HD2      LEU  24  -3.170  12.443  -3.313
  362   2HD2  LEU  24          2HD2      LEU  24  -2.275  12.003  -1.861
  363   3HD2  LEU  24          3HD2      LEU  24  -3.783  12.911  -1.731
  364    H    LEU  25           H        LEU  25  -1.356  11.902  -3.820
  365    HA   LEU  25           HA       LEU  25   1.574  12.168  -3.351
  366   1HB   LEU  25          1HB       LEU  25  -0.777  10.774  -2.134
  367   2HB   LEU  25          2HB       LEU  25   0.769   9.925  -2.052
  368    HG   LEU  25           HG       LEU  25   0.763  12.816  -1.315
  369   1HD1  LEU  25          1HD1      LEU  25  -1.233  11.407  -0.225
  370   2HD1  LEU  25          2HD1      LEU  25   0.070  10.854   0.826
  371   3HD1  LEU  25          3HD1      LEU  25  -0.303  12.574   0.717
  372   1HD2  LEU  25          1HD2      LEU  25   2.655  10.881  -1.330
  373   2HD2  LEU  25          2HD2      LEU  25   2.684  12.234  -0.199
  374   3HD2  LEU  25          3HD2      LEU  25   2.038  10.674   0.310
  375    H    VAL  26           H        VAL  26   0.393  11.751  -5.912
  376    HA   VAL  26           HA       VAL  26   1.673   9.220  -6.703
  377    HB   VAL  26           HB       VAL  26  -1.188   9.661  -6.221
  378   1HG1  VAL  26          1HG1      VAL  26  -0.297   8.787  -8.979
  379   2HG1  VAL  26          2HG1      VAL  26  -1.861   8.334  -8.300
  380   3HG1  VAL  26          3HG1      VAL  26  -1.470  10.038  -8.551
  381   1HG2  VAL  26          1HG2      VAL  26   0.588   7.294  -6.871
  382   2HG2  VAL  26          2HG2      VAL  26   0.009   7.800  -5.281
  383   3HG2  VAL  26          3HG2      VAL  26  -1.124   7.141  -6.464
  384    H    GLY  27           H        GLY  27   2.917  10.007  -8.361
  385   1HA   GLY  27          1HA       GLY  27   3.464  11.048 -10.403
  386   2HA   GLY  27          2HA       GLY  27   1.733  11.114 -10.739
  387    H    VAL  28           H        VAL  28   0.562  12.818  -9.242
  388    HA   VAL  28           HA       VAL  28   1.313  15.420  -9.916
  389    HB   VAL  28           HB       VAL  28  -0.121  14.427  -7.433
  390   1HG1  VAL  28          1HG1      VAL  28   0.662  16.928  -7.662
  391   2HG1  VAL  28          2HG1      VAL  28  -0.652  17.035  -8.835
  392   3HG1  VAL  28          3HG1      VAL  28  -0.996  16.581  -7.166
  393   1HG2  VAL  28          1HG2      VAL  28  -0.919  14.831 -10.302
  394   2HG2  VAL  28          2HG2      VAL  28  -1.341  13.516  -9.205
  395   3HG2  VAL  28          3HG2      VAL  28  -2.113  15.092  -9.032
  396    H    SER  29           H        SER  29   2.453  17.080  -8.827
  397    HA   SER  29           HA       SER  29   4.268  17.933  -7.597
  398   1HB   SER  29          1HB       SER  29   3.323  16.053  -5.443
  399   2HB   SER  29          2HB       SER  29   3.950  17.690  -5.269
  400    HG   SER  29           HG       SER  29   1.414  16.840  -5.702
  401    H    ALA  30           H        ALA  30   4.939  15.765  -9.256
  402    HA   ALA  30           HA       ALA  30   7.327  14.749  -7.847
  403   1HB   ALA  30          1HB       ALA  30   4.927  13.253  -8.087
  404   2HB   ALA  30          2HB       ALA  30   6.054  12.563  -9.255
  405   3HB   ALA  30          3HB       ALA  30   6.499  12.657  -7.551
  406    H    LYS  31           H        LYS  31   6.944  16.608  -9.944
  407    HA   LYS  31           HA       LYS  31   8.788  15.592 -11.921
  408   1HB   LYS  31          1HB       LYS  31   7.121  15.622 -13.826
  409   2HB   LYS  31          2HB       LYS  31   6.860  14.325 -12.662
  410   1HG   LYS  31          1HG       LYS  31   5.051  15.504 -11.618
  411   2HG   LYS  31          2HG       LYS  31   5.426  16.986 -12.497
  412   1HD   LYS  31          1HD       LYS  31   4.137  16.342 -14.224
  413   2HD   LYS  31          2HD       LYS  31   5.043  14.837 -14.380
  414   1HE   LYS  31          1HE       LYS  31   3.150  13.778 -13.699
  415   2HE   LYS  31          2HE       LYS  31   3.452  14.465 -12.091
  416   1HZ   LYS  31          1HZ       LYS  31   2.339  16.512 -12.843
  417   2HZ   LYS  31          2HZ       LYS  31   1.949  15.751 -14.310
  418   3HZ   LYS  31          3HZ       LYS  31   1.296  15.175 -12.852
  419    HA   PRO  32           HA       PRO  32   8.992  20.026 -12.159
  420   1HB   PRO  32          1HB       PRO  32  11.004  20.198 -14.002
  421   2HB   PRO  32          2HB       PRO  32  11.287  19.778 -12.302
  422   1HG   PRO  32          1HG       PRO  32  11.191  18.022 -14.693
  423   2HG   PRO  32          2HG       PRO  32  12.203  17.909 -13.245
  424   1HD   PRO  32          1HD       PRO  32   9.965  16.374 -13.713
  425   2HD   PRO  32          2HD       PRO  32  10.647  16.703 -12.106
  426    H    VAL  33           H        VAL  33   8.038  21.565 -13.524
  427    HA   VAL  33           HA       VAL  33   7.167  20.598 -16.230
  428    HB   VAL  33           HB       VAL  33   5.200  22.089 -15.837
  429   1HG1  VAL  33          1HG1      VAL  33   5.756  20.065 -13.646
  430   2HG1  VAL  33          2HG1      VAL  33   4.164  20.695 -14.063
  431   3HG1  VAL  33          3HG1      VAL  33   5.057  19.717 -15.228
  432   1HG2  VAL  33          1HG2      VAL  33   6.528  23.583 -14.230
  433   2HG2  VAL  33          2HG2      VAL  33   4.878  23.197 -13.747
  434   3HG2  VAL  33          3HG2      VAL  33   6.234  22.349 -13.004
  435    H    ASN  34           H        ASN  34   6.851  22.434 -17.815
  436    HA   ASN  34           HA       ASN  34   9.158  24.258 -17.711
  437   1HB   ASN  34          1HB       ASN  34   7.956  22.855 -19.668
  438   2HB   ASN  34          2HB       ASN  34   7.076  24.373 -19.845
  439   1HD2  ASN  34          2HD2      ASN  34   8.371  24.320 -22.013
  440   2HD2  ASN  34          1HD2      ASN  34   9.918  25.021 -21.993
  441    H    ARG  35           H        ARG  35   8.657  26.608 -18.505
  442    HA   ARG  35           HA       ARG  35   7.719  28.706 -17.958
  443   1HB   ARG  35          1HB       ARG  35   5.214  26.988 -17.961
  444   2HB   ARG  35          2HB       ARG  35   5.266  28.737 -18.171
  445   1HG   ARG  35          1HG       ARG  35   5.594  28.465 -20.379
  446   2HG   ARG  35          2HG       ARG  35   7.087  27.587 -20.048
  447   1HD   ARG  35          1HD       ARG  35   5.774  26.024 -21.266
  448   2HD   ARG  35          2HD       ARG  35   5.508  25.554 -19.574
  449    HE   ARG  35           HE       ARG  35   3.635  27.593 -20.498
  450   1HH1  ARG  35          1HH1      ARG  35   4.333  24.196 -20.312
  451   2HH1  ARG  35          2HH1      ARG  35   2.670  23.730 -20.427
  452   1HH2  ARG  35          1HH2      ARG  35   1.478  26.973 -20.647
  453   2HH2  ARG  35          2HH2      ARG  35   1.062  25.292 -20.615
  454    HA   PRO  36           HA       PRO  36   7.497  27.597 -13.483
  455   1HB   PRO  36          1HB       PRO  36   9.328  29.460 -12.668
  456   2HB   PRO  36          2HB       PRO  36   9.784  27.839 -13.230
  457   1HG   PRO  36          1HG       PRO  36   9.863  30.436 -14.681
  458   2HG   PRO  36          2HG       PRO  36  11.005  29.085 -14.721
  459   1HD   PRO  36          1HD       PRO  36   9.159  29.554 -16.674
  460   2HD   PRO  36          2HD       PRO  36   9.800  27.940 -16.292
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  12.532 -15.803   2.759
    2   2H5*    G   1          2H5*        G   1  13.487 -17.277   2.470
    3    H4*    G   1           H4*        G   1  11.475 -18.649   2.615
    4    H3*    G   1           H3*        G   1  10.053 -15.981   2.905
    5    H2*    G   1           H2*        G   1   8.542 -16.970   4.437
    6   2HO*    G   1          2HO*        G   1   9.410 -19.379   3.242
    7    H1*    G   1           H1*        G   1  10.404 -18.614   5.687
    8    H8     G   1           H8         G   1  11.874 -15.193   5.195
    9    H1     G   1           H1         G   1   7.572 -15.482   9.957
   10   1H2     G   1          1H2         G   1   6.256 -17.322   9.605
   11   2H2     G   1          2H2         G   1   7.112 -18.727   9.012
   12   1H5*    C   2          1H5*        C   2   6.793 -18.874   2.759
   13   2H5*    C   2          2H5*        C   2   5.972 -18.395   1.255
   14    H4*    C   2           H4*        C   2   4.305 -18.657   2.992
   15    H3*    C   2           H3*        C   2   4.930 -15.761   2.321
   16    H2*    C   2           H2*        C   2   3.324 -15.076   3.900
   17   2HO*    C   2          2HO*        C   2   2.027 -17.216   3.102
   18    H1*    C   2           H1*        C   2   3.797 -17.139   5.741
   19   1H4     C   2          1H4         C   2   6.631 -12.116   8.333
   20   2H4     C   2          2H4         C   2   7.874 -12.112   7.107
   21    H5     C   2           H5         C   2   7.644 -13.425   5.058
   22    H6     C   2           H6         C   2   6.712 -15.531   4.200
   23   1H5*    C   3          1H5*        C   3   0.345 -14.167   1.460
   24   2H5*    C   3          2H5*        C   3   1.357 -12.756   1.826
   25    H4*    C   3           H4*        C   3  -0.089 -14.605   3.694
   26    H3*    C   3           H3*        C   3   0.379 -11.637   3.388
   27    H2*    C   3           H2*        C   3   0.204 -11.311   5.693
   28   2HO*    C   3          2HO*        C   3  -0.660 -12.771   7.112
   29    H1*    C   3           H1*        C   3   1.488 -13.654   6.470
   30   1H4     C   3          1H4         C   3   5.808  -8.973   6.821
   31   2H4     C   3          2H4         C   3   6.116  -9.111   5.105
   32    H5     C   3           H5         C   3   5.037 -10.821   3.754
   33    H6     C   3           H6         C   3   3.308 -12.517   3.686
   34   1H5*    C   4          1H5*        C   4  -3.592 -10.396   4.627
   35   2H5*    C   4          2H5*        C   4  -1.822 -10.498   4.672
   36    H4*    C   4           H4*        C   4  -3.527 -10.079   7.139
   37    H3*    C   4           H3*        C   4  -2.271  -8.064   5.251
   38    H2*    C   4           H2*        C   4  -1.697  -6.721   7.096
   39   2HO*    C   4          2HO*        C   4  -3.492  -8.331   8.600
   40    H1*    C   4           H1*        C   4  -1.054  -8.820   8.806
   41   1H4     C   4          1H4         C   4   4.590  -6.952   6.620
   42   2H4     C   4          2H4         C   4   4.069  -7.099   4.961
   43    H5     C   4           H5         C   4   2.273  -8.862   4.695
   44    H6     C   4           H6         C   4   0.174  -9.564   5.544
   45   1H5*    U   5          1H5*        U   5  -4.571  -6.119   7.910
   46   2H5*    U   5          2H5*        U   5  -5.637  -4.851   7.271
   47    H4*    U   5           H4*        U   5  -4.292  -3.915   9.053
   48    H3*    U   5           H3*        U   5  -3.402  -3.037   6.284
   49    H2*    U   5           H2*        U   5  -1.788  -1.671   7.308
   50   2HO*    U   5          2HO*        U   5  -2.192  -1.788   9.891
   51    H1*    U   5           H1*        U   5  -1.328  -3.378   9.500
   52    H3     U   5           H3         U   5   2.537  -2.444   7.251
   53    H5     U   5           H5         U   5   0.815  -5.661   5.208
   54    H6     U   5           H6         U   5  -1.208  -5.219   6.416
   55   1H5*    G   6          1H5*        G   6  -1.495   0.112   8.112
   56   2H5*    G   6          2H5*        G   6  -2.715   1.403   8.199
   57    H4*    G   6           H4*        G   6  -1.391   2.567   6.790
   58    H3*    G   6           H3*        G   6  -2.267   0.349   4.898
   59    H2*    G   6           H2*        G   6  -0.748   1.160   3.312
   60   2HO*    G   6          2HO*        G   6  -0.399   3.221   3.071
   61    H1*    G   6           H1*        G   6   1.199   2.012   5.165
   62    H8     G   6           H8         G   6  -0.506  -1.463   5.066
   63    H1     G   6           H1         G   6   5.312  -1.103   2.345
   64   1H2     G   6          1H2         G   6   5.896   1.056   2.137
   65   2H2     G   6          2H2         G   6   5.197   2.215   3.253
   66   1H5*    A   7          1H5*        A   7  -4.383   1.572   1.010
   67   2H5*    A   7          2H5*        A   7  -3.364   0.120   0.961
   68    H4*    A   7           H4*        A   7  -2.724   1.585  -0.852
   69    H3*    A   7           H3*        A   7  -0.737   1.612   1.444
   70    H2*    A   7           H2*        A   7   0.611   3.082   0.161
   71   2HO*    A   7          2HO*        A   7  -0.898   2.876  -2.160
   72    H1*    A   7           H1*        A   7  -1.530   4.388  -1.072
   73    H8     A   7           H8         A   7  -2.242   4.456   2.554
   74   1H6     A   7          1H6         A   7   0.594   9.127   3.256
   75   2H6     A   7          2H6         A   7   1.889   8.082   3.794
   76    H2     A   7           H2         A   7   2.309   7.292  -0.979
   77   1H5*    A   8          1H5*        A   8   1.098   0.745  -1.666
   78   2H5*    A   8          2H5*        A   8   2.437  -0.397  -1.913
   79    H4*    A   8           H4*        A   8   3.317   1.791  -2.289
   80    H3*    A   8           H3*        A   8   4.010   0.696   0.457
   81    H2*    A   8           H2*        A   8   5.229   2.654   0.947
   82   2HO*    A   8          2HO*        A   8   4.985   3.510  -1.744
   83    H1*    A   8           H1*        A   8   3.491   4.412  -0.375
   84    H8     A   8           H8         A   8   1.500   1.948   1.651
   85   1H6     A   8          1H6         A   8   1.386   4.476   5.858
   86   2H6     A   8          2H6         A   8   2.626   5.459   6.603
   87    H2     A   8           H2         A   8   5.106   7.042   3.194
   88   1H5*    A   9          2H5*        A   9   8.511  -0.611  -2.446
   89   2H5*    A   9          1H5*        A   9   7.519   0.303  -1.291
   90    H4*    A   9           H4*        A   9   9.666   1.263  -2.854
   91    H3*    A   9           H3*        A   9   7.521   2.623  -1.200
   92    H2*    A   9           H2*        A   9   8.276   4.717  -2.004
   93   2HO*    A   9          2HO*        A   9  10.544   4.179  -1.740
   94    H1*    A   9           H1*        A   9   8.795   3.842  -4.604
   95    H8     A   9           H8         A   9   6.508   5.148  -2.114
   96   1H6     A   9          1H6         A   9   2.507   6.114  -6.052
   97   2H6     A   9          2H6         A   9   1.917   4.821  -5.032
   98    H2     A   9           H2         A   9   5.326   2.677  -7.916
   99   1H5*    A  10          1H5*        A  10  10.145   1.610   3.780
  100   2H5*    A  10          2H5*        A  10   8.465   1.832   3.250
  101    H4*    A  10           H4*        A  10  10.170   4.274   3.452
  102    H3*    A  10           H3*        A  10   9.215   2.648   5.810
  103    H2*    A  10           H2*        A  10   8.452   4.574   6.904
  104   2HO*    A  10          2HO*        A  10   9.021   6.678   5.650
  105    H1*    A  10           H1*        A  10   7.516   5.918   4.650
  106    H8     A  10           H8         A  10   6.209   2.712   3.858
  107   1H6     A  10          1H6         A  10   2.587   2.186   7.090
  108   2H6     A  10          2H6         A  10   2.045   3.168   8.432
  109    H2     A  10           H2         A  10   5.215   6.271   9.110
  110   1H5*    A  11          2H5*        A  11  10.932   4.037   9.902
  111   2H5*    A  11          1H5*        A  11  10.461   2.616   8.946
  112    H4*    A  11           H4*        A  11   8.667   4.664  10.262
  113    H3*    A  11           H3*        A  11   9.081   1.681  10.477
  114    H2*    A  11           H2*        A  11   6.779   1.366  10.897
  115   2HO*    A  11          2HO*        A  11   5.408   3.235  11.259
  116    H1*    A  11           H1*        A  11   5.845   3.318   9.173
  117    H8     A  11           H8         A  11   8.571   1.541   7.379
  118   1H6     A  11          1H6         A  11   4.822  -3.109   6.267
  119   2H6     A  11          2H6         A  11   5.604  -1.972   5.195
  120    H2     A  11           H2         A  11   2.592  -0.193   9.005
  121   1H5*    G  12          1H5*        G  12   8.841  -1.076  13.620
  122   2H5*    G  12          2H5*        G  12   8.831  -0.294  12.032
  123    H4*    G  12           H4*        G  12   6.602   0.606  13.666
  124    H3*    G  12           H3*        G  12   6.934  -2.361  13.250
  125    H2*    G  12           H2*        G  12   4.672  -2.534  12.590
  126   2HO*    G  12          2HO*        G  12   4.194   0.138  13.395
  127    H1*    G  12           H1*        G  12   4.553  -0.108  11.206
  128    H8     G  12           H8         G  12   7.575  -1.092   9.728
  129    H1     G  12           H1         G  12   3.045  -5.400   8.254
  130   1H2     G  12          1H2         G  12   1.318  -5.184   9.585
  131   2H2     G  12          2H2         G  12   1.326  -4.089  10.949
  132   1H5*    G  13          1H5*        G  13   6.588  -5.169  16.554
  133   2H5*    G  13          2H5*        G  13   6.488  -4.389  14.966
  134    H4*    G  13           H4*        G  13   3.952  -5.245  16.318
  135    H3*    G  13           H3*        G  13   5.967  -7.073  14.987
  136    H2*    G  13           H2*        G  13   4.266  -8.188  13.843
  137   2HO*    G  13          2HO*        G  13   2.036  -7.843  14.353
  138    H1*    G  13           H1*        G  13   2.670  -5.970  13.363
  139    H8     G  13           H8         G  13   6.029  -4.778  12.533
  140    H1     G  13           H1         G  13   3.938  -9.203   8.371
  141   1H2     G  13          1H2         G  13   1.841  -9.861   9.073
  142   2H2     G  13          2H2         G  13   1.783 -10.143  10.797
  143   1H5*    G  14          1H5*        G  14   0.857  -8.862  16.863
  144   2H5*    G  14          2H5*        G  14   1.562  -9.863  18.151
  145    H4*    G  14           H4*        G  14   0.282 -11.245  16.561
  146    H3*    G  14           H3*        G  14   3.286 -11.638  16.435
  147    H2*    G  14           H2*        G  14   2.887 -13.385  14.877
  148   2HO*    G  14          2HO*        G  14   1.011 -14.419  14.686
  149    H1*    G  14           H1*        G  14   0.826 -12.063  13.539
  150    H8     G  14           H8         G  14   3.764  -9.815  14.378
  151    H1     G  14           H1         G  14   4.552 -13.312   9.040
  152   1H2     G  14          1H2         G  14   3.096 -15.161   9.268
  153   2H2     G  14          2H2         G  14   1.499 -14.557   9.645
  154   1H5*    C  15          1H5*        C  15   1.395 -15.208  16.429
  155   2H5*    C  15          2H5*        C  15   2.045 -16.350  17.626
  156    H4*    C  15           H4*        C  15   1.951 -17.483  15.492
  157    H3*    C  15           H3*        C  15   4.761 -16.626  16.249
  158    H2*    C  15           H2*        C  15   5.547 -17.681  14.292
  159   2HO*    C  15          2HO*        C  15   3.444 -18.888  13.246
  160    H1*    C  15           H1*        C  15   3.265 -17.104  12.741
  161   1H4     C  15          1H4         C  15   7.807 -13.246  10.597
  162   2H4     C  15          2H4         C  15   7.911 -12.416  12.139
  163    H5     C  15           H5         C  15   6.176 -12.764  13.846
  164    H6     C  15           H6         C  15   4.484 -14.287  14.645
  165   2H    ASP   2          2H        ASP   2   9.981 -11.380  -1.853
  166   1H    ASP   2          1H        ASP   2   9.843 -13.069  -1.972
  167   3H    ASP   2          3H        ASP   2  11.253 -12.373  -1.329
  168    HA   ASP   2           HA       ASP   2  10.057 -13.123   0.549
  169   1HB   ASP   2          1HB       ASP   2   9.337 -10.211   0.135
  170   2HB   ASP   2          2HB       ASP   2   9.696 -11.015   1.659
  171    H    ALA   3           H        ALA   3   7.853 -11.890   1.722
  172    HA   ALA   3           HA       ALA   3   5.605 -12.899   0.012
  173   1HB   ALA   3          1HB       ALA   3   6.155 -14.164   2.087
  174   2HB   ALA   3          2HB       ALA   3   5.878 -12.700   3.029
  175   3HB   ALA   3          3HB       ALA   3   4.542 -13.455   2.161
  176    H    GLN   4           H        GLN   4   6.743 -10.243   2.026
  177    HA   GLN   4           HA       GLN   4   4.217  -8.816   2.071
  178   1HB   GLN   4          1HB       GLN   4   6.113  -8.507   3.675
  179   2HB   GLN   4          2HB       GLN   4   7.077  -7.835   2.367
  180   1HG   GLN   4          1HG       GLN   4   5.320  -6.079   2.043
  181   2HG   GLN   4          2HG       GLN   4   4.493  -6.699   3.471
  182   1HE2  GLN   4          2HE2      GLN   4   5.140  -4.194   3.935
  183   2HE2  GLN   4          1HE2      GLN   4   6.580  -4.003   4.811
  184    H    THR   5           H        THR   5   7.251  -8.217   0.295
  185    HA   THR   5           HA       THR   5   6.356  -6.203  -1.448
  186    HB   THR   5           HB       THR   5   8.122  -8.592  -2.095
  187    HG1  THR   5           HG1      THR   5   8.668  -6.076  -0.906
  188   1HG2  THR   5          1HG2      THR   5   7.739  -5.860  -3.310
  189   2HG2  THR   5          2HG2      THR   5   9.205  -6.807  -3.584
  190   3HG2  THR   5          3HG2      THR   5   7.638  -7.432  -4.102
  191    H    ARG   6           H        ARG   6   5.833  -9.674  -1.493
  192    HA   ARG   6           HA       ARG   6   4.458  -9.834  -4.047
  193   1HB   ARG   6          1HB       ARG   6   5.229 -11.505  -1.801
  194   2HB   ARG   6          2HB       ARG   6   3.552 -11.829  -2.255
  195   1HG   ARG   6          1HG       ARG   6   4.849 -11.665  -4.709
  196   2HG   ARG   6          2HG       ARG   6   6.034 -12.481  -3.690
  197   1HD   ARG   6          1HD       ARG   6   3.138 -13.357  -3.701
  198   2HD   ARG   6          2HD       ARG   6   4.297 -13.981  -4.891
  199    HE   ARG   6           HE       ARG   6   5.403 -14.090  -2.222
  200   1HH1  ARG   6          1HH1      ARG   6   3.196 -15.638  -4.408
  201   2HH1  ARG   6          2HH1      ARG   6   3.366 -17.192  -3.666
  202   1HH2  ARG   6          1HH2      ARG   6   5.617 -16.115  -1.265
  203   2HH2  ARG   6          2HH2      ARG   6   4.729 -17.462  -1.895
  204    H    ARG   7           H        ARG   7   3.483  -9.689  -0.631
  205    HA   ARG   7           HA       ARG   7   0.687  -9.780  -1.016
  206   1HB   ARG   7          1HB       ARG   7   1.603 -10.051   1.160
  207   2HB   ARG   7          2HB       ARG   7   2.543  -8.572   1.032
  208   1HG   ARG   7          1HG       ARG   7   0.166  -7.427   0.828
  209   2HG   ARG   7          2HG       ARG   7  -0.383  -8.908   1.610
  210   1HD   ARG   7          1HD       ARG   7   0.301  -8.097   3.603
  211   2HD   ARG   7          2HD       ARG   7   1.960  -7.985   2.991
  212    HE   ARG   7           HE       ARG   7   0.026  -5.766   3.084
  213   1HH1  ARG   7          1HH1      ARG   7   2.896  -7.079   1.643
  214   2HH1  ARG   7          2HH1      ARG   7   3.478  -5.541   1.133
  215   1HH2  ARG   7          1HH2      ARG   7   0.791  -3.780   2.418
  216   2HH2  ARG   7          2HH2      ARG   7   2.294  -3.677   1.568
  217    H    ARG   8           H        ARG   8   2.981  -7.114  -1.246
  218    HA   ARG   8           HA       ARG   8   1.228  -4.877  -1.335
  219   1HB   ARG   8          1HB       ARG   8   3.862  -5.205  -1.426
  220   2HB   ARG   8          2HB       ARG   8   3.603  -5.164  -3.166
  221   1HG   ARG   8          1HG       ARG   8   3.985  -2.907  -2.652
  222   2HG   ARG   8          2HG       ARG   8   2.225  -3.009  -2.679
  223   1HD   ARG   8          1HD       ARG   8   3.091  -1.777  -0.667
  224   2HD   ARG   8          2HD       ARG   8   2.177  -3.232  -0.228
  225    HE   ARG   8           HE       ARG   8   4.191  -4.194   0.546
  226   1HH1  ARG   8          1HH1      ARG   8   4.823  -1.515  -1.569
  227   2HH1  ARG   8          2HH1      ARG   8   6.532  -1.555  -1.298
  228   1HH2  ARG   8          1HH2      ARG   8   6.416  -4.233   0.889
  229   2HH2  ARG   8          2HH2      ARG   8   7.429  -3.083   0.084
  230    H    GLU   9           H        GLU   9   2.210  -7.140  -3.876
  231    HA   GLU   9           HA       GLU   9   0.829  -5.823  -6.021
  232   1HB   GLU   9          1HB       GLU   9   1.357  -8.782  -5.540
  233   2HB   GLU   9          2HB       GLU   9   1.019  -8.042  -7.105
  234   1HG   GLU   9          1HG       GLU   9   3.123  -6.515  -6.150
  235   2HG   GLU   9          2HG       GLU   9   3.532  -8.138  -5.595
  236    H    ARG  10           H        ARG  10  -0.136  -7.911  -3.410
  237    HA   ARG  10           HA       ARG  10  -2.862  -8.318  -4.381
  238   1HB   ARG  10          1HB       ARG  10  -1.093  -9.252  -2.296
  239   2HB   ARG  10          2HB       ARG  10  -2.613  -8.726  -1.574
  240   1HG   ARG  10          1HG       ARG  10  -3.866 -10.311  -2.719
  241   2HG   ARG  10          2HG       ARG  10  -2.704 -10.420  -4.042
  242   1HD   ARG  10          1HD       ARG  10  -1.128 -11.636  -2.618
  243   2HD   ARG  10          2HD       ARG  10  -2.215 -11.458  -1.226
  244    HE   ARG  10           HE       ARG  10  -2.566 -13.337  -3.422
  245   1HH1  ARG  10          1HH1      ARG  10  -4.181 -11.354  -1.071
  246   2HH1  ARG  10          2HH1      ARG  10  -5.603 -12.339  -1.047
  247   1HH2  ARG  10          2HH2      ARG  10  -4.420 -14.606  -3.382
  248   2HH2  ARG  10          1HH2      ARG  10  -5.740 -14.171  -2.348
  249    H    ARG  11           H        ARG  11  -1.071  -5.826  -2.834
  250    HA   ARG  11           HA       ARG  11  -3.460  -4.634  -1.556
  251   1HB   ARG  11          1HB       ARG  11  -0.550  -3.809  -1.777
  252   2HB   ARG  11          2HB       ARG  11  -1.776  -2.917  -0.880
  253   1HG   ARG  11          1HG       ARG  11  -0.846  -5.751  -0.338
  254   2HG   ARG  11          2HG       ARG  11  -0.548  -4.340   0.668
  255   1HD   ARG  11          1HD       ARG  11  -2.526  -4.652   1.735
  256   2HD   ARG  11          2HD       ARG  11  -3.396  -4.606   0.193
  257    HE   ARG  11           HE       ARG  11  -1.988  -7.104   0.461
  258   1HH1  ARG  11          1HH1      ARG  11  -4.765  -5.350   1.585
  259   2HH1  ARG  11          2HH1      ARG  11  -5.681  -6.780   1.916
  260   1HH2  ARG  11          1HH2      ARG  11  -3.186  -8.955   0.897
  261   2HH2  ARG  11          2HH2      ARG  11  -4.792  -8.812   1.529
  262    H    ALA  12           H        ALA  12  -2.273  -4.765  -4.676
  263    HA   ALA  12           HA       ALA  12  -2.247  -2.068  -5.596
  264   1HB   ALA  12          1HB       ALA  12  -1.776  -4.244  -6.856
  265   2HB   ALA  12          2HB       ALA  12  -3.522  -4.466  -6.975
  266   3HB   ALA  12          3HB       ALA  12  -2.755  -3.079  -7.746
  267    H    GLU  13           H        GLU  13  -4.859  -4.138  -4.521
  268    HA   GLU  13           HA       GLU  13  -7.021  -2.462  -5.524
  269   1HB   GLU  13          1HB       GLU  13  -6.809  -4.661  -3.437
  270   2HB   GLU  13          2HB       GLU  13  -8.339  -3.952  -3.956
  271   1HG   GLU  13          1HG       GLU  13  -8.253  -4.937  -6.038
  272   2HG   GLU  13          2HG       GLU  13  -6.490  -4.938  -6.080
  273    H    LYS  14           H        LYS  14  -5.091  -2.756  -2.569
  274    HA   LYS  14           HA       LYS  14  -6.689  -0.811  -1.056
  275   1HB   LYS  14          1HB       LYS  14  -3.895  -1.983  -0.713
  276   2HB   LYS  14          2HB       LYS  14  -4.759  -1.059   0.518
  277   1HG   LYS  14          1HG       LYS  14  -5.801  -3.623  -0.712
  278   2HG   LYS  14          2HG       LYS  14  -4.930  -3.546   0.823
  279   1HD   LYS  14          1HD       LYS  14  -6.665  -1.920   1.645
  280   2HD   LYS  14          2HD       LYS  14  -7.572  -2.210   0.159
  281   1HE   LYS  14          1HE       LYS  14  -7.419  -4.725   0.790
  282   2HE   LYS  14          2HE       LYS  14  -6.998  -4.139   2.411
  283   1HZ   LYS  14          1HZ       LYS  14  -9.365  -3.260   0.841
  284   2HZ   LYS  14          2HZ       LYS  14  -9.411  -4.375   2.123
  285   3HZ   LYS  14          3HZ       LYS  14  -8.965  -2.765   2.416
  286    H    GLN  15           H        GLN  15  -3.778  -0.938  -2.988
  287    HA   GLN  15           HA       GLN  15  -2.853   1.757  -2.607
  288   1HB   GLN  15          1HB       GLN  15  -2.284  -0.673  -4.132
  289   2HB   GLN  15          2HB       GLN  15  -1.986   0.765  -5.092
  290   1HG   GLN  15          1HG       GLN  15  -0.317   1.535  -3.669
  291   2HG   GLN  15          2HG       GLN  15  -0.986   0.688  -2.275
  292   1HE2  GLN  15          2HE2      GLN  15  -0.962  -1.849  -2.581
  293   2HE2  GLN  15          1HE2      GLN  15   0.456  -2.495  -3.255
  294    H    ALA  16           H        ALA  16  -4.648   0.170  -5.258
  295    HA   ALA  16           HA       ALA  16  -5.084   2.607  -6.753
  296   1HB   ALA  16          1HB       ALA  16  -6.462  -0.099  -6.657
  297   2HB   ALA  16          2HB       ALA  16  -6.843   1.135  -7.858
  298   3HB   ALA  16          3HB       ALA  16  -5.229   0.427  -7.802
  299    H    GLN  17           H        GLN  17  -6.731   1.095  -4.035
  300    HA   GLN  17           HA       GLN  17  -9.158   2.726  -4.300
  301   1HB   GLN  17          1HB       GLN  17  -7.928   0.823  -2.311
  302   2HB   GLN  17          2HB       GLN  17  -9.287   1.826  -1.808
  303   1HG   GLN  17          1HG       GLN  17 -10.708   0.912  -3.501
  304   2HG   GLN  17          2HG       GLN  17  -9.354   0.119  -4.304
  305   1HE2  GLN  17          2HE2      GLN  17 -10.470   0.210  -0.863
  306   2HE2  GLN  17          1HE2      GLN  17 -10.468  -1.476  -0.671
  307    H    TRP  18           H        TRP  18  -6.114   2.776  -2.581
  308    HA   TRP  18           HA       TRP  18  -6.671   5.156  -0.992
  309   1HB   TRP  18          1HB       TRP  18  -5.040   3.465  -0.297
  310   2HB   TRP  18          2HB       TRP  18  -4.177   3.635  -1.812
  311    HD1  TRP  18           HD1      TRP  18  -4.584   5.309   1.563
  312    HE1  TRP  18           HE1      TRP  18  -2.916   7.278   1.704
  313    HE3  TRP  18           HE3      TRP  18  -2.940   5.397  -3.208
  314    HZ2  TRP  18           HZ2      TRP  18  -1.104   8.684  -0.006
  315    HZ3  TRP  18           HZ3      TRP  18  -1.263   7.017  -3.942
  316    HH2  TRP  18           HH2      TRP  18  -0.333   8.644  -2.373
  317    H    LYS  19           H        LYS  19  -4.753   4.384  -3.856
  318    HA   LYS  19           HA       LYS  19  -3.775   6.977  -4.464
  319   1HB   LYS  19          1HB       LYS  19  -4.419   4.499  -6.082
  320   2HB   LYS  19          2HB       LYS  19  -3.730   5.936  -6.825
  321   1HG   LYS  19          1HG       LYS  19  -1.857   5.827  -5.158
  322   2HG   LYS  19          2HG       LYS  19  -2.493   4.271  -4.628
  323   1HD   LYS  19          1HD       LYS  19  -2.414   3.743  -7.231
  324   2HD   LYS  19          2HD       LYS  19  -1.179   5.000  -7.213
  325   1HE   LYS  19          1HE       LYS  19   0.138   3.781  -5.581
  326   2HE   LYS  19          2HE       LYS  19  -1.156   2.585  -5.370
  327   1HZ   LYS  19          1HZ       LYS  19  -0.010   3.173  -8.033
  328   2HZ   LYS  19          2HZ       LYS  19   0.693   2.012  -7.011
  329   3HZ   LYS  19          3HZ       LYS  19  -0.907   1.818  -7.546
  330    H    ALA  20           H        ALA  20  -6.799   5.321  -5.180
  331    HA   ALA  20           HA       ALA  20  -7.861   7.177  -7.040
  332   1HB   ALA  20          1HB       ALA  20  -8.982   5.260  -5.017
  333   2HB   ALA  20          2HB       ALA  20 -10.065   6.272  -5.971
  334   3HB   ALA  20          3HB       ALA  20  -8.991   5.129  -6.776
  335    H    ALA  21           H        ALA  21  -7.614   7.221  -3.537
  336    HA   ALA  21           HA       ALA  21  -8.945   9.897  -3.516
  337   1HB   ALA  21          1HB       ALA  21  -9.727   7.621  -2.243
  338   2HB   ALA  21          2HB       ALA  21  -8.684   8.336  -1.013
  339   3HB   ALA  21          3HB       ALA  21 -10.071   9.238  -1.627
  340    H    ASN  22           H        ASN  22  -6.117   9.171  -3.969
  341    HA   ASN  22           HA       ASN  22  -4.950  11.094  -2.063
  342   1HB   ASN  22          1HB       ASN  22  -4.090   8.196  -2.256
  343   2HB   ASN  22          2HB       ASN  22  -3.142   9.452  -1.462
  344   1HD2  ASN  22          2HD2      ASN  22  -5.356   7.075  -0.818
  345   2HD2  ASN  22          1HD2      ASN  22  -6.043   7.696   0.604
  346    HA   PRO  23           HA       PRO  23  -3.086  10.746  -6.384
  347   1HB   PRO  23          1HB       PRO  23  -4.196  13.013  -7.457
  348   2HB   PRO  23          2HB       PRO  23  -4.948  11.411  -7.608
  349   1HG   PRO  23          1HG       PRO  23  -5.606  13.642  -5.758
  350   2HG   PRO  23          2HG       PRO  23  -6.681  12.501  -6.582
  351   1HD   PRO  23          1HD       PRO  23  -5.964  12.284  -3.954
  352   2HD   PRO  23          2HD       PRO  23  -6.432  10.900  -4.956
  353    H    LEU  24           H        LEU  24  -3.784  13.163  -3.989
  354    HA   LEU  24           HA       LEU  24  -1.807  15.131  -4.609
  355   1HB   LEU  24          1HB       LEU  24  -2.463  15.998  -2.535
  356   2HB   LEU  24          2HB       LEU  24  -3.819  14.923  -2.850
  357    HG   LEU  24           HG       LEU  24  -1.378  14.050  -1.269
  358   1HD1  LEU  24          1HD1      LEU  24  -3.794  15.600  -0.454
  359   2HD1  LEU  24          2HD1      LEU  24  -3.210  14.349   0.644
  360   3HD1  LEU  24          3HD1      LEU  24  -2.147  15.675   0.172
  361   1HD2  LEU  24          1HD2      LEU  24  -3.514  12.601  -2.340
  362   2HD2  LEU  24          2HD2      LEU  24  -2.459  12.057  -1.038
  363   3HD2  LEU  24          3HD2      LEU  24  -3.988  12.856  -0.665
  364    H    LEU  25           H        LEU  25  -1.693  12.066  -2.901
  365    HA   LEU  25           HA       LEU  25   1.223  12.340  -2.362
  366   1HB   LEU  25          1HB       LEU  25  -1.084  10.625  -1.454
  367   2HB   LEU  25          2HB       LEU  25   0.561  10.004  -1.274
  368    HG   LEU  25           HG       LEU  25  -0.226  12.746  -0.282
  369   1HD1  LEU  25          1HD1      LEU  25  -0.266  10.119   1.236
  370   2HD1  LEU  25          2HD1      LEU  25  -0.478  11.716   1.955
  371   3HD1  LEU  25          3HD1      LEU  25  -1.677  11.092   0.822
  372   1HD2  LEU  25          1HD2      LEU  25   2.102  10.865   0.041
  373   2HD2  LEU  25          2HD2      LEU  25   2.111  12.589  -0.330
  374   3HD2  LEU  25          3HD2      LEU  25   1.747  12.042   1.306
  375    H    VAL  26           H        VAL  26   0.074  12.173  -4.965
  376    HA   VAL  26           HA       VAL  26   1.396   9.757  -6.050
  377    HB   VAL  26           HB       VAL  26  -1.487  10.371  -5.741
  378   1HG1  VAL  26          1HG1      VAL  26  -0.351   9.518  -8.412
  379   2HG1  VAL  26          2HG1      VAL  26  -2.012   9.174  -7.929
  380   3HG1  VAL  26          3HG1      VAL  26  -1.465  10.846  -8.071
  381   1HG2  VAL  26          1HG2      VAL  26  -0.203   8.370  -4.847
  382   2HG2  VAL  26          2HG2      VAL  26  -1.675   7.980  -5.739
  383   3HG2  VAL  26          3HG2      VAL  26  -0.100   7.787  -6.510
  384    H    GLY  27           H        GLY  27   1.778  10.103  -8.440
  385   1HA   GLY  27          1HA       GLY  27   2.635  12.679  -9.152
  386   2HA   GLY  27          2HA       GLY  27   2.161  11.461 -10.341
  387    H    VAL  28           H        VAL  28   1.595  14.427 -10.347
  388    HA   VAL  28           HA       VAL  28  -0.982  15.171  -9.610
  389    HB   VAL  28           HB       VAL  28   0.493  15.680 -12.217
  390   1HG1  VAL  28          1HG1      VAL  28  -2.185  16.205 -11.727
  391   2HG1  VAL  28          2HG1      VAL  28  -1.402  17.712 -11.241
  392   3HG1  VAL  28          3HG1      VAL  28  -1.171  17.086 -12.874
  393   1HG2  VAL  28          1HG2      VAL  28   0.275  17.242  -9.622
  394   2HG2  VAL  28          2HG2      VAL  28   1.708  16.395 -10.204
  395   3HG2  VAL  28          3HG2      VAL  28   1.104  17.807 -11.073
  396    H    SER  29           H        SER  29  -3.050  14.711 -10.320
  397    HA   SER  29           HA       SER  29  -4.707  13.287 -11.179
  398   1HB   SER  29          1HB       SER  29  -4.529  13.269 -13.755
  399   2HB   SER  29          2HB       SER  29  -4.586  14.844 -12.971
  400    HG   SER  29           HG       SER  29  -2.540  15.172 -13.462
  401    H    ALA  30           H        ALA  30  -2.354  11.982 -10.162
  402    HA   ALA  30           HA       ALA  30  -1.111   9.963 -10.279
  403   1HB   ALA  30          1HB       ALA  30  -3.888   9.700 -10.045
  404   2HB   ALA  30          2HB       ALA  30  -3.420   8.456 -11.205
  405   3HB   ALA  30          3HB       ALA  30  -2.676   8.494  -9.605
  406    H    LYS  31           H        LYS  31  -0.297  11.154 -12.492
  407    HA   LYS  31           HA       LYS  31  -0.102   8.978 -14.459
  408   1HB   LYS  31          1HB       LYS  31  -0.974  10.453 -16.294
  409   2HB   LYS  31          2HB       LYS  31  -2.201  10.055 -15.092
  410   1HG   LYS  31          1HG       LYS  31  -1.954  12.206 -14.019
  411   2HG   LYS  31          2HG       LYS  31  -0.553  12.597 -15.016
  412   1HD   LYS  31          1HD       LYS  31  -2.536  13.730 -15.897
  413   2HD   LYS  31          2HD       LYS  31  -1.988  12.505 -17.040
  414   1HE   LYS  31          1HE       LYS  31  -3.789  11.083 -16.587
  415   2HE   LYS  31          2HE       LYS  31  -4.056  11.777 -14.974
  416   1HZ   LYS  31          1HZ       LYS  31  -4.657  13.882 -16.053
  417   2HZ   LYS  31          2HZ       LYS  31  -4.511  13.142 -17.575
  418   3HZ   LYS  31          3HZ       LYS  31  -5.711  12.625 -16.494
  419    HA   PRO  32           HA       PRO  32   3.785  11.122 -14.696
  420   1HB   PRO  32          1HB       PRO  32   4.971   9.532 -16.572
  421   2HB   PRO  32          2HB       PRO  32   4.755   9.030 -14.885
  422   1HG   PRO  32          1HG       PRO  32   3.241   8.233 -17.300
  423   2HG   PRO  32          2HG       PRO  32   3.613   7.307 -15.840
  424   1HD   PRO  32          1HD       PRO  32   1.175   8.511 -16.414
  425   2HD   PRO  32          2HD       PRO  32   1.710   7.974 -14.808
  426    H    VAL  33           H        VAL  33   2.012  12.677 -15.945
  427    HA   VAL  33           HA       VAL  33   3.237  13.202 -18.626
  428    HB   VAL  33           HB       VAL  33   0.270  13.330 -18.002
  429   1HG1  VAL  33          1HG1      VAL  33   1.760  14.400 -20.081
  430   2HG1  VAL  33          2HG1      VAL  33   1.170  12.881 -20.756
  431   3HG1  VAL  33          3HG1      VAL  33   0.029  14.069 -20.125
  432   1HG2  VAL  33          1HG2      VAL  33   1.987  11.076 -19.043
  433   2HG2  VAL  33          2HG2      VAL  33   0.716  11.020 -17.822
  434   3HG2  VAL  33          3HG2      VAL  33   0.295  11.209 -19.525
  435    H    ASN  34           H        ASN  34   3.460  15.430 -19.073
  436    HA   ASN  34           HA       ASN  34   2.782  17.252 -16.819
  437   1HB   ASN  34          1HB       ASN  34   4.567  18.603 -17.651
  438   2HB   ASN  34          2HB       ASN  34   5.127  16.942 -17.824
  439   1HD2  ASN  34          2HD2      ASN  34   5.205  16.029 -20.018
  440   2HD2  ASN  34          1HD2      ASN  34   5.138  17.035 -21.385
  441    H    ARG  35           H        ARG  35   0.619  16.469 -18.418
  442    HA   ARG  35           HA       ARG  35  -1.156  17.349 -19.714
  443   1HB   ARG  35          1HB       ARG  35   0.083  19.842 -18.505
  444   2HB   ARG  35          2HB       ARG  35  -1.553  19.741 -19.159
  445   1HG   ARG  35          1HG       ARG  35  -0.750  17.719 -17.110
  446   2HG   ARG  35          2HG       ARG  35  -1.075  19.363 -16.559
  447   1HD   ARG  35          1HD       ARG  35  -3.080  18.328 -18.464
  448   2HD   ARG  35          2HD       ARG  35  -3.023  17.461 -16.916
  449    HE   ARG  35           HE       ARG  35  -3.863  20.222 -17.278
  450   1HH1  ARG  35          1HH1      ARG  35  -2.309  17.973 -15.137
  451   2HH1  ARG  35          2HH1      ARG  35  -2.711  18.870 -13.714
  452   1HH2  ARG  35          1HH2      ARG  35  -4.380  21.379 -15.421
  453   2HH2  ARG  35          2HH2      ARG  35  -3.877  20.789 -13.873
  454    HA   PRO  36           HA       PRO  36   1.653  18.635 -23.168
  455   1HB   PRO  36          1HB       PRO  36   0.867  16.684 -24.916
  456   2HB   PRO  36          2HB       PRO  36   2.166  16.449 -23.730
  457   1HG   PRO  36          1HG       PRO  36  -0.656  15.528 -23.652
  458   2HG   PRO  36          2HG       PRO  36   0.811  14.725 -23.075
  459   1HD   PRO  36          1HD       PRO  36  -0.981  16.022 -21.449
  460   2HD   PRO  36          2HD       PRO  36   0.728  15.757 -21.048
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  12.276 -15.158   2.201
    2   2H5*    G   1          2H5*        G   1  13.428 -16.495   2.413
    3    H4*    G   1           H4*        G   1  11.428 -18.064   2.399
    4    H3*    G   1           H3*        G   1   9.982 -15.401   2.591
    5    H2*    G   1           H2*        G   1   8.465 -16.351   4.133
    6   2HO*    G   1          2HO*        G   1   7.820 -18.310   3.753
    7    H1*    G   1           H1*        G   1  10.348 -17.922   5.447
    8    H8     G   1           H8         G   1  11.593 -14.407   4.751
    9    H1     G   1           H1         G   1   7.612 -14.867   9.771
   10   1H2     G   1          1H2         G   1   6.694 -16.871   9.829
   11   2H2     G   1          2H2         G   1   7.151 -18.136   8.711
   12   1H5*    C   2          1H5*        C   2   6.317 -17.023   0.728
   13   2H5*    C   2          2H5*        C   2   7.249 -16.371   2.094
   14    H4*    C   2           H4*        C   2   4.965 -18.298   2.530
   15    H3*    C   2           H3*        C   2   4.847 -15.296   2.112
   16    H2*    C   2           H2*        C   2   3.310 -15.090   3.877
   17   2HO*    C   2          2HO*        C   2   2.500 -17.487   3.048
   18    H1*    C   2           H1*        C   2   4.405 -17.068   5.515
   19   1H4     C   2          1H4         C   2   6.460 -11.612   7.987
   20   2H4     C   2          2H4         C   2   7.686 -11.474   6.753
   21    H5     C   2           H5         C   2   7.587 -12.821   4.712
   22    H6     C   2           H6         C   2   6.843 -14.961   3.810
   23   1H5*    C   3          1H5*        C   3   0.385 -13.837   1.322
   24   2H5*    C   3          2H5*        C   3   1.557 -12.566   1.708
   25    H4*    C   3           H4*        C   3   0.012 -14.347   3.590
   26    H3*    C   3           H3*        C   3   0.432 -11.375   3.234
   27    H2*    C   3           H2*        C   3   0.242 -11.033   5.539
   28   2HO*    C   3          2HO*        C   3  -0.839 -12.273   6.875
   29    H1*    C   3           H1*        C   3   1.561 -13.348   6.333
   30   1H4     C   3          1H4         C   3   5.878  -8.688   6.764
   31   2H4     C   3          2H4         C   3   6.037  -8.626   5.023
   32    H5     C   3           H5         C   3   5.024 -10.378   3.635
   33    H6     C   3           H6         C   3   3.335 -12.109   3.534
   34   1H5*    C   4          1H5*        C   4  -3.712 -10.358   4.700
   35   2H5*    C   4          2H5*        C   4  -1.940 -10.410   4.644
   36    H4*    C   4           H4*        C   4  -3.477 -10.338   7.245
   37    H3*    C   4           H3*        C   4  -2.611  -8.021   5.483
   38    H2*    C   4           H2*        C   4  -1.883  -6.843   7.372
   39   2HO*    C   4          2HO*        C   4  -2.420  -7.749   9.531
   40    H1*    C   4           H1*        C   4  -0.941  -9.029   8.810
   41   1H4     C   4          1H4         C   4   3.797  -5.927   5.646
   42   2H4     C   4          2H4         C   4   4.343  -7.563   5.372
   43    H5     C   4           H5         C   4   1.963  -8.535   4.423
   44    H6     C   4           H6         C   4  -0.057  -9.333   5.353
   45   1H5*    U   5          1H5*        U   5  -4.566  -6.282   8.614
   46   2H5*    U   5          2H5*        U   5  -5.801  -5.139   8.042
   47    H4*    U   5           H4*        U   5  -4.399  -3.941   9.553
   48    H3*    U   5           H3*        U   5  -3.701  -3.301   6.673
   49    H2*    U   5           H2*        U   5  -2.106  -1.765   7.483
   50   2HO*    U   5          2HO*        U   5  -3.557  -1.897   9.926
   51    H1*    U   5           H1*        U   5  -1.455  -3.246   9.788
   52    H3     U   5           H3         U   5   2.329  -2.471   7.429
   53    H5     U   5           H5         U   5   0.460  -5.598   5.374
   54    H6     U   5           H6         U   5  -1.486  -5.208   6.727
   55   1H5*    G   6          1H5*        G   6  -1.843   0.033   8.152
   56   2H5*    G   6          2H5*        G   6  -3.124   1.257   8.300
   57    H4*    G   6           H4*        G   6  -2.027   2.485   6.777
   58    H3*    G   6           H3*        G   6  -2.675   0.118   4.989
   59    H2*    G   6           H2*        G   6  -1.215   0.971   3.355
   60   2HO*    G   6          2HO*        G   6  -0.758   3.049   3.127
   61    H1*    G   6           H1*        G   6   0.687   2.010   5.128
   62    H8     G   6           H8         G   6  -0.958  -1.501   5.242
   63    H1     G   6           H1         G   6   5.011  -1.266   2.857
   64   1H2     G   6          1H2         G   6   5.604   0.877   2.544
   65   2H2     G   6          2H2         G   6   4.826   2.113   3.514
   66   1H5*    A   7          1H5*        A   7  -4.615   1.834   0.799
   67   2H5*    A   7          2H5*        A   7  -3.700   0.314   0.807
   68    H4*    A   7           H4*        A   7  -2.836   1.731  -0.950
   69    H3*    A   7           H3*        A   7  -1.019   1.618   1.483
   70    H2*    A   7           H2*        A   7   0.511   3.000   0.310
   71   2HO*    A   7          2HO*        A   7  -0.002   3.401  -2.025
   72    H1*    A   7           H1*        A   7  -1.442   4.444  -1.072
   73    H8     A   7           H8         A   7  -2.414   4.584   2.495
   74   1H6     A   7          1H6         A   7   0.854   9.124   3.321
   75   2H6     A   7          2H6         A   7   1.721   7.823   4.107
   76    H2     A   7           H2         A   7   2.594   7.042  -0.690
   77   1H5*    A   8          1H5*        A   8   0.923   0.439  -1.550
   78   2H5*    A   8          2H5*        A   8   2.177  -0.817  -1.678
   79    H4*    A   8           H4*        A   8   3.259   1.285  -2.048
   80    H3*    A   8           H3*        A   8   3.670   0.264   0.783
   81    H2*    A   8           H2*        A   8   5.095   2.129   1.195
   82   2HO*    A   8          2HO*        A   8   4.988   3.186  -1.355
   83    H1*    A   8           H1*        A   8   3.536   3.940  -0.271
   84    H8     A   8           H8         A   8   1.235   1.832   1.802
   85   1H6     A   8          1H6         A   8   2.313   5.750   6.448
   86   2H6     A   8          2H6         A   8   1.671   4.160   6.099
   87    H2     A   8           H2         A   8   5.415   6.496   3.264
   88   1H5*    A   9          2H5*        A   9   8.288  -1.493  -1.840
   89   2H5*    A   9          1H5*        A   9   7.326  -0.411  -0.810
   90    H4*    A   9           H4*        A   9   9.476   0.328  -2.424
   91    H3*    A   9           H3*        A   9   7.206   1.907  -1.187
   92    H2*    A   9           H2*        A   9   8.021   3.848  -2.268
   93   2HO*    A   9          2HO*        A   9  10.297   2.478  -3.199
   94    H1*    A   9           H1*        A   9   8.684   2.544  -4.648
   95    H8     A   9           H8         A   9   6.307   4.253  -2.548
   96   1H6     A   9          1H6         A   9   2.409   4.441  -5.494
   97   2H6     A   9          2H6         A   9   1.802   3.303  -6.677
   98    H2     A   9           H2         A   9   5.276   0.682  -7.780
   99   1H5*    A  10          1H5*        A  10  10.100   1.151   3.879
  100   2H5*    A  10          2H5*        A  10   8.394   1.463   3.503
  101    H4*    A  10           H4*        A  10  10.291   3.780   3.719
  102    H3*    A  10           H3*        A  10   9.142   2.176   6.003
  103    H2*    A  10           H2*        A  10   8.566   4.139   7.159
  104   2HO*    A  10          2HO*        A  10   9.414   6.141   6.656
  105    H1*    A  10           H1*        A  10   7.797   5.629   4.932
  106    H8     A  10           H8         A  10   6.205   2.551   4.055
  107   1H6     A  10          1H6         A  10   1.895   3.521   8.336
  108   2H6     A  10          2H6         A  10   2.597   2.202   7.427
  109    H2     A  10           H2         A  10   5.443   6.150   9.327
  110   1H5*    A  11          1H5*        A  11   9.938   4.750   8.635
  111   2H5*    A  11          2H5*        A  11  10.717   3.841   9.951
  112    H4*    A  11           H4*        A  11   8.365   4.613  10.447
  113    H3*    A  11           H3*        A  11   9.039   1.661  10.462
  114    H2*    A  11           H2*        A  11   6.804   1.154  11.016
  115   2HO*    A  11          2HO*        A  11   6.307   3.904  11.479
  116    H1*    A  11           H1*        A  11   5.612   3.123   9.480
  117    H8     A  11           H8         A  11   8.353   1.471   7.489
  118   1H6     A  11          1H6         A  11   4.564  -3.132   6.311
  119   2H6     A  11          2H6         A  11   5.323  -1.963   5.257
  120    H2     A  11           H2         A  11   2.427  -0.320   9.215
  121   1H5*    G  12          1H5*        G  12   9.227  -1.300  13.368
  122   2H5*    G  12          2H5*        G  12   8.987  -0.412  11.853
  123    H4*    G  12           H4*        G  12   6.893   0.159  13.803
  124    H3*    G  12           H3*        G  12   7.368  -2.713  12.996
  125    H2*    G  12           H2*        G  12   5.048  -2.977  12.601
  126   2HO*    G  12          2HO*        G  12   4.815  -1.249  14.591
  127    H1*    G  12           H1*        G  12   4.628  -0.437  11.504
  128    H8     G  12           H8         G  12   7.556  -1.149   9.659
  129    H1     G  12           H1         G  12   3.006  -5.439   8.191
  130   1H2     G  12          1H2         G  12   1.516  -5.550   9.814
  131   2H2     G  12          2H2         G  12   1.410  -4.295  11.028
  132   1H5*    G  13          1H5*        G  13   4.882  -3.301  16.142
  133   2H5*    G  13          2H5*        G  13   5.343  -4.509  17.359
  134    H4*    G  13           H4*        G  13   3.274  -5.189  16.289
  135    H3*    G  13           H3*        G  13   5.703  -6.736  15.318
  136    H2*    G  13           H2*        G  13   4.306  -8.014  13.962
  137   2HO*    G  13          2HO*        G  13   2.637  -8.662  15.180
  138    H1*    G  13           H1*        G  13   2.495  -5.945  13.370
  139    H8     G  13           H8         G  13   5.877  -4.611  12.676
  140    H1     G  13           H1         G  13   3.941  -8.916   8.314
  141   1H2     G  13          1H2         G  13   2.307 -10.160   9.185
  142   2H2     G  13          2H2         G  13   1.332  -9.504  10.481
  143   1H5*    G  14          1H5*        G  14   0.740  -8.654  15.944
  144   2H5*    G  14          2H5*        G  14   0.666  -9.409  17.552
  145    H4*    G  14           H4*        G  14   0.150 -11.254  16.278
  146    H3*    G  14           H3*        G  14   3.179 -11.156  16.122
  147    H2*    G  14           H2*        G  14   3.079 -13.087  14.746
  148   2HO*    G  14          2HO*        G  14   1.231 -14.319  14.524
  149    H1*    G  14           H1*        G  14   0.822 -12.273  13.322
  150    H8     G  14           H8         G  14   3.435  -9.587  14.031
  151    H1     G  14           H1         G  14   4.561 -13.074   8.745
  152   1H2     G  14          1H2         G  14   2.854 -14.541   8.491
  153   2H2     G  14          2H2         G  14   2.196 -15.211   9.967
  154   1H5*    C  15          1H5*        C  15   1.776 -14.988  16.619
  155   2H5*    C  15          2H5*        C  15   2.701 -15.943  17.798
  156    H4*    C  15           H4*        C  15   2.536 -17.171  15.691
  157    H3*    C  15           H3*        C  15   5.292 -16.027  16.247
  158    H2*    C  15           H2*        C  15   6.057 -17.073  14.279
  159   2HO*    C  15          2HO*        C  15   5.164 -19.137  14.667
  160    H1*    C  15           H1*        C  15   3.642 -16.769  12.857
  161   1H4     C  15          1H4         C  15   7.679 -12.615  10.302
  162   2H4     C  15          2H4         C  15   7.789 -11.708  11.800
  163    H5     C  15           H5         C  15   6.180 -12.128  13.616
  164    H6     C  15           H6         C  15   4.733 -13.788  14.598
  165   2H    ASP   2          2H        ASP   2   9.544  -8.762  -0.649
  166   1H    ASP   2          1H        ASP   2   9.256  -9.741  -2.007
  167   3H    ASP   2          3H        ASP   2  10.808  -9.670  -1.329
  168    HA   ASP   2           HA       ASP   2   9.895 -11.713  -0.580
  169   1HB   ASP   2          1HB       ASP   2   9.478  -9.612   1.563
  170   2HB   ASP   2          2HB       ASP   2   9.949 -11.289   1.807
  171    H    ALA   3           H        ALA   3   8.109 -11.999   1.549
  172    HA   ALA   3           HA       ALA   3   5.603 -12.416   0.272
  173   1HB   ALA   3          1HB       ALA   3   6.494 -13.465   2.378
  174   2HB   ALA   3          2HB       ALA   3   6.173 -11.945   3.212
  175   3HB   ALA   3          3HB       ALA   3   4.838 -12.878   2.536
  176    H    GLN   4           H        GLN   4   6.855  -9.643   2.061
  177    HA   GLN   4           HA       GLN   4   4.315  -8.245   2.200
  178   1HB   GLN   4          1HB       GLN   4   6.576  -8.008   3.545
  179   2HB   GLN   4          2HB       GLN   4   7.042  -6.946   2.218
  180   1HG   GLN   4          1HG       GLN   4   4.385  -6.261   3.082
  181   2HG   GLN   4          2HG       GLN   4   5.453  -6.295   4.475
  182   1HE2  GLN   4          2HE2      GLN   4   5.162  -4.893   1.185
  183   2HE2  GLN   4          1HE2      GLN   4   6.119  -3.530   1.514
  184    H    THR   5           H        THR   5   7.236  -7.707   0.210
  185    HA   THR   5           HA       THR   5   6.145  -5.784  -1.562
  186    HB   THR   5           HB       THR   5   8.102  -8.071  -2.003
  187    HG1  THR   5           HG1      THR   5   8.547  -5.312  -1.539
  188   1HG2  THR   5          1HG2      THR   5   7.466  -5.639  -3.687
  189   2HG2  THR   5          2HG2      THR   5   8.930  -6.606  -3.889
  190   3HG2  THR   5          3HG2      THR   5   7.345  -7.333  -4.162
  191    H    ARG   6           H        ARG   6   5.744  -9.248  -1.305
  192    HA   ARG   6           HA       ARG   6   4.389  -9.677  -3.833
  193   1HB   ARG   6          1HB       ARG   6   5.152 -11.123  -1.409
  194   2HB   ARG   6          2HB       ARG   6   3.542 -11.585  -1.971
  195   1HG   ARG   6          1HG       ARG   6   4.358 -12.599  -3.849
  196   2HG   ARG   6          2HG       ARG   6   5.594 -11.365  -4.099
  197   1HD   ARG   6          1HD       ARG   6   6.947 -13.160  -3.485
  198   2HD   ARG   6          2HD       ARG   6   6.613 -12.484  -1.879
  199    HE   ARG   6           HE       ARG   6   5.235 -14.349  -1.439
  200   1HH1  ARG   6          1HH1      ARG   6   5.795 -13.990  -4.847
  201   2HH1  ARG   6          2HH1      ARG   6   4.993 -15.469  -5.252
  202   1HH2  ARG   6          1HH2      ARG   6   4.197 -16.268  -1.979
  203   2HH2  ARG   6          2HH2      ARG   6   4.093 -16.752  -3.639
  204    H    ARG   7           H        ARG   7   3.337  -9.313  -0.432
  205    HA   ARG   7           HA       ARG   7   0.557  -9.548  -0.981
  206   1HB   ARG   7          1HB       ARG   7   1.468  -9.706   1.260
  207   2HB   ARG   7          2HB       ARG   7   2.130  -8.074   1.159
  208   1HG   ARG   7          1HG       ARG   7  -0.300  -7.288   0.799
  209   2HG   ARG   7          2HG       ARG   7  -0.777  -8.899   1.331
  210   1HD   ARG   7          1HD       ARG   7  -0.151  -8.504   3.505
  211   2HD   ARG   7          2HD       ARG   7   1.189  -7.448   3.042
  212    HE   ARG   7           HE       ARG   7  -0.323  -5.635   3.091
  213   1HH1  ARG   7          1HH1      ARG   7  -2.012  -8.648   2.860
  214   2HH1  ARG   7          2HH1      ARG   7  -3.569  -7.914   3.016
  215   1HH2  ARG   7          1HH2      ARG   7  -2.311  -4.688   3.292
  216   2HH2  ARG   7          2HH2      ARG   7  -3.739  -5.661   3.261
  217    H    ARG   8           H        ARG   8   2.800  -6.856  -1.195
  218    HA   ARG   8           HA       ARG   8   1.030  -4.648  -1.414
  219   1HB   ARG   8          1HB       ARG   8   3.744  -5.188  -1.610
  220   2HB   ARG   8          2HB       ARG   8   3.348  -4.742  -3.263
  221   1HG   ARG   8          1HG       ARG   8   4.066  -2.808  -1.827
  222   2HG   ARG   8          2HG       ARG   8   2.476  -2.605  -2.552
  223   1HD   ARG   8          1HD       ARG   8   2.847  -2.078   0.027
  224   2HD   ARG   8          2HD       ARG   8   1.367  -2.890  -0.507
  225    HE   ARG   8           HE       ARG   8   3.554  -4.739   0.076
  226   1HH1  ARG   8          1HH1      ARG   8   0.870  -2.952   1.350
  227   2HH1  ARG   8          2HH1      ARG   8   0.642  -4.020   2.686
  228   1HH2  ARG   8          2HH2      ARG   8   3.247  -6.115   1.809
  229   2HH2  ARG   8          1HH2      ARG   8   1.980  -5.803   2.945
  230    H    GLU   9           H        GLU   9   2.134  -6.966  -3.865
  231    HA   GLU   9           HA       GLU   9   0.806  -5.734  -6.086
  232   1HB   GLU   9          1HB       GLU   9   1.466  -8.633  -5.444
  233   2HB   GLU   9          2HB       GLU   9   0.977  -8.064  -7.040
  234   1HG   GLU   9          1HG       GLU   9   3.121  -6.415  -6.006
  235   2HG   GLU   9          2HG       GLU   9   3.593  -8.114  -5.983
  236    H    ARG  10           H        ARG  10  -0.224  -7.758  -3.455
  237    HA   ARG  10           HA       ARG  10  -2.911  -8.227  -4.505
  238   1HB   ARG  10          1HB       ARG  10  -1.192  -9.079  -2.341
  239   2HB   ARG  10          2HB       ARG  10  -2.751  -8.579  -1.689
  240   1HG   ARG  10          1HG       ARG  10  -3.927 -10.193  -2.908
  241   2HG   ARG  10          2HG       ARG  10  -2.645 -10.359  -4.107
  242   1HD   ARG  10          1HD       ARG  10  -1.228 -11.543  -2.540
  243   2HD   ARG  10          2HD       ARG  10  -2.352 -11.213  -1.206
  244    HE   ARG  10           HE       ARG  10  -3.902 -12.459  -3.174
  245   1HH1  ARG  10          1HH1      ARG  10  -1.058 -13.196  -1.326
  246   2HH1  ARG  10          2HH1      ARG  10  -1.353 -14.902  -1.331
  247   1HH2  ARG  10          1HH2      ARG  10  -4.277 -14.677  -3.174
  248   2HH2  ARG  10          2HH2      ARG  10  -3.166 -15.737  -2.372
  249    H    ARG  11           H        ARG  11  -1.211  -5.678  -2.980
  250    HA   ARG  11           HA       ARG  11  -3.676  -4.484  -1.836
  251   1HB   ARG  11          1HB       ARG  11  -0.745  -3.705  -1.828
  252   2HB   ARG  11          2HB       ARG  11  -2.022  -2.812  -1.003
  253   1HG   ARG  11          1HG       ARG  11  -1.190  -5.682  -0.454
  254   2HG   ARG  11          2HG       ARG  11  -0.921  -4.310   0.603
  255   1HD   ARG  11          1HD       ARG  11  -3.007  -4.515   1.478
  256   2HD   ARG  11          2HD       ARG  11  -3.741  -4.534  -0.128
  257    HE   ARG  11           HE       ARG  11  -2.334  -7.009   0.412
  258   1HH1  ARG  11          1HH1      ARG  11  -5.269  -5.249   0.983
  259   2HH1  ARG  11          2HH1      ARG  11  -6.219  -6.675   1.219
  260   1HH2  ARG  11          1HH2      ARG  11  -3.577  -8.856   0.719
  261   2HH2  ARG  11          2HH2      ARG  11  -5.267  -8.709   1.070
  262    H    ALA  12           H        ALA  12  -2.341  -4.640  -4.870
  263    HA   ALA  12           HA       ALA  12  -2.155  -1.936  -5.770
  264   1HB   ALA  12          1HB       ALA  12  -1.710  -4.133  -7.014
  265   2HB   ALA  12          2HB       ALA  12  -3.454  -4.264  -7.240
  266   3HB   ALA  12          3HB       ALA  12  -2.573  -2.911  -7.949
  267    H    GLU  13           H        GLU  13  -4.905  -3.904  -4.852
  268    HA   GLU  13           HA       GLU  13  -6.937  -2.135  -5.968
  269   1HB   GLU  13          1HB       GLU  13  -6.977  -4.321  -3.855
  270   2HB   GLU  13          2HB       GLU  13  -8.419  -3.590  -4.561
  271   1HG   GLU  13          1HG       GLU  13  -8.295  -5.180  -6.160
  272   2HG   GLU  13          2HG       GLU  13  -6.891  -4.309  -6.779
  273    H    LYS  14           H        LYS  14  -5.194  -2.514  -2.912
  274    HA   LYS  14           HA       LYS  14  -6.824  -0.531  -1.488
  275   1HB   LYS  14          1HB       LYS  14  -4.116  -1.827  -0.967
  276   2HB   LYS  14          2HB       LYS  14  -5.015  -0.871   0.213
  277   1HG   LYS  14          1HG       LYS  14  -6.340  -3.213  -1.119
  278   2HG   LYS  14          2HG       LYS  14  -5.246  -3.479   0.240
  279   1HD   LYS  14          1HD       LYS  14  -6.737  -1.455   1.242
  280   2HD   LYS  14          2HD       LYS  14  -7.933  -2.222   0.196
  281   1HE   LYS  14          1HE       LYS  14  -6.251  -3.930   2.022
  282   2HE   LYS  14          2HE       LYS  14  -7.683  -3.099   2.655
  283   1HZ   LYS  14          1HZ       LYS  14  -8.955  -4.010   0.775
  284   2HZ   LYS  14          2HZ       LYS  14  -7.588  -4.894   0.287
  285   3HZ   LYS  14          3HZ       LYS  14  -8.335  -5.232   1.776
  286    H    GLN  15           H        GLN  15  -3.819  -0.749  -3.239
  287    HA   GLN  15           HA       GLN  15  -2.807   1.899  -2.758
  288   1HB   GLN  15          1HB       GLN  15  -2.248  -0.542  -4.264
  289   2HB   GLN  15          2HB       GLN  15  -1.842   0.884  -5.205
  290   1HG   GLN  15          1HG       GLN  15  -0.217   1.581  -3.694
  291   2HG   GLN  15          2HG       GLN  15  -1.003   0.773  -2.337
  292   1HE2  GLN  15          2HE2      GLN  15  -1.058  -1.733  -2.557
  293   2HE2  GLN  15          1HE2      GLN  15   0.346  -2.470  -3.169
  294    H    ALA  16           H        ALA  16  -4.495   0.409  -5.529
  295    HA   ALA  16           HA       ALA  16  -4.696   2.853  -7.052
  296   1HB   ALA  16          1HB       ALA  16  -4.905   0.498  -7.906
  297   2HB   ALA  16          2HB       ALA  16  -6.459   0.373  -7.081
  298   3HB   ALA  16          3HB       ALA  16  -6.252   1.522  -8.402
  299    H    GLN  17           H        GLN  17  -6.598   1.486  -4.426
  300    HA   GLN  17           HA       GLN  17  -8.885   3.280  -4.881
  301   1HB   GLN  17          1HB       GLN  17  -7.955   1.292  -2.812
  302   2HB   GLN  17          2HB       GLN  17  -9.293   2.373  -2.430
  303   1HG   GLN  17          1HG       GLN  17  -9.211   0.650  -4.917
  304   2HG   GLN  17          2HG       GLN  17  -9.986   0.148  -3.414
  305   1HE2  GLN  17          2HE2      GLN  17 -10.681   1.563  -6.352
  306   2HE2  GLN  17          1HE2      GLN  17 -12.057   2.454  -5.912
  307    H    TRP  18           H        TRP  18  -5.969   3.125  -2.955
  308    HA   TRP  18           HA       TRP  18  -6.501   5.541  -1.398
  309   1HB   TRP  18          1HB       TRP  18  -5.057   3.740  -0.570
  310   2HB   TRP  18          2HB       TRP  18  -4.054   3.846  -2.002
  311    HD1  TRP  18           HD1      TRP  18  -4.612   5.530   1.342
  312    HE1  TRP  18           HE1      TRP  18  -2.848   7.399   1.624
  313    HE3  TRP  18           HE3      TRP  18  -2.615   5.544  -3.296
  314    HZ2  TRP  18           HZ2      TRP  18  -0.835   8.706   0.059
  315    HZ3  TRP  18           HZ3      TRP  18  -0.804   7.068  -3.889
  316    HH2  TRP  18           HH2      TRP  18   0.103   8.628  -2.243
  317    H    LYS  19           H        LYS  19  -4.434   4.617  -4.106
  318    HA   LYS  19           HA       LYS  19  -3.214   7.132  -4.621
  319   1HB   LYS  19          1HB       LYS  19  -3.882   4.686  -6.272
  320   2HB   LYS  19          2HB       LYS  19  -3.045   6.066  -6.969
  321   1HG   LYS  19          1HG       LYS  19  -1.391   5.849  -5.025
  322   2HG   LYS  19          2HG       LYS  19  -2.100   4.261  -4.753
  323   1HD   LYS  19          1HD       LYS  19  -1.133   5.083  -7.487
  324   2HD   LYS  19          2HD       LYS  19  -0.022   4.407  -6.294
  325   1HE   LYS  19          1HE       LYS  19  -2.133   2.641  -6.153
  326   2HE   LYS  19          2HE       LYS  19  -2.103   3.051  -7.878
  327   1HZ   LYS  19          1HZ       LYS  19   0.354   2.422  -6.344
  328   2HZ   LYS  19          2HZ       LYS  19  -0.534   1.227  -7.163
  329   3HZ   LYS  19          3HZ       LYS  19   0.168   2.505  -8.030
  330    H    ALA  20           H        ALA  20  -6.282   5.700  -5.597
  331    HA   ALA  20           HA       ALA  20  -7.019   7.607  -7.562
  332   1HB   ALA  20          1HB       ALA  20  -8.288   5.598  -5.814
  333   2HB   ALA  20          2HB       ALA  20  -9.368   6.866  -6.393
  334   3HB   ALA  20          3HB       ALA  20  -8.489   5.860  -7.546
  335    H    ALA  21           H        ALA  21  -7.079   7.700  -4.053
  336    HA   ALA  21           HA       ALA  21  -8.218  10.459  -4.191
  337   1HB   ALA  21          1HB       ALA  21  -9.399   8.333  -3.070
  338   2HB   ALA  21          2HB       ALA  21  -8.369   8.799  -1.716
  339   3HB   ALA  21          3HB       ALA  21  -9.547   9.942  -2.363
  340    H    ASN  22           H        ASN  22  -5.412   9.514  -4.285
  341    HA   ASN  22           HA       ASN  22  -4.363  11.363  -2.237
  342   1HB   ASN  22          1HB       ASN  22  -3.654   8.421  -2.350
  343   2HB   ASN  22          2HB       ASN  22  -2.772   9.620  -1.407
  344   1HD2  ASN  22          2HD2      ASN  22  -5.099   7.327  -1.067
  345   2HD2  ASN  22          1HD2      ASN  22  -5.980   7.982   0.228
  346    HA   PRO  23           HA       PRO  23  -1.987  10.898  -6.290
  347   1HB   PRO  23          1HB       PRO  23  -2.808  13.235  -7.471
  348   2HB   PRO  23          2HB       PRO  23  -3.631  11.684  -7.739
  349   1HG   PRO  23          1HG       PRO  23  -4.380  13.938  -5.951
  350   2HG   PRO  23          2HG       PRO  23  -5.410  12.884  -6.933
  351   1HD   PRO  23          1HD       PRO  23  -5.073  12.579  -4.244
  352   2HD   PRO  23          2HD       PRO  23  -5.468  11.237  -5.330
  353    H    LEU  24           H        LEU  24  -2.876  13.422  -4.051
  354    HA   LEU  24           HA       LEU  24  -0.727  15.254  -4.352
  355   1HB   LEU  24          1HB       LEU  24  -1.554  16.098  -2.324
  356   2HB   LEU  24          2HB       LEU  24  -2.928  15.126  -2.840
  357    HG   LEU  24           HG       LEU  24  -0.757  14.019  -1.033
  358   1HD1  LEU  24          1HD1      LEU  24  -3.333  15.427  -0.294
  359   2HD1  LEU  24          2HD1      LEU  24  -2.370  14.468   0.831
  360   3HD1  LEU  24          3HD1      LEU  24  -1.693  15.932   0.116
  361   1HD2  LEU  24          1HD2      LEU  24  -2.813  12.756  -2.387
  362   2HD2  LEU  24          2HD2      LEU  24  -2.047  12.135  -0.927
  363   3HD2  LEU  24          3HD2      LEU  24  -3.541  13.067  -0.814
  364    H    LEU  25           H        LEU  25  -0.953  12.152  -2.735
  365    HA   LEU  25           HA       LEU  25   1.898  12.270  -1.881
  366   1HB   LEU  25          1HB       LEU  25  -0.614  10.835  -1.139
  367   2HB   LEU  25          2HB       LEU  25   0.879   9.906  -0.985
  368    HG   LEU  25           HG       LEU  25   1.017  12.655   0.096
  369   1HD1  LEU  25          1HD1      LEU  25  -1.068  10.728   0.936
  370   2HD1  LEU  25          2HD1      LEU  25  -0.104  11.406   2.248
  371   3HD1  LEU  25          3HD1      LEU  25  -0.992  12.475   1.163
  372   1HD2  LEU  25          1HD2      LEU  25   2.635  10.541   0.223
  373   2HD2  LEU  25          2HD2      LEU  25   2.510  11.669   1.574
  374   3HD2  LEU  25          3HD2      LEU  25   1.624  10.144   1.612
  375    H    VAL  26           H        VAL  26   1.020  12.146  -4.613
  376    HA   VAL  26           HA       VAL  26   2.339   9.645  -5.485
  377    HB   VAL  26           HB       VAL  26  -0.531  10.278  -5.421
  378   1HG1  VAL  26          1HG1      VAL  26   0.756   9.615  -8.081
  379   2HG1  VAL  26          2HG1      VAL  26  -0.931   9.242  -7.725
  380   3HG1  VAL  26          3HG1      VAL  26  -0.375  10.918  -7.705
  381   1HG2  VAL  26          1HG2      VAL  26   0.583   8.209  -4.567
  382   2HG2  VAL  26          2HG2      VAL  26  -0.715   7.867  -5.711
  383   3HG2  VAL  26          3HG2      VAL  26   0.967   7.762  -6.231
  384    H    GLY  27           H        GLY  27   3.665  10.174  -7.220
  385   1HA   GLY  27          1HA       GLY  27   4.625  11.466  -8.938
  386   2HA   GLY  27          2HA       GLY  27   2.962  11.849  -9.395
  387    H    VAL  28           H        VAL  28   2.083  13.826  -8.776
  388    HA   VAL  28           HA       VAL  28   2.276  16.161  -8.353
  389    HB   VAL  28           HB       VAL  28   1.789  14.646  -6.218
  390   1HG1  VAL  28          1HG1      VAL  28   4.475  14.809  -5.879
  391   2HG1  VAL  28          2HG1      VAL  28   3.969  16.236  -4.980
  392   3HG1  VAL  28          3HG1      VAL  28   3.344  14.647  -4.541
  393   1HG2  VAL  28          1HG2      VAL  28   1.506  17.310  -6.882
  394   2HG2  VAL  28          2HG2      VAL  28   0.837  16.545  -5.441
  395   3HG2  VAL  28          3HG2      VAL  28   2.384  17.388  -5.353
  396    H    SER  29           H        SER  29   4.013  17.462  -6.527
  397    HA   SER  29           HA       SER  29   6.315  17.932  -8.207
  398   1HB   SER  29          1HB       SER  29   6.581  18.849  -5.458
  399   2HB   SER  29          2HB       SER  29   6.370  19.799  -6.924
  400    HG   SER  29           HG       SER  29   4.475  18.788  -5.129
  401    H    ALA  30           H        ALA  30   6.652  15.353  -7.997
  402    HA   ALA  30           HA       ALA  30   8.972  14.997  -6.191
  403   1HB   ALA  30          1HB       ALA  30   6.741  14.335  -5.073
  404   2HB   ALA  30          2HB       ALA  30   6.681  13.013  -6.240
  405   3HB   ALA  30          3HB       ALA  30   8.008  13.107  -5.080
  406    H    LYS  31           H        LYS  31   9.053  15.270  -8.930
  407    HA   LYS  31           HA       LYS  31   9.356  12.474  -9.971
  408   1HB   LYS  31          1HB       LYS  31   8.819  15.155 -11.279
  409   2HB   LYS  31          2HB       LYS  31   9.155  13.686 -12.195
  410   1HG   LYS  31          1HG       LYS  31   7.169  13.004 -10.286
  411   2HG   LYS  31          2HG       LYS  31   6.667  14.537 -11.000
  412   1HD   LYS  31          1HD       LYS  31   7.667  12.354 -12.800
  413   2HD   LYS  31          2HD       LYS  31   6.022  12.259 -12.171
  414   1HE   LYS  31          1HE       LYS  31   6.307  14.929 -13.018
  415   2HE   LYS  31          2HE       LYS  31   7.053  13.950 -14.296
  416   1HZ   LYS  31          1HZ       LYS  31   5.063  12.443 -14.062
  417   2HZ   LYS  31          2HZ       LYS  31   4.335  13.675 -13.146
  418   3HZ   LYS  31          3HZ       LYS  31   4.756  13.959 -14.764
  419    HA   PRO  32           HA       PRO  32  13.643  14.007  -9.584
  420   1HB   PRO  32          1HB       PRO  32  14.762  11.526  -9.290
  421   2HB   PRO  32          2HB       PRO  32  14.056  12.437  -7.939
  422   1HG   PRO  32          1HG       PRO  32  12.910  10.186  -9.509
  423   2HG   PRO  32          2HG       PRO  32  12.777  10.543  -7.780
  424   1HD   PRO  32          1HD       PRO  32  10.803  11.064  -9.601
  425   2HD   PRO  32          2HD       PRO  32  11.006  11.958  -8.079
  426    H    VAL  33           H        VAL  33  15.301  13.983 -11.172
  427    HA   VAL  33           HA       VAL  33  16.193  13.733 -13.344
  428    HB   VAL  33           HB       VAL  33  14.914  10.994 -13.046
  429   1HG1  VAL  33          1HG1      VAL  33  16.521  12.217 -15.095
  430   2HG1  VAL  33          2HG1      VAL  33  17.454  10.934 -14.324
  431   3HG1  VAL  33          3HG1      VAL  33  15.880  10.576 -15.035
  432   1HG2  VAL  33          1HG2      VAL  33  16.307  11.634 -11.081
  433   2HG2  VAL  33          2HG2      VAL  33  17.033  10.319 -12.006
  434   3HG2  VAL  33          3HG2      VAL  33  17.655  11.962 -12.168
  435    H    ASN  34           H        ASN  34  14.976  15.133 -14.632
  436    HA   ASN  34           HA       ASN  34  12.269  15.024 -15.331
  437   1HB   ASN  34          1HB       ASN  34  13.967  16.814 -15.815
  438   2HB   ASN  34          2HB       ASN  34  14.588  15.805 -17.124
  439   1HD2  ASN  34          2HD2      ASN  34  13.899  17.517 -18.676
  440   2HD2  ASN  34          1HD2      ASN  34  12.264  17.660 -19.107
  441    H    ARG  35           H        ARG  35  11.200  13.270 -16.153
  442    HA   ARG  35           HA       ARG  35  11.779  12.195 -18.746
  443   1HB   ARG  35          1HB       ARG  35  13.288  11.147 -16.529
  444   2HB   ARG  35          2HB       ARG  35  12.229   9.879 -17.144
  445   1HG   ARG  35          1HG       ARG  35  13.057  10.540 -19.483
  446   2HG   ARG  35          2HG       ARG  35  14.323  11.446 -18.655
  447   1HD   ARG  35          1HD       ARG  35  15.265   9.489 -17.700
  448   2HD   ARG  35          2HD       ARG  35  13.809   8.529 -18.031
  449    HE   ARG  35           HE       ARG  35  14.862   9.628 -20.480
  450   1HH1  ARG  35          1HH1      ARG  35  15.378   7.169 -18.085
  451   2HH1  ARG  35          2HH1      ARG  35  16.175   6.098 -19.186
  452   1HH2  ARG  35          1HH2      ARG  35  15.899   8.229 -21.903
  453   2HH2  ARG  35          2HH2      ARG  35  16.469   6.694 -21.337
  454    HA   PRO  36           HA       PRO  36   8.342   9.557 -16.748
  455   1HB   PRO  36          1HB       PRO  36   7.885   9.785 -14.060
  456   2HB   PRO  36          2HB       PRO  36   9.029   8.616 -14.749
  457   1HG   PRO  36          1HG       PRO  36   9.554  11.246 -13.465
  458   2HG   PRO  36          2HG       PRO  36  10.468   9.735 -13.357
  459   1HD   PRO  36          1HD       PRO  36  11.213  11.838 -14.923
  460   2HD   PRO  36          2HD       PRO  36  11.636  10.150 -15.275
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  11.912 -16.053   0.673
    2   2H5*    G   1          2H5*        G   1  13.122 -15.998   1.975
    3    H4*    G   1           H4*        G   1  11.812 -18.564   2.000
    4    H3*    G   1           H3*        G   1   9.983 -16.137   1.944
    5    H2*    G   1           H2*        G   1   8.734 -17.052   3.737
    6   2HO*    G   1          2HO*        G   1   8.342 -19.112   3.701
    7    H1*    G   1           H1*        G   1  10.886 -18.245   5.043
    8    H8     G   1           H8         G   1  11.634 -14.683   4.031
    9    H1     G   1           H1         G   1   8.078 -15.253   9.351
   10   1H2     G   1          1H2         G   1   7.192 -17.323   9.415
   11   2H2     G   1          2H2         G   1   8.095 -18.622   8.665
   12   1H5*    C   2          1H5*        C   2   6.364 -15.378   1.060
   13   2H5*    C   2          2H5*        C   2   7.720 -15.773   2.136
   14    H4*    C   2           H4*        C   2   5.567 -17.659   2.534
   15    H3*    C   2           H3*        C   2   4.873 -14.717   2.609
   16    H2*    C   2           H2*        C   2   3.703 -15.009   4.622
   17   2HO*    C   2          2HO*        C   2   2.460 -16.730   4.539
   18    H1*    C   2           H1*        C   2   5.431 -16.888   5.743
   19   1H4     C   2          1H4         C   2   6.936 -11.360   8.445
   20   2H4     C   2          2H4         C   2   7.647 -10.770   6.960
   21    H5     C   2           H5         C   2   7.829 -12.183   4.978
   22    H6     C   2           H6         C   2   7.504 -14.496   4.168
   23   1H5*    C   3          1H5*        C   3  -0.027 -13.599   1.794
   24   2H5*    C   3          2H5*        C   3   1.525 -12.881   2.272
   25    H4*    C   3           H4*        C   3  -0.370 -14.332   4.145
   26    H3*    C   3           H3*        C   3   0.159 -11.392   3.650
   27    H2*    C   3           H2*        C   3  -0.089 -10.964   5.948
   28   2HO*    C   3          2HO*        C   3  -1.567 -11.985   6.998
   29    H1*    C   3           H1*        C   3   1.178 -13.285   6.819
   30   1H4     C   3          1H4         C   3   5.594  -8.720   7.207
   31   2H4     C   3          2H4         C   3   5.682  -8.594   5.464
   32    H5     C   3           H5         C   3   4.676 -10.368   4.081
   33    H6     C   3           H6         C   3   3.010 -12.139   4.014
   34   1H5*    C   4          1H5*        C   4  -4.063 -10.198   4.959
   35   2H5*    C   4          2H5*        C   4  -2.290 -10.221   4.910
   36    H4*    C   4           H4*        C   4  -3.876  -9.978   7.476
   37    H3*    C   4           H3*        C   4  -2.861  -7.800   5.613
   38    H2*    C   4           H2*        C   4  -2.163  -6.544   7.465
   39   2HO*    C   4          2HO*        C   4  -3.820  -8.243   9.031
   40    H1*    C   4           H1*        C   4  -1.386  -8.689   9.066
   41   1H4     C   4          1H4         C   4   3.644  -5.894   6.104
   42   2H4     C   4          2H4         C   4   4.126  -7.553   5.863
   43    H5     C   4           H5         C   4   1.801  -8.522   4.866
   44    H6     C   4           H6         C   4  -0.282  -9.235   5.714
   45   1H5*    U   5          1H5*        U   5  -4.884  -5.859   8.578
   46   2H5*    U   5          2H5*        U   5  -6.061  -4.703   7.918
   47    H4*    U   5           H4*        U   5  -4.681  -3.499   9.446
   48    H3*    U   5           H3*        U   5  -3.871  -2.967   6.570
   49    H2*    U   5           H2*        U   5  -2.265  -1.445   7.383
   50   2HO*    U   5          2HO*        U   5  -2.343  -0.665   9.542
   51    H1*    U   5           H1*        U   5  -1.731  -2.866   9.758
   52    H3     U   5           H3         U   5   2.143  -2.246   7.490
   53    H5     U   5           H5         U   5   0.288  -5.422   5.514
   54    H6     U   5           H6         U   5  -1.695  -4.926   6.763
   55   1H5*    G   6          1H5*        G   6  -1.973   0.385   8.020
   56   2H5*    G   6          2H5*        G   6  -3.253   1.617   8.102
   57    H4*    G   6           H4*        G   6  -2.092   2.808   6.598
   58    H3*    G   6           H3*        G   6  -2.766   0.431   4.839
   59    H2*    G   6           H2*        G   6  -1.251   1.199   3.214
   60   2HO*    G   6          2HO*        G   6  -0.723   3.256   2.949
   61    H1*    G   6           H1*        G   6   0.668   2.192   4.979
   62    H8     G   6           H8         G   6  -1.159  -1.217   5.214
   63    H1     G   6           H1         G   6   4.835  -1.402   2.895
   64   1H2     G   6          1H2         G   6   5.526   0.699   2.461
   65   2H2     G   6          2H2         G   6   4.842   1.996   3.424
   66   1H5*    A   7          1H5*        A   7  -4.589   2.051   0.580
   67   2H5*    A   7          2H5*        A   7  -3.696   0.522   0.685
   68    H4*    A   7           H4*        A   7  -2.793   1.837  -1.137
   69    H3*    A   7           H3*        A   7  -1.001   1.795   1.317
   70    H2*    A   7           H2*        A   7   0.568   3.090   0.103
   71   2HO*    A   7          2HO*        A   7   0.736   3.073  -2.040
   72    H1*    A   7           H1*        A   7  -1.337   4.513  -1.366
   73    H8     A   7           H8         A   7  -2.337   4.829   2.182
   74   1H6     A   7          1H6         A   7   1.422   7.959   3.804
   75   2H6     A   7          2H6         A   7   1.502   9.360   2.759
   76    H2     A   7           H2         A   7   2.769   7.013  -1.047
   77   1H5*    A   8          1H5*        A   8   0.918   0.468  -1.630
   78   2H5*    A   8          2H5*        A   8   2.146  -0.814  -1.735
   79    H4*    A   8           H4*        A   8   3.267   1.259  -2.142
   80    H3*    A   8           H3*        A   8   3.667   0.275   0.701
   81    H2*    A   8           H2*        A   8   5.095   2.124   1.103
   82   2HO*    A   8          2HO*        A   8   6.195   3.111  -0.426
   83    H1*    A   8           H1*        A   8   3.600   3.938  -0.430
   84    H8     A   8           H8         A   8   1.278   1.896   1.709
   85   1H6     A   8          1H6         A   8   1.423   4.618   5.750
   86   2H6     A   8          2H6         A   8   2.572   5.792   6.352
   87    H2     A   8           H2         A   8   5.407   6.657   2.985
   88   1H5*    A   9          2H5*        A   9   8.200  -1.678  -1.902
   89   2H5*    A   9          1H5*        A   9   7.260  -0.599  -0.851
   90    H4*    A   9           H4*        A   9   9.484   0.086  -2.426
   91    H3*    A   9           H3*        A   9   7.356   1.721  -1.021
   92    H2*    A   9           H2*        A   9   8.252   3.678  -2.004
   93   2HO*    A   9          2HO*        A   9  10.515   2.064  -2.526
   94    H1*    A   9           H1*        A   9   8.820   2.507  -4.475
   95    H8     A   9           H8         A   9   6.514   4.174  -2.228
   96   1H6     A   9          1H6         A   9   2.359   4.353  -6.718
   97   2H6     A   9          2H6         A   9   2.369   4.310  -4.969
   98    H2     A   9           H2         A   9   5.417   1.169  -7.792
   99   1H5*    A  10          1H5*        A  10   9.870   0.946   4.100
  100   2H5*    A  10          2H5*        A  10   8.215   1.295   3.561
  101    H4*    A  10           H4*        A  10  10.173   3.556   3.614
  102    H3*    A  10           H3*        A  10   8.988   2.204   6.038
  103    H2*    A  10           H2*        A  10   8.429   4.272   6.998
  104   2HO*    A  10          2HO*        A  10   9.229   6.250   5.937
  105    H1*    A  10           H1*        A  10   7.690   5.557   4.642
  106    H8     A  10           H8         A  10   6.050   2.483   3.983
  107   1H6     A  10          1H6         A  10   2.224   3.074   8.654
  108   2H6     A  10          2H6         A  10   1.986   3.080   6.921
  109    H2     A  10           H2         A  10   5.372   6.373   9.047
  110   1H5*    A  11          1H5*        A  11   9.618   5.139   8.477
  111   2H5*    A  11          2H5*        A  11  10.467   4.366   9.835
  112    H4*    A  11           H4*        A  11   8.090   4.982  10.347
  113    H3*    A  11           H3*        A  11   8.923   2.070  10.412
  114    H2*    A  11           H2*        A  11   6.727   1.454  10.997
  115   2HO*    A  11          2HO*        A  11   6.736   3.665  12.368
  116    H1*    A  11           H1*        A  11   5.410   3.350   9.458
  117    H8     A  11           H8         A  11   8.230   1.624   7.568
  118   1H6     A  11          1H6         A  11   4.393  -2.984   6.495
  119   2H6     A  11          2H6         A  11   5.253  -1.897   5.432
  120    H2     A  11           H2         A  11   2.226   0.009   9.176
  121   1H5*    G  12          1H5*        G  12   8.584  -0.657  13.810
  122   2H5*    G  12          2H5*        G  12   8.502   0.060  12.191
  123    H4*    G  12           H4*        G  12   6.267   0.913  13.848
  124    H3*    G  12           H3*        G  12   6.756  -2.053  13.510
  125    H2*    G  12           H2*        G  12   4.487  -2.380  12.947
  126   2HO*    G  12          2HO*        G  12   4.080   0.191  14.076
  127    H1*    G  12           H1*        G  12   4.167  -0.003  11.522
  128    H8     G  12           H8         G  12   7.215  -0.905   9.975
  129    H1     G  12           H1         G  12   2.668  -5.190   8.493
  130   1H2     G  12          1H2         G  12   0.912  -4.917   9.806
  131   2H2     G  12          2H2         G  12   1.060  -4.053  11.319
  132   1H5*    G  13          1H5*        G  13   5.662  -4.503  17.468
  133   2H5*    G  13          2H5*        G  13   6.536  -5.476  16.287
  134    H4*    G  13           H4*        G  13   3.673  -5.332  16.894
  135    H3*    G  13           H3*        G  13   5.545  -7.214  15.463
  136    H2*    G  13           H2*        G  13   3.765  -8.149  14.296
  137   2HO*    G  13          2HO*        G  13   2.222  -8.554  15.782
  138    H1*    G  13           H1*        G  13   2.290  -5.832  13.916
  139    H8     G  13           H8         G  13   5.610  -4.648  13.166
  140    H1     G  13           H1         G  13   3.614  -8.914   8.785
  141   1H2     G  13          1H2         G  13   1.652  -9.773   9.456
  142   2H2     G  13          2H2         G  13   1.364  -9.891  11.178
  143   1H5*    G  14          1H5*        G  14   0.973  -9.995  17.602
  144   2H5*    G  14          2H5*        G  14   2.401 -10.696  18.397
  145    H4*    G  14           H4*        G  14   0.897 -12.274  16.992
  146    H3*    G  14           H3*        G  14   3.886 -12.061  16.625
  147    H2*    G  14           H2*        G  14   3.786 -13.706  14.946
  148   2HO*    G  14          2HO*        G  14   1.107 -14.291  15.097
  149    H1*    G  14           H1*        G  14   1.378 -12.848  13.832
  150    H8     G  14           H8         G  14   3.661  -9.932  14.623
  151    H1     G  14           H1         G  14   5.075 -12.995   9.131
  152   1H2     G  14          1H2         G  14   4.164 -15.138   9.329
  153   2H2     G  14          2H2         G  14   2.507 -15.044   9.880
  154   1H5*    C  15          2H5*        C  15   4.614 -16.025  17.757
  155   2H5*    C  15          1H5*        C  15   4.226 -14.779  16.549
  156    H4*    C  15           H4*        C  15   3.745 -17.652  15.821
  157    H3*    C  15           H3*        C  15   6.477 -16.332  15.976
  158    H2*    C  15           H2*        C  15   7.056 -17.414  13.966
  159   2HO*    C  15          2HO*        C  15   5.335 -19.314  14.903
  160    H1*    C  15           H1*        C  15   4.472 -17.307  12.845
  161   1H4     C  15          1H4         C  15   7.892 -12.974   9.730
  162   2H4     C  15          2H4         C  15   8.130 -12.031  11.195
  163    H5     C  15           H5         C  15   6.675 -12.472  13.144
  164    H6     C  15           H6         C  15   5.417 -14.169  14.297
  165   2H    ASP   2          2H        ASP   2   9.609 -10.525  -1.595
  166   1H    ASP   2          1H        ASP   2   9.529 -12.217  -1.724
  167   3H    ASP   2          3H        ASP   2  10.958 -11.476  -1.188
  168    HA   ASP   2           HA       ASP   2   9.953 -12.284   0.772
  169   1HB   ASP   2          1HB       ASP   2   9.061  -9.407   0.464
  170   2HB   ASP   2          2HB       ASP   2   9.611 -10.207   1.933
  171    H    ALA   3           H        ALA   3   7.801 -11.176   2.136
  172    HA   ALA   3           HA       ALA   3   5.480 -12.377   0.675
  173   1HB   ALA   3          1HB       ALA   3   6.210 -13.334   2.846
  174   2HB   ALA   3          2HB       ALA   3   5.954 -11.767   3.610
  175   3HB   ALA   3          3HB       ALA   3   4.584 -12.662   2.950
  176    H    GLN   4           H        GLN   4   6.626  -9.470   2.280
  177    HA   GLN   4           HA       GLN   4   4.057  -8.114   2.266
  178   1HB   GLN   4          1HB       GLN   4   6.416  -7.806   3.558
  179   2HB   GLN   4          2HB       GLN   4   6.662  -6.645   2.257
  180   1HG   GLN   4          1HG       GLN   4   4.009  -6.333   3.342
  181   2HG   GLN   4          2HG       GLN   4   5.190  -6.265   4.640
  182   1HE2  GLN   4          2HE2      GLN   4   5.056  -5.051   1.236
  183   2HE2  GLN   4          1HE2      GLN   4   5.611  -3.494   1.622
  184    H    THR   5           H        THR   5   7.014  -7.783   0.288
  185    HA   THR   5           HA       THR   5   6.034  -5.899  -1.582
  186    HB   THR   5           HB       THR   5   7.847  -8.312  -1.962
  187    HG1  THR   5           HG1      THR   5   9.448  -6.607  -1.707
  188   1HG2  THR   5          1HG2      THR   5   7.243  -5.905  -3.665
  189   2HG2  THR   5          2HG2      THR   5   8.789  -6.746  -3.795
  190   3HG2  THR   5          3HG2      THR   5   7.285  -7.605  -4.134
  191    H    ARG   6           H        ARG   6   5.483  -9.345  -1.223
  192    HA   ARG   6           HA       ARG   6   4.091  -9.743  -3.742
  193   1HB   ARG   6          1HB       ARG   6   4.902 -11.210  -1.384
  194   2HB   ARG   6          2HB       ARG   6   3.217 -11.568  -1.766
  195   1HG   ARG   6          1HG       ARG   6   4.036 -13.042  -3.284
  196   2HG   ARG   6          2HG       ARG   6   4.419 -11.625  -4.261
  197   1HD   ARG   6          1HD       ARG   6   6.520 -12.611  -4.172
  198   2HD   ARG   6          2HD       ARG   6   6.605 -11.631  -2.695
  199    HE   ARG   6           HE       ARG   6   6.489 -13.627  -1.446
  200   1HH1  ARG   6          1HH1      ARG   6   5.270 -14.110  -4.660
  201   2HH1  ARG   6          2HH1      ARG   6   5.036 -15.812  -4.441
  202   1HH2  ARG   6          1HH2      ARG   6   6.180 -15.837  -1.173
  203   2HH2  ARG   6          2HH2      ARG   6   5.549 -16.784  -2.478
  204    H    ARG   7           H        ARG   7   3.110  -9.332  -0.335
  205    HA   ARG   7           HA       ARG   7   0.313  -9.461  -0.828
  206   1HB   ARG   7          1HB       ARG   7   1.295  -9.631   1.389
  207   2HB   ARG   7          2HB       ARG   7   1.964  -8.003   1.257
  208   1HG   ARG   7          1HG       ARG   7  -0.452  -7.192   0.950
  209   2HG   ARG   7          2HG       ARG   7  -0.951  -8.803   1.459
  210   1HD   ARG   7          1HD       ARG   7  -0.355  -8.432   3.637
  211   2HD   ARG   7          2HD       ARG   7   1.039  -7.434   3.201
  212    HE   ARG   7           HE       ARG   7  -0.396  -5.555   3.242
  213   1HH1  ARG   7          1HH1      ARG   7  -2.208  -8.489   2.961
  214   2HH1  ARG   7          2HH1      ARG   7  -3.733  -7.690   3.097
  215   1HH2  ARG   7          1HH2      ARG   7  -2.340  -4.522   3.418
  216   2HH2  ARG   7          2HH2      ARG   7  -3.809  -5.431   3.356
  217    H    ARG   8           H        ARG   8   2.650  -6.850  -1.115
  218    HA   ARG   8           HA       ARG   8   0.929  -4.599  -1.331
  219   1HB   ARG   8          1HB       ARG   8   3.629  -5.197  -1.557
  220   2HB   ARG   8          2HB       ARG   8   3.218  -4.772  -3.213
  221   1HG   ARG   8          1HG       ARG   8   3.994  -2.827  -1.815
  222   2HG   ARG   8          2HG       ARG   8   2.402  -2.607  -2.533
  223   1HD   ARG   8          1HD       ARG   8   2.807  -2.052   0.042
  224   2HD   ARG   8          2HD       ARG   8   1.302  -2.822  -0.479
  225    HE   ARG   8           HE       ARG   8   3.452  -4.720   0.137
  226   1HH1  ARG   8          1HH1      ARG   8   0.756  -2.891   1.330
  227   2HH1  ARG   8          2HH1      ARG   8   0.477  -3.953   2.661
  228   1HH2  ARG   8          1HH2      ARG   8   3.076  -6.084   1.864
  229   2HH2  ARG   8          2HH2      ARG   8   1.781  -5.750   2.964
  230    H    GLU   9           H        GLU   9   1.950  -6.977  -3.756
  231    HA   GLU   9           HA       GLU   9   0.601  -5.772  -5.979
  232   1HB   GLU   9          1HB       GLU   9   1.219  -8.672  -5.291
  233   2HB   GLU   9          2HB       GLU   9   0.729  -8.118  -6.891
  234   1HG   GLU   9          1HG       GLU   9   2.921  -6.504  -5.889
  235   2HG   GLU   9          2HG       GLU   9   3.351  -8.214  -5.866
  236    H    ARG  10           H        ARG  10  -0.380  -7.821  -3.327
  237    HA   ARG  10           HA       ARG  10  -3.097  -8.273  -4.267
  238   1HB   ARG  10          1HB       ARG  10  -1.355  -8.897  -1.987
  239   2HB   ARG  10          2HB       ARG  10  -3.013  -8.561  -1.499
  240   1HG   ARG  10          1HG       ARG  10  -3.425 -10.724  -2.042
  241   2HG   ARG  10          2HG       ARG  10  -3.356 -10.175  -3.718
  242   1HD   ARG  10          1HD       ARG  10  -0.680 -10.484  -3.113
  243   2HD   ARG  10          2HD       ARG  10  -1.429 -11.824  -2.222
  244    HE   ARG  10           HE       ARG  10  -2.724 -11.900  -4.654
  245   1HH1  ARG  10          1HH1      ARG  10   0.609 -11.832  -3.682
  246   2HH1  ARG  10          2HH1      ARG  10   1.150 -12.728  -5.061
  247   1HH2  ARG  10          1HH2      ARG  10  -2.008 -13.062  -6.441
  248   2HH2  ARG  10          2HH2      ARG  10  -0.323 -13.421  -6.614
  249    H    ARG  11           H        ARG  11  -1.340  -5.700  -2.806
  250    HA   ARG  11           HA       ARG  11  -3.788  -4.412  -1.734
  251   1HB   ARG  11          1HB       ARG  11  -0.838  -3.700  -1.738
  252   2HB   ARG  11          2HB       ARG  11  -2.096  -2.748  -0.952
  253   1HG   ARG  11          1HG       ARG  11  -1.339  -5.618  -0.299
  254   2HG   ARG  11          2HG       ARG  11  -1.040  -4.219   0.711
  255   1HD   ARG  11          1HD       ARG  11  -3.135  -4.349   1.585
  256   2HD   ARG  11          2HD       ARG  11  -3.859  -4.381  -0.026
  257    HE   ARG  11           HE       ARG  11  -2.524  -6.883   0.626
  258   1HH1  ARG  11          1HH1      ARG  11  -5.445  -5.033   0.960
  259   2HH1  ARG  11          2HH1      ARG  11  -6.444  -6.429   1.171
  260   1HH2  ARG  11          1HH2      ARG  11  -3.835  -8.689   0.902
  261   2HH2  ARG  11          2HH2      ARG  11  -5.540  -8.488   1.138
  262    H    ALA  12           H        ALA  12  -2.487  -4.720  -4.750
  263    HA   ALA  12           HA       ALA  12  -2.214  -2.060  -5.755
  264   1HB   ALA  12          1HB       ALA  12  -3.430  -4.563  -7.004
  265   2HB   ALA  12          2HB       ALA  12  -2.889  -3.149  -7.909
  266   3HB   ALA  12          3HB       ALA  12  -1.721  -4.129  -7.022
  267    H    GLU  13           H        GLU  13  -5.009  -3.918  -4.758
  268    HA   GLU  13           HA       GLU  13  -6.996  -2.147  -5.950
  269   1HB   GLU  13          1HB       GLU  13  -7.120  -4.206  -3.713
  270   2HB   GLU  13          2HB       GLU  13  -8.521  -3.501  -4.516
  271   1HG   GLU  13          1HG       GLU  13  -8.383  -5.160  -6.035
  272   2HG   GLU  13          2HG       GLU  13  -6.888  -4.420  -6.606
  273    H    LYS  14           H        LYS  14  -5.257  -2.441  -2.877
  274    HA   LYS  14           HA       LYS  14  -6.825  -0.346  -1.549
  275   1HB   LYS  14          1HB       LYS  14  -4.167  -1.718  -0.974
  276   2HB   LYS  14          2HB       LYS  14  -4.992  -0.637   0.151
  277   1HG   LYS  14          1HG       LYS  14  -6.429  -3.021  -0.992
  278   2HG   LYS  14          2HG       LYS  14  -5.360  -3.201   0.400
  279   1HD   LYS  14          1HD       LYS  14  -6.777  -1.042   1.201
  280   2HD   LYS  14          2HD       LYS  14  -7.993  -1.842   0.204
  281   1HE   LYS  14          1HE       LYS  14  -7.449  -3.990   1.483
  282   2HE   LYS  14          2HE       LYS  14  -6.543  -2.967   2.616
  283   1HZ   LYS  14          1HZ       LYS  14  -9.334  -2.395   1.789
  284   2HZ   LYS  14          2HZ       LYS  14  -8.951  -3.288   3.182
  285   3HZ   LYS  14          3HZ       LYS  14  -8.458  -1.668   3.046
  286    H    GLN  15           H        GLN  15  -3.824  -0.730  -3.283
  287    HA   GLN  15           HA       GLN  15  -2.747   1.915  -2.936
  288   1HB   GLN  15          1HB       GLN  15  -2.245  -0.609  -4.319
  289   2HB   GLN  15          2HB       GLN  15  -1.804   0.759  -5.325
  290   1HG   GLN  15          1HG       GLN  15  -0.168   1.493  -3.841
  291   2HG   GLN  15          2HG       GLN  15  -0.976   0.767  -2.452
  292   1HE2  GLN  15          2HE2      GLN  15  -1.089  -1.750  -2.567
  293   2HE2  GLN  15          1HE2      GLN  15   0.303  -2.543  -3.135
  294    H    ALA  16           H        ALA  16  -4.465   0.333  -5.640
  295    HA   ALA  16           HA       ALA  16  -4.606   2.709  -7.273
  296   1HB   ALA  16          1HB       ALA  16  -4.877   0.310  -8.005
  297   2HB   ALA  16          2HB       ALA  16  -6.444   0.285  -7.199
  298   3HB   ALA  16          3HB       ALA  16  -6.177   1.357  -8.573
  299    H    GLN  17           H        GLN  17  -6.565   1.490  -4.606
  300    HA   GLN  17           HA       GLN  17  -8.801   3.317  -5.141
  301   1HB   GLN  17          1HB       GLN  17  -7.923   1.380  -3.016
  302   2HB   GLN  17          2HB       GLN  17  -9.173   2.555  -2.611
  303   1HG   GLN  17          1HG       GLN  17  -9.486   1.087  -5.185
  304   2HG   GLN  17          2HG       GLN  17  -9.760   0.172  -3.703
  305   1HE2  GLN  17          1HE2      GLN  17 -11.844   0.965  -5.643
  306   2HE2  GLN  17          2HE2      GLN  17 -12.930   1.962  -4.803
  307    H    TRP  18           H        TRP  18  -5.901   3.186  -3.180
  308    HA   TRP  18           HA       TRP  18  -6.374   5.686  -1.752
  309   1HB   TRP  18          1HB       TRP  18  -4.959   3.897  -0.852
  310   2HB   TRP  18          2HB       TRP  18  -3.955   3.931  -2.288
  311    HD1  TRP  18           HD1      TRP  18  -4.504   5.756   0.980
  312    HE1  TRP  18           HE1      TRP  18  -2.720   7.613   1.201
  313    HE3  TRP  18           HE3      TRP  18  -2.466   5.554  -3.638
  314    HZ2  TRP  18           HZ2      TRP  18  -0.677   8.829  -0.396
  315    HZ3  TRP  18           HZ3      TRP  18  -0.624   7.030  -4.277
  316    HH2  TRP  18           HH2      TRP  18   0.287   8.641  -2.683
  317    H    LYS  19           H        LYS  19  -4.293   4.612  -4.398
  318    HA   LYS  19           HA       LYS  19  -3.059   7.086  -5.034
  319   1HB   LYS  19          1HB       LYS  19  -3.744   4.571  -6.571
  320   2HB   LYS  19          2HB       LYS  19  -2.889   5.908  -7.326
  321   1HG   LYS  19          1HG       LYS  19  -1.258   5.758  -5.344
  322   2HG   LYS  19          2HG       LYS  19  -1.973   4.177  -5.043
  323   1HD   LYS  19          1HD       LYS  19  -1.490   4.191  -7.793
  324   2HD   LYS  19          2HD       LYS  19  -0.074   4.985  -7.105
  325   1HE   LYS  19          1HE       LYS  19   0.634   3.080  -6.024
  326   2HE   LYS  19          2HE       LYS  19  -1.022   2.517  -5.722
  327   1HZ   LYS  19          1HZ       LYS  19  -1.263   2.076  -8.093
  328   2HZ   LYS  19          2HZ       LYS  19   0.340   2.575  -8.364
  329   3HZ   LYS  19          3HZ       LYS  19   0.025   1.182  -7.445
  330    H    ALA  20           H        ALA  20  -6.137   5.637  -5.946
  331    HA   ALA  20           HA       ALA  20  -6.839   7.480  -7.993
  332   1HB   ALA  20          1HB       ALA  20  -8.343   5.754  -6.043
  333   2HB   ALA  20          2HB       ALA  20  -9.199   6.760  -7.210
  334   3HB   ALA  20          3HB       ALA  20  -8.105   5.495  -7.771
  335    H    ALA  21           H        ALA  21  -6.946   7.657  -4.489
  336    HA   ALA  21           HA       ALA  21  -8.100  10.407  -4.706
  337   1HB   ALA  21          1HB       ALA  21  -8.303   8.334  -2.505
  338   2HB   ALA  21          2HB       ALA  21  -9.011   9.947  -2.431
  339   3HB   ALA  21          3HB       ALA  21  -9.591   8.782  -3.622
  340    H    ASN  22           H        ASN  22  -5.291   9.528  -4.811
  341    HA   ASN  22           HA       ASN  22  -4.264  11.409  -2.784
  342   1HB   ASN  22          1HB       ASN  22  -3.529   8.477  -2.893
  343   2HB   ASN  22          2HB       ASN  22  -2.584   9.686  -2.024
  344   1HD2  ASN  22          2HD2      ASN  22  -4.946   7.443  -1.527
  345   2HD2  ASN  22          1HD2      ASN  22  -5.739   8.134  -0.196
  346    HA   PRO  23           HA       PRO  23  -1.926  11.026  -6.867
  347   1HB   PRO  23          1HB       PRO  23  -2.864  13.318  -8.049
  348   2HB   PRO  23          2HB       PRO  23  -3.616  11.730  -8.305
  349   1HG   PRO  23          1HG       PRO  23  -4.457  13.957  -6.523
  350   2HG   PRO  23          2HG       PRO  23  -5.444  12.846  -7.490
  351   1HD   PRO  23          1HD       PRO  23  -5.071  12.582  -4.800
  352   2HD   PRO  23          2HD       PRO  23  -5.414  11.213  -5.872
  353    H    LEU  24           H        LEU  24  -2.877  13.414  -4.545
  354    HA   LEU  24           HA       LEU  24  -0.843  15.384  -4.873
  355   1HB   LEU  24          1HB       LEU  24  -1.735  16.192  -2.866
  356   2HB   LEU  24          2HB       LEU  24  -3.043  15.130  -3.368
  357    HG   LEU  24           HG       LEU  24  -0.805  14.172  -1.558
  358   1HD1  LEU  24          1HD1      LEU  24  -2.308  16.215  -0.779
  359   2HD1  LEU  24          2HD1      LEU  24  -3.485  14.937  -0.481
  360   3HD1  LEU  24          3HD1      LEU  24  -1.918  14.899   0.328
  361   1HD2  LEU  24          1HD2      LEU  24  -2.806  12.787  -2.882
  362   2HD2  LEU  24          2HD2      LEU  24  -1.991  12.222  -1.426
  363   3HD2  LEU  24          3HD2      LEU  24  -3.531  13.074  -1.305
  364    H    LEU  25           H        LEU  25  -0.934  12.287  -3.237
  365    HA   LEU  25           HA       LEU  25   1.908  12.523  -2.377
  366   1HB   LEU  25          1HB       LEU  25  -0.542  10.948  -1.673
  367   2HB   LEU  25          2HB       LEU  25   1.013  10.139  -1.453
  368    HG   LEU  25           HG       LEU  25   0.737  12.930  -0.418
  369   1HD1  LEU  25          1HD1      LEU  25  -1.295  11.371   0.240
  370   2HD1  LEU  25          2HD1      LEU  25  -0.113  10.643   1.327
  371   3HD1  LEU  25          3HD1      LEU  25  -0.500  12.358   1.467
  372   1HD2  LEU  25          1HD2      LEU  25   2.737  11.087  -0.387
  373   2HD2  LEU  25          2HD2      LEU  25   2.555  12.340   0.840
  374   3HD2  LEU  25          3HD2      LEU  25   1.945  10.714   1.144
  375    H    VAL  26           H        VAL  26   1.086  12.404  -5.090
  376    HA   VAL  26           HA       VAL  26   2.450   9.948  -6.025
  377    HB   VAL  26           HB       VAL  26  -0.432  10.614  -6.012
  378   1HG1  VAL  26          1HG1      VAL  26   0.967   9.842  -8.569
  379   2HG1  VAL  26          2HG1      VAL  26  -0.715   9.404  -8.270
  380   3HG1  VAL  26          3HG1      VAL  26  -0.238  11.104  -8.306
  381   1HG2  VAL  26          1HG2      VAL  26   1.298   8.155  -6.257
  382   2HG2  VAL  26          2HG2      VAL  26   0.181   8.601  -4.965
  383   3HG2  VAL  26          3HG2      VAL  26  -0.442   8.066  -6.527
  384    H    GLY  27           H        GLY  27   3.008  10.236  -8.396
  385   1HA   GLY  27          1HA       GLY  27   3.736  12.990  -8.991
  386   2HA   GLY  27          2HA       GLY  27   3.988  11.607 -10.057
  387    H    VAL  28           H        VAL  28   1.116  13.245  -8.681
  388    HA   VAL  28           HA       VAL  28  -0.888  13.929  -9.690
  389    HB   VAL  28           HB       VAL  28   1.090  14.311 -11.952
  390   1HG1  VAL  28          1HG1      VAL  28  -1.703  14.289 -12.138
  391   2HG1  VAL  28          2HG1      VAL  28  -1.303  16.000 -11.940
  392   3HG1  VAL  28          3HG1      VAL  28  -0.593  15.079 -13.266
  393   1HG2  VAL  28          1HG2      VAL  28   0.099  15.965  -9.645
  394   2HG2  VAL  28          2HG2      VAL  28   1.747  15.767 -10.242
  395   3HG2  VAL  28          3HG2      VAL  28   0.600  16.768 -11.133
  396    H    SER  29           H        SER  29  -2.581  12.857 -10.552
  397    HA   SER  29           HA       SER  29  -3.684  10.937 -11.371
  398   1HB   SER  29          1HB       SER  29  -2.603  12.692 -13.309
  399   2HB   SER  29          2HB       SER  29  -2.428  11.064 -13.958
  400    HG   SER  29           HG       SER  29  -4.816  12.119 -12.838
  401    H    ALA  30           H        ALA  30  -1.227  10.257 -10.045
  402    HA   ALA  30           HA       ALA  30   0.504   8.612  -9.983
  403   1HB   ALA  30          1HB       ALA  30  -2.203   7.560 -10.401
  404   2HB   ALA  30          2HB       ALA  30  -0.935   6.402 -10.807
  405   3HB   ALA  30          3HB       ALA  30  -0.997   7.114  -9.193
  406    H    LYS  31           H        LYS  31   1.442   9.796 -12.028
  407    HA   LYS  31           HA       LYS  31   1.433   7.911 -14.361
  408   1HB   LYS  31          1HB       LYS  31   2.090  10.875 -14.271
  409   2HB   LYS  31          2HB       LYS  31   1.852   9.889 -15.714
  410   1HG   LYS  31          1HG       LYS  31  -0.502   9.481 -15.015
  411   2HG   LYS  31          2HG       LYS  31  -0.253  10.541 -13.627
  412   1HD   LYS  31          1HD       LYS  31  -1.303  11.821 -15.413
  413   2HD   LYS  31          2HD       LYS  31   0.354  12.387 -15.202
  414   1HE   LYS  31          1HE       LYS  31   1.097  11.342 -17.180
  415   2HE   LYS  31          2HE       LYS  31  -0.286  10.231 -17.221
  416   1HZ   LYS  31          1HZ       LYS  31  -1.747  12.170 -17.491
  417   2HZ   LYS  31          2HZ       LYS  31  -0.388  13.182 -17.568
  418   3HZ   LYS  31          3HZ       LYS  31  -0.651  12.020 -18.781
  419    HA   PRO  32           HA       PRO  32   5.709   7.398 -13.280
  420   1HB   PRO  32          1HB       PRO  32   6.504   6.014 -15.502
  421   2HB   PRO  32          2HB       PRO  32   5.556   5.277 -14.196
  422   1HG   PRO  32          1HG       PRO  32   4.675   6.235 -16.863
  423   2HG   PRO  32          2HG       PRO  32   4.111   4.852 -15.915
  424   1HD   PRO  32          1HD       PRO  32   2.780   7.253 -16.121
  425   2HD   PRO  32          2HD       PRO  32   2.578   6.099 -14.786
  426    H    VAL  33           H        VAL  33   7.917   7.744 -14.566
  427    HA   VAL  33           HA       VAL  33   7.641   9.953 -16.556
  428    HB   VAL  33           HB       VAL  33   9.289  11.258 -15.230
  429   1HG1  VAL  33          1HG1      VAL  33   6.640  11.109 -14.826
  430   2HG1  VAL  33          2HG1      VAL  33   7.183  10.565 -13.238
  431   3HG1  VAL  33          3HG1      VAL  33   7.679  12.144 -13.847
  432   1HG2  VAL  33          1HG2      VAL  33   8.982   8.926 -13.317
  433   2HG2  VAL  33          2HG2      VAL  33  10.466   9.470 -14.100
  434   3HG2  VAL  33          3HG2      VAL  33   9.702  10.471 -12.865
  435    H    ASN  34           H        ASN  34   9.800   7.649 -14.922
  436    HA   ASN  34           HA       ASN  34  11.763   6.569 -15.680
  437   1HB   ASN  34          1HB       ASN  34   9.914   6.916 -17.998
  438   2HB   ASN  34          2HB       ASN  34  11.557   6.384 -18.358
  439   1HD2  ASN  34          2HD2      ASN  34   9.075   5.624 -15.834
  440   2HD2  ASN  34          1HD2      ASN  34   9.289   3.943 -15.929
  441    H    ARG  35           H        ARG  35  12.329   9.165 -15.082
  442    HA   ARG  35           HA       ARG  35  14.546   9.793 -16.853
  443   1HB   ARG  35          1HB       ARG  35  12.359  10.541 -18.021
  444   2HB   ARG  35          2HB       ARG  35  12.294  11.806 -16.794
  445   1HG   ARG  35          1HG       ARG  35  14.959  11.676 -17.884
  446   2HG   ARG  35          2HG       ARG  35  13.795  11.812 -19.202
  447   1HD   ARG  35          1HD       ARG  35  12.812  13.627 -17.353
  448   2HD   ARG  35          2HD       ARG  35  14.569  13.818 -17.203
  449    HE   ARG  35           HE       ARG  35  14.101  13.654 -19.950
  450   1HH1  ARG  35          1HH1      ARG  35  13.045  15.655 -17.320
  451   2HH1  ARG  35          2HH1      ARG  35  12.827  17.053 -18.316
  452   1HH2  ARG  35          1HH2      ARG  35  13.815  15.476 -21.237
  453   2HH2  ARG  35          2HH2      ARG  35  13.260  16.953 -20.523
  454    HA   PRO  36           HA       PRO  36  14.995  11.403 -12.600
  455   1HB   PRO  36          1HB       PRO  36  17.700  11.002 -12.475
  456   2HB   PRO  36          2HB       PRO  36  16.517   9.724 -12.131
  457   1HG   PRO  36          1HG       PRO  36  18.107  10.217 -14.597
  458   2HG   PRO  36          2HG       PRO  36  17.678   8.687 -13.817
  459   1HD   PRO  36          1HD       PRO  36  16.407   9.659 -16.025
  460   2HD   PRO  36          2HD       PRO  36  15.632   8.591 -14.835
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  12.030 -13.949   2.108
    2   2H5*    G   1          2H5*        G   1  13.029 -15.221   1.366
    3    H4*    G   1           H4*        G   1  11.427 -16.901   1.831
    4    H3*    G   1           H3*        G   1   9.495 -14.614   2.324
    5    H2*    G   1           H2*        G   1   8.401 -15.879   3.993
    6   2HO*    G   1          2HO*        G   1   9.265 -18.214   4.162
    7    H1*    G   1           H1*        G   1  10.670 -17.118   5.012
    8    H8     G   1           H8         G   1  11.349 -13.467   4.437
    9    H1     G   1           H1         G   1   7.784 -14.642   9.650
   10   1H2     G   1          1H2         G   1   7.233 -16.780   9.722
   11   2H2     G   1          2H2         G   1   7.495 -17.841   8.357
   12   1H5*    C   2          1H5*        C   2   6.580 -18.341   2.442
   13   2H5*    C   2          2H5*        C   2   5.753 -17.814   0.957
   14    H4*    C   2           H4*        C   2   4.094 -18.274   2.672
   15    H3*    C   2           H3*        C   2   4.535 -15.320   2.118
   16    H2*    C   2           H2*        C   2   2.891 -14.792   3.720
   17   2HO*    C   2          2HO*        C   2   1.238 -16.145   3.199
   18    H1*    C   2           H1*        C   2   3.513 -16.853   5.507
   19   1H4     C   2          1H4         C   2   6.200 -11.766   8.135
   20   2H4     C   2          2H4         C   2   7.347 -11.618   6.827
   21    H5     C   2           H5         C   2   7.376 -13.152   4.941
   22    H6     C   2           H6         C   2   6.245 -15.004   3.866
   23   1H5*    C   3          1H5*        C   3  -0.300 -13.519   1.536
   24   2H5*    C   3          2H5*        C   3   1.320 -12.978   2.028
   25    H4*    C   3           H4*        C   3  -0.643 -14.368   3.876
   26    H3*    C   3           H3*        C   3  -0.047 -11.435   3.425
   27    H2*    C   3           H2*        C   3  -0.195 -11.028   5.729
   28   2HO*    C   3          2HO*        C   3  -0.929 -13.544   6.547
   29    H1*    C   3           H1*        C   3   1.004 -13.405   6.546
   30   1H4     C   3          1H4         C   3   5.736  -9.168   6.814
   31   2H4     C   3          2H4         C   3   5.550  -8.767   5.122
   32    H5     C   3           H5         C   3   4.534 -10.599   3.729
   33    H6     C   3           H6         C   3   2.841 -12.355   3.724
   34   1H5*    C   4          1H5*        C   4  -3.991 -10.046   4.740
   35   2H5*    C   4          2H5*        C   4  -2.226 -10.212   4.793
   36    H4*    C   4           H4*        C   4  -3.915  -9.787   7.265
   37    H3*    C   4           H3*        C   4  -2.640  -7.755   5.408
   38    H2*    C   4           H2*        C   4  -1.977  -6.471   7.236
   39   2HO*    C   4          2HO*        C   4  -3.223  -7.968   9.203
   40    H1*    C   4           H1*        C   4  -1.375  -8.606   8.921
   41   1H4     C   4          1H4         C   4   3.826  -6.141   5.947
   42   2H4     C   4          2H4         C   4   4.243  -7.825   5.772
   43    H5     C   4           H5         C   4   1.872  -8.684   4.734
   44    H6     C   4           H6         C   4  -0.265  -9.278   5.574
   45   1H5*    U   5          1H5*        U   5  -5.065  -4.536   6.451
   46   2H5*    U   5          2H5*        U   5  -3.671  -5.612   6.563
   47    H4*    U   5           H4*        U   5  -4.205  -3.863   8.922
   48    H3*    U   5           H3*        U   5  -3.122  -2.851   6.260
   49    H2*    U   5           H2*        U   5  -1.546  -1.580   7.447
   50   2HO*    U   5          2HO*        U   5  -3.300  -0.887   9.003
   51    H1*    U   5           H1*        U   5  -1.221  -3.422   9.550
   52    H3     U   5           H3         U   5   2.708  -2.459   7.387
   53    H5     U   5           H5         U   5   0.978  -5.630   5.264
   54    H6     U   5           H6         U   5  -1.068  -5.159   6.433
   55   1H5*    G   6          1H5*        G   6  -2.467  -0.152   7.451
   56   2H5*    G   6          2H5*        G   6  -2.958   1.317   8.305
   57    H4*    G   6           H4*        G   6  -2.184   2.701   6.633
   58    H3*    G   6           H3*        G   6  -2.756   0.412   4.726
   59    H2*    G   6           H2*        G   6  -1.115   1.205   3.273
   60   2HO*    G   6          2HO*        G   6  -0.893   3.269   2.967
   61    H1*    G   6           H1*        G   6   0.656   2.138   5.230
   62    H8     G   6           H8         G   6  -1.093  -1.302   5.256
   63    H1     G   6           H1         G   6   4.922  -1.277   2.987
   64   1H2     G   6          1H2         G   6   5.580   0.834   2.640
   65   2H2     G   6          2H2         G   6   4.832   2.111   3.583
   66   1H5*    A   7          1H5*        A   7  -4.577   1.820   0.559
   67   2H5*    A   7          2H5*        A   7  -3.652   0.306   0.626
   68    H4*    A   7           H4*        A   7  -2.773   1.664  -1.165
   69    H3*    A   7           H3*        A   7  -0.991   1.661   1.294
   70    H2*    A   7           H2*        A   7   0.547   3.006   0.092
   71   2HO*    A   7          2HO*        A   7  -0.393   3.183  -2.346
   72    H1*    A   7           H1*        A   7  -1.396   4.377  -1.374
   73    H8     A   7           H8         A   7  -2.399   4.665   2.179
   74   1H6     A   7          1H6         A   7   2.047   8.918   2.925
   75   2H6     A   7          2H6         A   7   0.541   8.299   3.566
   76    H2     A   7           H2         A   7   2.613   6.989  -1.090
   77   1H5*    A   8          1H5*        A   8   0.975   0.444  -1.636
   78   2H5*    A   8          2H5*        A   8   2.241  -0.799  -1.765
   79    H4*    A   8           H4*        A   8   3.293   1.325  -2.125
   80    H3*    A   8           H3*        A   8   3.725   0.278   0.693
   81    H2*    A   8           H2*        A   8   5.128   2.142   1.133
   82   2HO*    A   8          2HO*        A   8   5.595   3.606  -0.700
   83    H1*    A   8           H1*        A   8   3.552   3.963  -0.303
   84    H8     A   8           H8         A   8   1.223   1.848   1.676
   85   1H6     A   8          1H6         A   8   2.235   5.574   6.422
   86   2H6     A   8          2H6         A   8   1.865   3.881   6.180
   87    H2     A   8           H2         A   8   5.553   6.280   3.392
   88   1H5*    A   9          2H5*        A   9   8.299  -1.508  -1.971
   89   2H5*    A   9          1H5*        A   9   7.322  -0.501  -0.884
   90    H4*    A   9           H4*        A   9   9.520   0.324  -2.415
   91    H3*    A   9           H3*        A   9   7.303   1.837  -1.009
   92    H2*    A   9           H2*        A   9   8.159   3.850  -1.914
   93   2HO*    A   9          2HO*        A   9  10.255   3.969  -1.872
   94    H1*    A   9           H1*        A   9   8.799   2.764  -4.407
   95    H8     A   9           H8         A   9   6.418   4.297  -2.147
   96   1H6     A   9          1H6         A   9   2.656   5.018  -5.266
   97   2H6     A   9          2H6         A   9   1.944   3.831  -6.336
   98    H2     A   9           H2         A   9   5.461   1.399  -7.793
   99   1H5*    A  10          1H5*        A  10   9.846   0.634   4.103
  100   2H5*    A  10          2H5*        A  10   8.253   1.160   3.529
  101    H4*    A  10           H4*        A  10  10.398   3.227   3.614
  102    H3*    A  10           H3*        A  10   9.189   1.920   6.049
  103    H2*    A  10           H2*        A  10   8.830   4.004   7.071
  104   2HO*    A  10          2HO*        A  10  10.817   4.869   5.286
  105    H1*    A  10           H1*        A  10   8.118   5.398   4.769
  106    H8     A  10           H8         A  10   6.174   2.556   4.032
  107   1H6     A  10          1H6         A  10   2.706   2.591   7.557
  108   2H6     A  10          2H6         A  10   2.224   3.950   8.549
  109    H2     A  10           H2         A  10   6.094   6.146   9.356
  110   1H5*    A  11          1H5*        A  11  10.644   4.598   9.325
  111   2H5*    A  11          2H5*        A  11  11.088   3.106  10.183
  112    H4*    A  11           H4*        A  11   8.810   4.474  10.680
  113    H3*    A  11           H3*        A  11   9.309   1.491  10.765
  114    H2*    A  11           H2*        A  11   7.027   1.105  11.206
  115   2HO*    A  11          2HO*        A  11   6.718   3.887  11.669
  116    H1*    A  11           H1*        A  11   6.016   3.110   9.584
  117    H8     A  11           H8         A  11   8.782   1.363   7.752
  118   1H6     A  11          1H6         A  11   5.046  -3.183   6.458
  119   2H6     A  11          2H6         A  11   5.662  -1.985   5.344
  120    H2     A  11           H2         A  11   2.746  -0.293   9.219
  121   1H5*    G  12          1H5*        G  12   9.037  -1.450  13.744
  122   2H5*    G  12          2H5*        G  12   8.991  -0.613  12.184
  123    H4*    G  12           H4*        G  12   6.834   0.281  13.913
  124    H3*    G  12           H3*        G  12   7.094  -2.681  13.422
  125    H2*    G  12           H2*        G  12   4.806  -2.797  12.840
  126   2HO*    G  12          2HO*        G  12   4.648  -0.415  14.309
  127    H1*    G  12           H1*        G  12   4.687  -0.338  11.514
  128    H8     G  12           H8         G  12   7.655  -1.388   9.934
  129    H1     G  12           H1         G  12   2.899  -5.419   8.392
  130   1H2     G  12          1H2         G  12   1.142  -5.038   9.687
  131   2H2     G  12          2H2         G  12   1.357  -4.264  11.241
  132   1H5*    G  13          1H5*        G  13   6.742  -5.510  16.751
  133   2H5*    G  13          2H5*        G  13   6.613  -4.724  15.168
  134    H4*    G  13           H4*        G  13   4.109  -5.557  16.603
  135    H3*    G  13           H3*        G  13   6.049  -7.374  15.149
  136    H2*    G  13           H2*        G  13   4.291  -8.441  14.045
  137   2HO*    G  13          2HO*        G  13   2.305  -8.610  14.787
  138    H1*    G  13           H1*        G  13   2.702  -6.194  13.689
  139    H8     G  13           H8         G  13   6.063  -5.048  12.761
  140    H1     G  13           H1         G  13   3.643  -9.211   8.506
  141   1H2     G  13          1H2         G  13   1.756 -10.056   9.274
  142   2H2     G  13          2H2         G  13   1.387  -9.990  10.982
  143   1H5*    G  14          1H5*        G  14   1.011  -9.318  17.112
  144   2H5*    G  14          2H5*        G  14   1.806 -10.255  18.397
  145    H4*    G  14           H4*        G  14   0.609 -11.792  16.936
  146    H3*    G  14           H3*        G  14   3.606 -11.850  16.489
  147    H2*    G  14           H2*        G  14   3.246 -13.628  14.955
  148   2HO*    G  14          2HO*        G  14   0.902 -13.936  16.399
  149    H1*    G  14           H1*        G  14   0.929 -12.537  13.843
  150    H8     G  14           H8         G  14   3.708 -10.034  14.509
  151    H1     G  14           H1         G  14   4.302 -13.206   8.953
  152   1H2     G  14          1H2         G  14   2.976 -15.028   9.024
  153   2H2     G  14          2H2         G  14   1.485 -14.893   9.929
  154   1H5*    C  15          1H5*        C  15   2.392 -15.522  16.640
  155   2H5*    C  15          2H5*        C  15   3.234 -16.586  17.792
  156    H4*    C  15           H4*        C  15   3.300 -17.735  15.708
  157    H3*    C  15           H3*        C  15   5.905 -16.278  16.237
  158    H2*    C  15           H2*        C  15   6.750 -17.176  14.226
  159   2HO*    C  15          2HO*        C  15   5.499 -19.320  14.910
  160    H1*    C  15           H1*        C  15   4.284 -17.142  12.859
  161   1H4     C  15          1H4         C  15   7.615 -12.409  10.302
  162   2H4     C  15          2H4         C  15   7.766 -11.594  11.849
  163    H5     C  15           H5         C  15   6.327 -12.274  13.730
  164    H6     C  15           H6         C  15   5.066 -14.105  14.677
  165   2H    ASP   2          2H        ASP   2   9.842  -9.074  -0.127
  166   1H    ASP   2          1H        ASP   2   9.619 -10.016  -1.523
  167   3H    ASP   2          3H        ASP   2  11.103 -10.054  -0.699
  168    HA   ASP   2           HA       ASP   2  10.028 -12.035  -0.052
  169   1HB   ASP   2          1HB       ASP   2   9.421  -9.927   2.038
  170   2HB   ASP   2          2HB       ASP   2   9.805 -11.621   2.323
  171    H    ALA   3           H        ALA   3   7.977 -12.257   1.827
  172    HA   ALA   3           HA       ALA   3   5.641 -12.513   0.198
  173   1HB   ALA   3          1HB       ALA   3   6.229 -13.753   2.306
  174   2HB   ALA   3          2HB       ALA   3   5.865 -12.286   3.215
  175   3HB   ALA   3          3HB       ALA   3   4.588 -13.105   2.316
  176    H    GLN   4           H        GLN   4   6.860  -9.863   2.151
  177    HA   GLN   4           HA       GLN   4   4.361  -8.391   2.271
  178   1HB   GLN   4          1HB       GLN   4   6.434  -8.226   3.778
  179   2HB   GLN   4          2HB       GLN   4   7.208  -7.353   2.460
  180   1HG   GLN   4          1HG       GLN   4   4.557  -6.292   3.072
  181   2HG   GLN   4          2HG       GLN   4   5.634  -6.228   4.461
  182   1HE2  GLN   4          2HE2      GLN   4   4.669  -4.348   1.944
  183   2HE2  GLN   4          1HE2      GLN   4   6.085  -3.451   1.679
  184    H    THR   5           H        THR   5   7.361  -7.824   0.409
  185    HA   THR   5           HA       THR   5   6.358  -5.826  -1.338
  186    HB   THR   5           HB       THR   5   8.327  -8.110  -1.736
  187    HG1  THR   5           HG1      THR   5   9.693  -6.774  -0.862
  188   1HG2  THR   5          1HG2      THR   5   7.233  -6.240  -3.661
  189   2HG2  THR   5          2HG2      THR   5   8.969  -5.993  -3.469
  190   3HG2  THR   5          3HG2      THR   5   8.350  -7.580  -3.922
  191    H    ARG   6           H        ARG   6   5.929  -9.298  -1.239
  192    HA   ARG   6           HA       ARG   6   4.633  -9.604  -3.819
  193   1HB   ARG   6          1HB       ARG   6   5.375 -11.164  -1.480
  194   2HB   ARG   6          2HB       ARG   6   3.737 -11.567  -2.010
  195   1HG   ARG   6          1HG       ARG   6   4.452 -12.346  -4.082
  196   2HG   ARG   6          2HG       ARG   6   5.897 -11.335  -4.082
  197   1HD   ARG   6          1HD       ARG   6   6.565 -13.661  -3.742
  198   2HD   ARG   6          2HD       ARG   6   6.814 -12.783  -2.220
  199    HE   ARG   6           HE       ARG   6   4.280 -13.622  -1.860
  200   1HH1  ARG   6          1HH1      ARG   6   7.044 -15.308  -3.128
  201   2HH1  ARG   6          2HH1      ARG   6   6.490 -16.854  -2.588
  202   1HH2  ARG   6          1HH2      ARG   6   3.579 -15.638  -1.167
  203   2HH2  ARG   6          2HH2      ARG   6   4.542 -17.042  -1.484
  204    H    ARG   7           H        ARG   7   3.534  -9.361  -0.428
  205    HA   ARG   7           HA       ARG   7   0.760  -9.557  -0.971
  206   1HB   ARG   7          1HB       ARG   7   1.624  -9.727   1.269
  207   2HB   ARG   7          2HB       ARG   7   2.374  -8.137   1.164
  208   1HG   ARG   7          1HG       ARG   7  -0.017  -7.224   0.814
  209   2HG   ARG   7          2HG       ARG   7  -0.566  -8.803   1.374
  210   1HD   ARG   7          1HD       ARG   7   0.229  -8.462   3.527
  211   2HD   ARG   7          2HD       ARG   7   1.479  -7.329   3.002
  212    HE   ARG   7           HE       ARG   7  -0.132  -5.593   3.096
  213   1HH1  ARG   7          1HH1      ARG   7  -1.628  -8.731   3.084
  214   2HH1  ARG   7          2HH1      ARG   7  -3.216  -8.104   3.361
  215   1HH2  ARG   7          1HH2      ARG   7  -2.207  -4.795   3.459
  216   2HH2  ARG   7          2HH2      ARG   7  -3.543  -5.891   3.572
  217    H    ARG   8           H        ARG   8   2.997  -6.850  -1.164
  218    HA   ARG   8           HA       ARG   8   1.209  -4.659  -1.386
  219   1HB   ARG   8          1HB       ARG   8   3.924  -5.148  -1.550
  220   2HB   ARG   8          2HB       ARG   8   3.549  -4.733  -3.215
  221   1HG   ARG   8          1HG       ARG   8   4.210  -2.765  -1.799
  222   2HG   ARG   8          2HG       ARG   8   2.630  -2.600  -2.556
  223   1HD   ARG   8          1HD       ARG   8   2.952  -2.033   0.024
  224   2HD   ARG   8          2HD       ARG   8   1.487  -2.856  -0.529
  225    HE   ARG   8           HE       ARG   8   3.647  -4.711   0.109
  226   1HH1  ARG   8          1HH1      ARG   8   1.013  -2.838   1.362
  227   2HH1  ARG   8          2HH1      ARG   8   0.777  -3.867   2.728
  228   1HH2  ARG   8          1HH2      ARG   8   3.330  -6.034   1.882
  229   2HH2  ARG   8          2HH2      ARG   8   2.081  -5.664   3.021
  230    H    GLU   9           H        GLU   9   2.337  -6.967  -3.827
  231    HA   GLU   9           HA       GLU   9   0.975  -5.763  -6.049
  232   1HB   GLU   9          1HB       GLU   9   1.629  -8.677  -5.456
  233   2HB   GLU   9          2HB       GLU   9   1.266  -8.020  -7.053
  234   1HG   GLU   9          1HG       GLU   9   3.282  -6.349  -6.124
  235   2HG   GLU   9          2HG       GLU   9   3.770  -7.938  -5.534
  236    H    ARG  10           H        ARG  10   0.039  -7.879  -3.440
  237    HA   ARG  10           HA       ARG  10  -2.648  -8.412  -4.434
  238   1HB   ARG  10          1HB       ARG  10  -0.899  -9.094  -2.195
  239   2HB   ARG  10          2HB       ARG  10  -2.541  -8.754  -1.653
  240   1HG   ARG  10          1HG       ARG  10  -3.368 -10.640  -2.605
  241   2HG   ARG  10          2HG       ARG  10  -2.425 -10.413  -4.078
  242   1HD   ARG  10          1HD       ARG  10  -0.400 -11.254  -2.893
  243   2HD   ARG  10          2HD       ARG  10  -1.395 -11.554  -1.455
  244    HE   ARG  10           HE       ARG  10  -2.780 -12.802  -3.520
  245   1HH1  ARG  10          1HH1      ARG  10   0.428 -12.956  -2.203
  246   2HH1  ARG  10          2HH1      ARG  10   0.644 -14.622  -2.616
  247   1HH2  ARG  10          1HH2      ARG  10  -2.488 -14.969  -4.053
  248   2HH2  ARG  10          2HH2      ARG  10  -0.997 -15.757  -3.658
  249    H    ARG  11           H        ARG  11  -1.002  -5.805  -2.897
  250    HA   ARG  11           HA       ARG  11  -3.501  -4.654  -1.788
  251   1HB   ARG  11          1HB       ARG  11  -0.594  -3.782  -1.810
  252   2HB   ARG  11          2HB       ARG  11  -1.895  -2.913  -0.999
  253   1HG   ARG  11          1HG       ARG  11  -1.010  -5.755  -0.400
  254   2HG   ARG  11          2HG       ARG  11  -0.704  -4.355   0.612
  255   1HD   ARG  11          1HD       ARG  11  -2.758  -4.529   1.565
  256   2HD   ARG  11          2HD       ARG  11  -3.546  -4.595  -0.018
  257    HE   ARG  11           HE       ARG  11  -2.148  -7.060   0.476
  258   1HH1  ARG  11          1HH1      ARG  11  -4.975  -5.254   1.375
  259   2HH1  ARG  11          2HH1      ARG  11  -5.897  -6.667   1.761
  260   1HH2  ARG  11          1HH2      ARG  11  -3.358  -8.887   0.982
  261   2HH2  ARG  11          2HH2      ARG  11  -4.988  -8.714   1.540
  262    H    ALA  12           H        ALA  12  -2.190  -4.844  -4.821
  263    HA   ALA  12           HA       ALA  12  -2.066  -2.164  -5.791
  264   1HB   ALA  12          1HB       ALA  12  -1.587  -4.406  -6.964
  265   2HB   ALA  12          2HB       ALA  12  -3.327  -4.539  -7.212
  266   3HB   ALA  12          3HB       ALA  12  -2.434  -3.204  -7.938
  267    H    GLU  13           H        GLU  13  -4.762  -4.176  -4.813
  268    HA   GLU  13           HA       GLU  13  -6.842  -2.486  -5.960
  269   1HB   GLU  13          1HB       GLU  13  -6.806  -4.608  -3.781
  270   2HB   GLU  13          2HB       GLU  13  -8.276  -3.921  -4.474
  271   1HG   GLU  13          1HG       GLU  13  -6.673  -4.710  -6.668
  272   2HG   GLU  13          2HG       GLU  13  -6.605  -6.039  -5.511
  273    H    LYS  14           H        LYS  14  -5.057  -2.737  -2.918
  274    HA   LYS  14           HA       LYS  14  -6.700  -0.739  -1.533
  275   1HB   LYS  14          1HB       LYS  14  -3.936  -1.905  -0.989
  276   2HB   LYS  14          2HB       LYS  14  -4.919  -1.018   0.178
  277   1HG   LYS  14          1HG       LYS  14  -5.712  -3.628  -1.146
  278   2HG   LYS  14          2HG       LYS  14  -5.099  -3.470   0.500
  279   1HD   LYS  14          1HD       LYS  14  -7.185  -3.042   1.225
  280   2HD   LYS  14          2HD       LYS  14  -7.232  -1.600   0.210
  281   1HE   LYS  14          1HE       LYS  14  -8.114  -2.856  -1.663
  282   2HE   LYS  14          2HE       LYS  14  -7.874  -4.391  -0.805
  283   1HZ   LYS  14          1HZ       LYS  14  -9.559  -2.159   0.196
  284   2HZ   LYS  14          2HZ       LYS  14 -10.170  -3.522  -0.613
  285   3HZ   LYS  14          3HZ       LYS  14  -9.397  -3.698   0.890
  286    H    GLN  15           H        GLN  15  -3.704  -0.949  -3.310
  287    HA   GLN  15           HA       GLN  15  -2.758   1.741  -2.930
  288   1HB   GLN  15          1HB       GLN  15  -2.145  -0.737  -4.356
  289   2HB   GLN  15          2HB       GLN  15  -1.779   0.667  -5.343
  290   1HG   GLN  15          1HG       GLN  15  -0.157   1.445  -3.878
  291   2HG   GLN  15          2HG       GLN  15  -0.927   0.690  -2.482
  292   1HE2  GLN  15          2HE2      GLN  15  -0.938  -1.834  -2.598
  293   2HE2  GLN  15          1HE2      GLN  15   0.485  -2.567  -3.172
  294    H    ALA  16           H        ALA  16  -4.434   0.107  -5.626
  295    HA   ALA  16           HA       ALA  16  -4.707   2.459  -7.260
  296   1HB   ALA  16          1HB       ALA  16  -4.937   0.022  -7.926
  297   2HB   ALA  16          2HB       ALA  16  -6.506   0.013  -7.119
  298   3HB   ALA  16          3HB       ALA  16  -6.241   1.051  -8.520
  299    H    GLN  17           H        GLN  17  -6.634   1.166  -4.586
  300    HA   GLN  17           HA       GLN  17  -8.898   2.963  -5.073
  301   1HB   GLN  17          1HB       GLN  17  -7.961   0.989  -3.035
  302   2HB   GLN  17          2HB       GLN  17  -9.119   2.198  -2.485
  303   1HG   GLN  17          1HG       GLN  17  -9.772   0.941  -5.084
  304   2HG   GLN  17          2HG       GLN  17  -9.833  -0.144  -3.694
  305   1HE2  GLN  17          2HE2      GLN  17 -10.581   3.365  -3.720
  306   2HE2  GLN  17          1HE2      GLN  17 -12.201   3.182  -3.251
  307    H    TRP  18           H        TRP  18  -5.991   2.895  -3.112
  308    HA   TRP  18           HA       TRP  18  -6.497   5.392  -1.699
  309   1HB   TRP  18          1HB       TRP  18  -5.020   3.648  -0.816
  310   2HB   TRP  18          2HB       TRP  18  -4.043   3.701  -2.269
  311    HD1  TRP  18           HD1      TRP  18  -4.591   5.554   0.992
  312    HE1  TRP  18           HE1      TRP  18  -2.836   7.445   1.162
  313    HE3  TRP  18           HE3      TRP  18  -2.614   5.331  -3.644
  314    HZ2  TRP  18           HZ2      TRP  18  -0.840   8.674  -0.472
  315    HZ3  TRP  18           HZ3      TRP  18  -0.817   6.827  -4.324
  316    HH2  TRP  18           HH2      TRP  18   0.091   8.479  -2.769
  317    H    LYS  19           H        LYS  19  -4.443   4.372  -4.384
  318    HA   LYS  19           HA       LYS  19  -3.266   6.873  -5.031
  319   1HB   LYS  19          1HB       LYS  19  -3.926   4.348  -6.564
  320   2HB   LYS  19          2HB       LYS  19  -3.112   5.703  -7.332
  321   1HG   LYS  19          1HG       LYS  19  -1.422   5.593  -5.419
  322   2HG   LYS  19          2HG       LYS  19  -2.124   4.026  -5.030
  323   1HD   LYS  19          1HD       LYS  19  -1.000   4.785  -7.741
  324   2HD   LYS  19          2HD       LYS  19  -0.138   3.841  -6.528
  325   1HE   LYS  19          1HE       LYS  19  -2.082   2.198  -6.573
  326   2HE   LYS  19          2HE       LYS  19  -2.673   3.070  -8.002
  327   1HZ   LYS  19          1HZ       LYS  19  -0.398   2.813  -8.945
  328   2HZ   LYS  19          2HZ       LYS  19  -0.025   1.771  -7.657
  329   3HZ   LYS  19          3HZ       LYS  19  -1.237   1.350  -8.770
  330    H    ALA  20           H        ALA  20  -6.322   5.356  -5.918
  331    HA   ALA  20           HA       ALA  20  -7.103   7.190  -7.938
  332   1HB   ALA  20          1HB       ALA  20  -8.321   5.197  -6.141
  333   2HB   ALA  20          2HB       ALA  20  -9.432   6.437  -6.724
  334   3HB   ALA  20          3HB       ALA  20  -8.552   5.429  -7.874
  335    H    ALA  21           H        ALA  21  -7.127   7.389  -4.434
  336    HA   ALA  21           HA       ALA  21  -8.340  10.115  -4.638
  337   1HB   ALA  21          1HB       ALA  21  -9.604   8.200  -3.471
  338   2HB   ALA  21          2HB       ALA  21  -8.361   8.297  -2.224
  339   3HB   ALA  21          3HB       ALA  21  -9.404   9.684  -2.540
  340    H    ASN  22           H        ASN  22  -5.519   9.225  -4.797
  341    HA   ASN  22           HA       ASN  22  -4.420  11.196  -2.898
  342   1HB   ASN  22          1HB       ASN  22  -3.677   8.257  -2.860
  343   2HB   ASN  22          2HB       ASN  22  -2.777   9.519  -2.024
  344   1HD2  ASN  22          2HD2      ASN  22  -5.102   7.237  -1.501
  345   2HD2  ASN  22          1HD2      ASN  22  -5.926   7.949  -0.198
  346    HA   PRO  23           HA       PRO  23  -2.238  10.492  -7.028
  347   1HB   PRO  23          1HB       PRO  23  -3.096  12.776  -8.282
  348   2HB   PRO  23          2HB       PRO  23  -3.949  11.225  -8.422
  349   1HG   PRO  23          1HG       PRO  23  -4.570  13.580  -6.713
  350   2HG   PRO  23          2HG       PRO  23  -5.666  12.493  -7.582
  351   1HD   PRO  23          1HD       PRO  23  -5.187  12.318  -4.904
  352   2HD   PRO  23          2HD       PRO  23  -5.651  10.928  -5.898
  353    H    LEU  24           H        LEU  24  -2.960  13.161  -4.895
  354    HA   LEU  24           HA       LEU  24  -0.786  14.914  -5.433
  355   1HB   LEU  24          1HB       LEU  24  -1.499  15.918  -3.440
  356   2HB   LEU  24          2HB       LEU  24  -2.908  14.923  -3.789
  357    HG   LEU  24           HG       LEU  24  -0.627  13.939  -2.045
  358   1HD1  LEU  24          1HD1      LEU  24  -1.962  16.112  -1.323
  359   2HD1  LEU  24          2HD1      LEU  24  -3.196  14.931  -0.884
  360   3HD1  LEU  24          3HD1      LEU  24  -1.593  14.845  -0.155
  361   1HD2  LEU  24          1HD2      LEU  24  -2.823  12.624  -3.161
  362   2HD2  LEU  24          2HD2      LEU  24  -1.887  12.058  -1.779
  363   3HD2  LEU  24          3HD2      LEU  24  -3.358  12.998  -1.527
  364    H    LEU  25           H        LEU  25  -1.008  11.934  -3.602
  365    HA   LEU  25           HA       LEU  25   1.891  12.020  -2.930
  366   1HB   LEU  25          1HB       LEU  25  -0.587  10.584  -1.993
  367   2HB   LEU  25          2HB       LEU  25   0.987   9.835  -1.702
  368    HG   LEU  25           HG       LEU  25   0.641  12.725  -1.000
  369   1HD1  LEU  25          1HD1      LEU  25  -1.296  11.141  -0.104
  370   2HD1  LEU  25          2HD1      LEU  25  -0.050  10.648   1.043
  371   3HD1  LEU  25          3HD1      LEU  25  -0.546  12.337   0.953
  372   1HD2  LEU  25          1HD2      LEU  25   2.355  10.397  -0.252
  373   2HD2  LEU  25          2HD2      LEU  25   2.806  12.079  -0.528
  374   3HD2  LEU  25          3HD2      LEU  25   2.050  11.607   0.993
  375    H    VAL  26           H        VAL  26   0.806  11.721  -5.578
  376    HA   VAL  26           HA       VAL  26   2.057   9.167  -6.370
  377    HB   VAL  26           HB       VAL  26  -0.805   9.764  -6.136
  378   1HG1  VAL  26          1HG1      VAL  26   0.294   9.000  -8.852
  379   2HG1  VAL  26          2HG1      VAL  26  -1.351   8.606  -8.353
  380   3HG1  VAL  26          3HG1      VAL  26  -0.841  10.293  -8.454
  381   1HG2  VAL  26          1HG2      VAL  26   0.399   7.774  -5.265
  382   2HG2  VAL  26          2HG2      VAL  26  -0.939   7.325  -6.325
  383   3HG2  VAL  26          3HG2      VAL  26   0.723   7.263  -6.923
  384    H    GLY  27           H        GLY  27   3.458   9.870  -7.932
  385   1HA   GLY  27          1HA       GLY  27   4.181  10.928  -9.924
  386   2HA   GLY  27          2HA       GLY  27   2.506  11.416 -10.211
  387    H    VAL  28           H        VAL  28   1.758  13.039  -8.304
  388    HA   VAL  28           HA       VAL  28   3.125  15.500  -8.654
  389    HB   VAL  28           HB       VAL  28   1.309  14.499  -6.440
  390   1HG1  VAL  28          1HG1      VAL  28   2.794  16.903  -6.573
  391   2HG1  VAL  28          2HG1      VAL  28   1.139  17.333  -7.010
  392   3HG1  VAL  28          3HG1      VAL  28   1.465  16.531  -5.475
  393   1HG2  VAL  28          1HG2      VAL  28   0.712  14.677  -9.071
  394   2HG2  VAL  28          2HG2      VAL  28  -0.466  15.014  -7.802
  395   3HG2  VAL  28          3HG2      VAL  28   0.388  16.342  -8.586
  396    H    SER  29           H        SER  29   4.642  16.591  -7.320
  397    HA   SER  29           HA       SER  29   6.523  16.715  -5.901
  398   1HB   SER  29          1HB       SER  29   4.394  15.233  -4.367
  399   2HB   SER  29          2HB       SER  29   5.947  15.596  -3.622
  400    HG   SER  29           HG       SER  29   5.408  17.634  -3.521
  401    H    ALA  30           H        ALA  30   7.786  14.985  -4.235
  402    HA   ALA  30           HA       ALA  30   9.286  13.152  -4.273
  403   1HB   ALA  30          1HB       ALA  30   6.606  12.157  -5.210
  404   2HB   ALA  30          2HB       ALA  30   7.974  11.045  -5.169
  405   3HB   ALA  30          3HB       ALA  30   7.438  11.837  -3.688
  406    H    LYS  31           H        LYS  31  10.442  14.440  -6.068
  407    HA   LYS  31           HA       LYS  31  10.315  12.931  -8.659
  408   1HB   LYS  31          1HB       LYS  31  10.985  15.828  -8.051
  409   2HB   LYS  31          2HB       LYS  31  11.061  15.099  -9.655
  410   1HG   LYS  31          1HG       LYS  31   8.728  14.784  -9.758
  411   2HG   LYS  31          2HG       LYS  31   8.539  14.954  -8.012
  412   1HD   LYS  31          1HD       LYS  31   7.759  17.005  -8.988
  413   2HD   LYS  31          2HD       LYS  31   9.333  17.352  -8.271
  414   1HE   LYS  31          1HE       LYS  31   9.531  16.410 -11.051
  415   2HE   LYS  31          2HE       LYS  31   8.642  17.938 -10.883
  416   1HZ   LYS  31          1HZ       LYS  31  10.436  18.726  -9.413
  417   2HZ   LYS  31          2HZ       LYS  31  11.313  17.309  -9.743
  418   3HZ   LYS  31          3HZ       LYS  31  10.984  18.411 -10.990
  419    HA   PRO  32           HA       PRO  32  14.518  11.962  -7.493
  420   1HB   PRO  32          1HB       PRO  32  15.166  10.554  -9.749
  421   2HB   PRO  32          2HB       PRO  32  14.176   9.877  -8.440
  422   1HG   PRO  32          1HG       PRO  32  13.339  10.975 -11.072
  423   2HG   PRO  32          2HG       PRO  32  12.691   9.602 -10.162
  424   1HD   PRO  32          1HD       PRO  32  11.504  12.068 -10.260
  425   2HD   PRO  32          2HD       PRO  32  11.296  10.916  -8.922
  426    H    VAL  33           H        VAL  33  16.228  13.356  -7.740
  427    HA   VAL  33           HA       VAL  33  16.343  15.084 -10.157
  428    HB   VAL  33           HB       VAL  33  17.884  15.139  -7.543
  429   1HG1  VAL  33          1HG1      VAL  33  18.622  16.379  -9.788
  430   2HG1  VAL  33          2HG1      VAL  33  17.397  17.535  -9.262
  431   3HG1  VAL  33          3HG1      VAL  33  18.768  17.164  -8.216
  432   1HG2  VAL  33          1HG2      VAL  33  15.148  15.919  -8.238
  433   2HG2  VAL  33          2HG2      VAL  33  15.904  15.782  -6.651
  434   3HG2  VAL  33          3HG2      VAL  33  16.084  17.266  -7.587
  435    H    ASN  34           H        ASN  34  18.270  12.715  -8.365
  436    HA   ASN  34           HA       ASN  34  20.269  11.596  -8.930
  437   1HB   ASN  34          1HB       ASN  34  18.603  10.869 -10.674
  438   2HB   ASN  34          2HB       ASN  34  19.215  12.151 -11.721
  439   1HD2  ASN  34          2HD2      ASN  34  20.965   9.856  -9.555
  440   2HD2  ASN  34          1HD2      ASN  34  21.963   9.235 -10.779
  441    H    ARG  35           H        ARG  35  20.647  14.312  -8.410
  442    HA   ARG  35           HA       ARG  35  22.256  15.501 -10.565
  443   1HB   ARG  35          1HB       ARG  35  20.984  17.044  -9.341
  444   2HB   ARG  35          2HB       ARG  35  21.314  16.253  -7.805
  445   1HG   ARG  35          1HG       ARG  35  23.660  17.020  -7.909
  446   2HG   ARG  35          2HG       ARG  35  23.335  17.799  -9.458
  447   1HD   ARG  35          1HD       ARG  35  21.421  18.569  -7.358
  448   2HD   ARG  35          2HD       ARG  35  23.094  19.046  -7.006
  449    HE   ARG  35           HE       ARG  35  21.452  20.114  -9.151
  450   1HH1  ARG  35          1HH1      ARG  35  24.677  19.255  -8.196
  451   2HH1  ARG  35          2HH1      ARG  35  25.423  20.379  -9.279
  452   1HH2  ARG  35          1HH2      ARG  35  22.433  21.571 -10.557
  453   2HH2  ARG  35          2HH2      ARG  35  24.161  21.684 -10.610
  454    HA   PRO  36           HA       PRO  36  25.789  14.697  -7.461
  455   1HB   PRO  36          1HB       PRO  36  25.282  13.223  -5.212
  456   2HB   PRO  36          2HB       PRO  36  25.104  14.987  -5.270
  457   1HG   PRO  36          1HG       PRO  36  23.022  12.870  -5.422
  458   2HG   PRO  36          2HG       PRO  36  22.971  14.452  -4.628
  459   1HD   PRO  36          1HD       PRO  36  21.795  13.916  -7.034
  460   2HD   PRO  36          2HD       PRO  36  22.338  15.530  -6.530
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  11.519 -16.411   0.990
    2   2H5*    G   1          2H5*        G   1  12.730 -16.499   2.290
    3    H4*    G   1           H4*        G   1  11.441 -19.047   2.094
    4    H3*    G   1           H3*        G   1   9.571 -16.665   2.114
    5    H2*    G   1           H2*        G   1   8.269 -17.674   3.813
    6   2HO*    G   1          2HO*        G   1   9.480 -20.074   4.083
    7    H1*    G   1           H1*        G   1  10.370 -18.839   5.184
    8    H8     G   1           H8         G   1  11.314 -15.337   4.264
    9    H1     G   1           H1         G   1   7.229 -15.693   9.209
   10   1H2     G   1          1H2         G   1   6.233 -17.700   9.197
   11   2H2     G   1          2H2         G   1   7.083 -19.055   8.488
   12   1H5*    C   2          1H5*        C   2   6.135 -17.241   1.093
   13   2H5*    C   2          2H5*        C   2   7.093 -16.577   2.436
   14    H4*    C   2           H4*        C   2   4.639 -18.266   2.926
   15    H3*    C   2           H3*        C   2   4.802 -15.286   2.378
   16    H2*    C   2           H2*        C   2   3.260 -14.882   4.105
   17   2HO*    C   2          2HO*        C   2   1.975 -16.512   4.996
   18    H1*    C   2           H1*        C   2   4.146 -16.897   5.829
   19   1H4     C   2          1H4         C   2   6.387 -11.287   7.899
   20   2H4     C   2          2H4         C   2   7.948 -11.743   7.256
   21    H5     C   2           H5         C   2   7.612 -12.876   4.953
   22    H6     C   2           H6         C   2   6.906 -15.147   4.275
   23   1H5*    C   3          1H5*        C   3   0.462 -13.570   1.554
   24   2H5*    C   3          2H5*        C   3   1.677 -12.361   2.005
   25    H4*    C   3           H4*        C   3  -0.042 -14.071   3.801
   26    H3*    C   3           H3*        C   3   0.535 -11.123   3.470
   27    H2*    C   3           H2*        C   3   0.263 -10.766   5.766
   28   2HO*    C   3          2HO*        C   3  -0.820 -12.056   7.115
   29    H1*    C   3           H1*        C   3   1.434 -13.139   6.618
   30   1H4     C   3          1H4         C   3   5.857  -8.568   7.170
   31   2H4     C   3          2H4         C   3   6.312  -8.803   5.497
   32    H5     C   3           H5         C   3   5.180 -10.400   4.063
   33    H6     C   3           H6         C   3   3.389 -12.022   3.898
   34   1H5*    C   4          1H5*        C   4  -3.525  -9.854   4.748
   35   2H5*    C   4          2H5*        C   4  -1.764 -10.068   4.772
   36    H4*    C   4           H4*        C   4  -3.370  -9.873   7.318
   37    H3*    C   4           H3*        C   4  -2.352  -7.611   5.566
   38    H2*    C   4           H2*        C   4  -1.608  -6.461   7.467
   39   2HO*    C   4          2HO*        C   4  -2.281  -7.035   9.573
   40    H1*    C   4           H1*        C   4  -0.808  -8.683   8.934
   41   1H4     C   4          1H4         C   4   4.148  -5.814   5.906
   42   2H4     C   4          2H4         C   4   4.599  -7.468   5.583
   43    H5     C   4           H5         C   4   2.223  -8.357   4.623
   44    H6     C   4           H6         C   4   0.154  -9.066   5.511
   45   1H5*    U   5          1H5*        U   5  -4.429  -5.784   8.548
   46   2H5*    U   5          2H5*        U   5  -5.585  -4.578   7.939
   47    H4*    U   5           H4*        U   5  -4.191  -3.458   9.515
   48    H3*    U   5           H3*        U   5  -3.336  -2.851   6.667
   49    H2*    U   5           H2*        U   5  -1.705  -1.401   7.535
   50   2HO*    U   5          2HO*        U   5  -2.371  -1.461  10.187
   51    H1*    U   5           H1*        U   5  -1.220  -2.914   9.868
   52    H3     U   5           H3         U   5   2.653  -2.231   7.622
   53    H5     U   5           H5         U   5   0.759  -5.280   5.484
   54    H6     U   5           H6         U   5  -1.206  -4.872   6.801
   55   1H5*    G   6          1H5*        G   6  -2.666   0.035   7.495
   56   2H5*    G   6          2H5*        G   6  -3.212   1.517   8.296
   57    H4*    G   6           H4*        G   6  -2.539   2.857   6.539
   58    H3*    G   6           H3*        G   6  -2.993   0.444   4.753
   59    H2*    G   6           H2*        G   6  -1.398   1.264   3.249
   60   2HO*    G   6          2HO*        G   6  -1.520   3.321   2.838
   61    H1*    G   6           H1*        G   6   0.324   2.374   5.163
   62    H8     G   6           H8         G   6  -1.253  -1.148   5.295
   63    H1     G   6           H1         G   6   4.800  -0.887   3.146
   64   1H2     G   6          1H2         G   6   5.317   1.261   2.675
   65   2H2     G   6          2H2         G   6   4.566   2.488   3.680
   66   1H5*    A   7          1H5*        A   7  -4.781   1.732   0.460
   67   2H5*    A   7          2H5*        A   7  -3.766   0.280   0.556
   68    H4*    A   7           H4*        A   7  -2.922   1.677  -1.218
   69    H3*    A   7           H3*        A   7  -1.219   1.807   1.294
   70    H2*    A   7           H2*        A   7   0.257   3.255   0.130
   71   2HO*    A   7          2HO*        A   7   0.597   3.129  -1.952
   72    H1*    A   7           H1*        A   7  -1.724   4.477  -1.410
   73    H8     A   7           H8         A   7  -2.869   4.724   2.105
   74   1H6     A   7          1H6         A   7   1.154   8.425   3.612
   75   2H6     A   7          2H6         A   7  -0.119   9.397   2.908
   76    H2     A   7           H2         A   7   2.103   7.337  -1.004
   77   1H5*    A   8          1H5*        A   8   0.889   0.704  -1.583
   78   2H5*    A   8          2H5*        A   8   2.219  -0.470  -1.692
   79    H4*    A   8           H4*        A   8   3.156   1.711  -2.043
   80    H3*    A   8           H3*        A   8   3.628   0.684   0.772
   81    H2*    A   8           H2*        A   8   4.923   2.618   1.225
   82   2HO*    A   8          2HO*        A   8   5.906   3.755  -0.283
   83    H1*    A   8           H1*        A   8   3.246   4.356  -0.210
   84    H8     A   8           H8         A   8   1.020   2.118   1.733
   85   1H6     A   8          1H6         A   8   1.281   4.240   6.120
   86   2H6     A   8          2H6         A   8   2.124   5.661   6.694
   87    H2     A   8           H2         A   8   5.180   6.666   3.559
   88   1H5*    A   9          2H5*        A   9   8.305  -0.849  -1.942
   89   2H5*    A   9          1H5*        A   9   7.271   0.066  -0.823
   90    H4*    A   9           H4*        A   9   9.369   1.087  -2.357
   91    H3*    A   9           H3*        A   9   7.013   2.407  -0.981
   92    H2*    A   9           H2*        A   9   7.742   4.485  -1.860
   93   2HO*    A   9          2HO*        A   9   9.752   4.830  -2.641
   94    H1*    A   9           H1*        A   9   8.480   3.447  -4.347
   95    H8     A   9           H8         A   9   5.973   4.786  -2.094
   96   1H6     A   9          1H6         A   9   2.239   5.395  -6.100
   97   2H6     A   9          2H6         A   9   1.539   3.924  -5.464
   98    H2     A   9           H2         A   9   5.259   1.864  -7.762
   99   1H5*    A  10          1H5*        A  10   9.712   1.149   4.107
  100   2H5*    A  10          2H5*        A  10   8.084   1.615   3.575
  101    H4*    A  10           H4*        A  10  10.130   3.778   3.674
  102    H3*    A  10           H3*        A  10   9.033   2.356   6.101
  103    H2*    A  10           H2*        A  10   8.595   4.398   7.175
  104   2HO*    A  10          2HO*        A  10   9.787   6.108   6.889
  105    H1*    A  10           H1*        A  10   7.776   5.811   4.918
  106    H8     A  10           H8         A  10   5.955   2.888   4.155
  107   1H6     A  10          1H6         A  10   2.108   3.437   7.373
  108   2H6     A  10          2H6         A  10   2.429   3.310   9.087
  109    H2     A  10           H2         A  10   5.780   6.388   9.539
  110   1H5*    A  11          1H5*        A  11  10.463   5.017   9.346
  111   2H5*    A  11          2H5*        A  11  11.008   3.555  10.199
  112    H4*    A  11           H4*        A  11   8.699   4.813  10.787
  113    H3*    A  11           H3*        A  11   9.307   1.848  10.818
  114    H2*    A  11           H2*        A  11   7.055   1.378  11.335
  115   2HO*    A  11          2HO*        A  11   6.447   4.098  11.709
  116    H1*    A  11           H1*        A  11   5.917   3.363   9.778
  117    H8     A  11           H8         A  11   8.687   1.689   7.852
  118   1H6     A  11          1H6         A  11   4.835  -2.860   6.550
  119   2H6     A  11          2H6         A  11   5.707  -1.723   5.553
  120    H2     A  11           H2         A  11   2.709  -0.050   9.438
  121   1H5*    G  12          1H5*        G  12   9.489  -1.152  13.636
  122   2H5*    G  12          2H5*        G  12   9.298  -0.252  12.121
  123    H4*    G  12           H4*        G  12   7.158   0.342  14.010
  124    H3*    G  12           H3*        G  12   7.621  -2.539  13.232
  125    H2*    G  12           H2*        G  12   5.305  -2.776  12.790
  126   2HO*    G  12          2HO*        G  12   4.103  -0.592  13.368
  127    H1*    G  12           H1*        G  12   4.949  -0.238  11.667
  128    H8     G  12           H8         G  12   7.919  -1.049   9.902
  129    H1     G  12           H1         G  12   3.280  -5.217   8.356
  130   1H2     G  12          1H2         G  12   1.758  -5.278   9.962
  131   2H2     G  12          2H2         G  12   1.614  -3.949  11.089
  132   1H5*    G  13          1H5*        G  13   4.943  -2.960  16.211
  133   2H5*    G  13          2H5*        G  13   5.308  -4.071  17.548
  134    H4*    G  13           H4*        G  13   3.251  -4.794  16.510
  135    H3*    G  13           H3*        G  13   5.635  -6.482  15.702
  136    H2*    G  13           H2*        G  13   4.207  -7.784  14.385
  137   2HO*    G  13          2HO*        G  13   2.224  -6.827  16.110
  138    H1*    G  13           H1*        G  13   2.490  -5.707  13.604
  139    H8     G  13           H8         G  13   5.973  -4.547  13.014
  140    H1     G  13           H1         G  13   3.949  -8.802   8.644
  141   1H2     G  13          1H2         G  13   2.211  -9.932   9.465
  142   2H2     G  13          2H2         G  13   1.241  -9.220  10.735
  143   1H5*    G  14          1H5*        G  14   1.393  -9.236  17.640
  144   2H5*    G  14          2H5*        G  14   2.632 -10.359  18.247
  145    H4*    G  14           H4*        G  14   0.669 -11.330  16.824
  146    H3*    G  14           H3*        G  14   3.585 -11.907  16.264
  147    H2*    G  14           H2*        G  14   2.908 -13.316  14.488
  148   2HO*    G  14          2HO*        G  14   0.182 -13.061  14.982
  149    H1*    G  14           H1*        G  14   0.821 -11.694  13.608
  150    H8     G  14           H8         G  14   3.634  -9.392  14.310
  151    H1     G  14           H1         G  14   4.588 -12.929   9.022
  152   1H2     G  14          1H2         G  14   2.749 -14.290   8.775
  153   2H2     G  14          2H2         G  14   2.239 -15.014  10.282
  154   1H5*    C  15          1H5*        C  15   1.666 -15.313  16.003
  155   2H5*    C  15          2H5*        C  15   2.171 -16.536  17.196
  156    H4*    C  15           H4*        C  15   2.135 -17.770  15.210
  157    H3*    C  15           H3*        C  15   4.924 -16.674  15.650
  158    H2*    C  15           H2*        C  15   5.612 -17.763  13.675
  159   2HO*    C  15          2HO*        C  15   3.326 -19.376  14.108
  160    H1*    C  15           H1*        C  15   3.159 -17.449  12.322
  161   1H4     C  15          1H4         C  15   7.152 -13.369   9.578
  162   2H4     C  15          2H4         C  15   7.317 -12.450  11.067
  163    H5     C  15           H5         C  15   5.657 -12.791  12.864
  164    H6     C  15           H6         C  15   4.153 -14.384  13.863
  165   2H    ASP   2          2H        ASP   2  10.560 -11.919  -1.109
  166   1H    ASP   2          1H        ASP   2  10.352 -13.465  -0.436
  167   3H    ASP   2          3H        ASP   2  11.754 -12.567  -0.095
  168    HA   ASP   2           HA       ASP   2  10.482 -12.281   1.828
  169   1HB   ASP   2          1HB       ASP   2   9.757 -10.004  -0.037
  170   2HB   ASP   2          2HB       ASP   2   9.959  -9.914   1.711
  171    H    ALA   3           H        ALA   3   8.184 -10.706   2.109
  172    HA   ALA   3           HA       ALA   3   6.006 -12.249   0.768
  173   1HB   ALA   3          1HB       ALA   3   6.427 -11.854   3.744
  174   2HB   ALA   3          2HB       ALA   3   4.989 -12.578   3.026
  175   3HB   ALA   3          3HB       ALA   3   6.551 -13.378   2.866
  176    H    GLN   4           H        GLN   4   6.950  -9.428   2.706
  177    HA   GLN   4           HA       GLN   4   4.366  -8.132   2.516
  178   1HB   GLN   4          1HB       GLN   4   6.154  -7.662   4.221
  179   2HB   GLN   4          2HB       GLN   4   7.137  -6.957   2.939
  180   1HG   GLN   4          1HG       GLN   4   5.256  -5.377   2.448
  181   2HG   GLN   4          2HG       GLN   4   4.419  -6.000   3.868
  182   1HE2  GLN   4          2HE2      GLN   4   5.516  -3.254   3.356
  183   2HE2  GLN   4          1HE2      GLN   4   6.581  -2.952   4.644
  184    H    THR   5           H        THR   5   7.475  -7.461   0.902
  185    HA   THR   5           HA       THR   5   6.597  -5.574  -0.994
  186    HB   THR   5           HB       THR   5   8.550  -7.889  -1.287
  187    HG1  THR   5           HG1      THR   5   8.829  -5.186  -0.484
  188   1HG2  THR   5          1HG2      THR   5   7.965  -5.472  -2.976
  189   2HG2  THR   5          2HG2      THR   5   9.584  -6.173  -2.953
  190   3HG2  THR   5          3HG2      THR   5   8.209  -7.145  -3.481
  191    H    ARG   6           H        ARG   6   6.173  -9.054  -0.849
  192    HA   ARG   6           HA       ARG   6   5.022  -9.392  -3.497
  193   1HB   ARG   6          1HB       ARG   6   5.657 -10.926  -1.104
  194   2HB   ARG   6          2HB       ARG   6   4.054 -11.352  -1.720
  195   1HG   ARG   6          1HG       ARG   6   4.897 -12.270  -3.647
  196   2HG   ARG   6          2HG       ARG   6   6.212 -11.099  -3.755
  197   1HD   ARG   6          1HD       ARG   6   7.335 -13.115  -3.219
  198   2HD   ARG   6          2HD       ARG   6   7.144 -12.341  -1.634
  199    HE   ARG   6           HE       ARG   6   5.591 -14.026  -1.067
  200   1HH1  ARG   6          2HH1      ARG   6   6.002 -13.817  -4.508
  201   2HH1  ARG   6          1HH1      ARG   6   5.004 -15.194  -4.828
  202   1HH2  ARG   6          1HH2      ARG   6   4.295 -15.813  -1.496
  203   2HH2  ARG   6          2HH2      ARG   6   4.041 -16.319  -3.133
  204    H    ARG   7           H        ARG   7   3.770  -9.122  -0.172
  205    HA   ARG   7           HA       ARG   7   1.026  -9.344  -0.826
  206   1HB   ARG   7          1HB       ARG   7   1.806  -9.504   1.445
  207   2HB   ARG   7          2HB       ARG   7   2.534  -7.899   1.368
  208   1HG   ARG   7          1HG       ARG   7   0.153  -7.019   0.919
  209   2HG   ARG   7          2HG       ARG   7  -0.405  -8.607   1.441
  210   1HD   ARG   7          1HD       ARG   7   0.165  -8.222   3.637
  211   2HD   ARG   7          2HD       ARG   7   1.558  -7.216   3.211
  212    HE   ARG   7           HE       ARG   7   0.111  -5.354   3.211
  213   1HH1  ARG   7          1HH1      ARG   7  -1.681  -8.297   2.897
  214   2HH1  ARG   7          2HH1      ARG   7  -3.213  -7.503   2.986
  215   1HH2  ARG   7          1HH2      ARG   7  -1.844  -4.328   3.327
  216   2HH2  ARG   7          2HH2      ARG   7  -3.306  -5.244   3.229
  217    H    ARG   8           H        ARG   8   3.237  -6.597  -0.916
  218    HA   ARG   8           HA       ARG   8   1.411  -4.444  -1.234
  219   1HB   ARG   8          1HB       ARG   8   4.136  -4.845  -1.242
  220   2HB   ARG   8          2HB       ARG   8   3.854  -4.509  -2.944
  221   1HG   ARG   8          1HG       ARG   8   4.378  -2.461  -1.594
  222   2HG   ARG   8          2HG       ARG   8   2.827  -2.378  -2.419
  223   1HD   ARG   8          1HD       ARG   8   3.020  -1.694   0.145
  224   2HD   ARG   8          2HD       ARG   8   1.609  -2.592  -0.431
  225    HE   ARG   8           HE       ARG   8   3.838  -4.310   0.399
  226   1HH1  ARG   8          1HH1      ARG   8   0.968  -2.620   1.353
  227   2HH1  ARG   8          2HH1      ARG   8   0.672  -3.640   2.711
  228   1HH2  ARG   8          1HH2      ARG   8   3.438  -5.634   2.167
  229   2HH2  ARG   8          2HH2      ARG   8   2.064  -5.338   3.172
  230    H    GLU   9           H        GLU   9   2.707  -6.753  -3.594
  231    HA   GLU   9           HA       GLU   9   1.417  -5.619  -5.899
  232   1HB   GLU   9          1HB       GLU   9   2.105  -8.503  -5.204
  233   2HB   GLU   9          2HB       GLU   9   1.789  -7.900  -6.830
  234   1HG   GLU   9          1HG       GLU   9   3.821  -6.318  -5.445
  235   2HG   GLU   9          2HG       GLU   9   4.281  -8.015  -5.591
  236    H    ARG  10           H        ARG  10   0.458  -7.780  -3.325
  237    HA   ARG  10           HA       ARG  10  -2.181  -8.406  -4.352
  238   1HB   ARG  10          1HB       ARG  10  -0.477  -8.935  -2.051
  239   2HB   ARG  10          2HB       ARG  10  -2.126  -8.585  -1.538
  240   1HG   ARG  10          1HG       ARG  10  -3.005 -10.334  -2.948
  241   2HG   ARG  10          2HG       ARG  10  -1.425 -10.591  -3.692
  242   1HD   ARG  10          1HD       ARG  10  -0.835 -12.017  -2.029
  243   2HD   ARG  10          2HD       ARG  10  -1.195 -10.782  -0.808
  244    HE   ARG  10           HE       ARG  10  -3.294 -11.804  -0.483
  245   1HH1  ARG  10          1HH1      ARG  10  -1.943 -12.697  -3.553
  246   2HH1  ARG  10          2HH1      ARG  10  -3.217 -13.810  -3.922
  247   1HH2  ARG  10          1HH2      ARG  10  -4.943 -13.253  -0.971
  248   2HH2  ARG  10          2HH2      ARG  10  -4.907 -14.124  -2.468
  249    H    ARG  11           H        ARG  11  -0.683  -5.684  -2.852
  250    HA   ARG  11           HA       ARG  11  -3.263  -4.600  -1.885
  251   1HB   ARG  11          1HB       ARG  11  -0.393  -3.622  -1.807
  252   2HB   ARG  11          2HB       ARG  11  -1.757  -2.782  -1.072
  253   1HG   ARG  11          1HG       ARG  11  -0.702  -5.537  -0.345
  254   2HG   ARG  11          2HG       ARG  11  -0.672  -4.105   0.663
  255   1HD   ARG  11          1HD       ARG  11  -2.767  -4.548   1.419
  256   2HD   ARG  11          2HD       ARG  11  -3.389  -4.660  -0.229
  257    HE   ARG  11           HE       ARG  11  -1.761  -6.960   0.533
  258   1HH1  ARG  11          1HH1      ARG  11  -4.933  -5.542   0.545
  259   2HH1  ARG  11          2HH1      ARG  11  -5.741  -7.067   0.653
  260   1HH2  ARG  11          1HH2      ARG  11  -2.825  -8.933   0.674
  261   2HH2  ARG  11          2HH2      ARG  11  -4.556  -8.977   0.726
  262    H    ALA  12           H        ALA  12  -1.844  -4.807  -4.863
  263    HA   ALA  12           HA       ALA  12  -1.811  -2.132  -5.877
  264   1HB   ALA  12          1HB       ALA  12  -1.105  -4.221  -7.075
  265   2HB   ALA  12          2HB       ALA  12  -2.799  -4.699  -7.197
  266   3HB   ALA  12          3HB       ALA  12  -2.226  -3.259  -8.040
  267    H    GLU  13           H        GLU  13  -4.429  -4.257  -4.935
  268    HA   GLU  13           HA       GLU  13  -6.556  -2.701  -6.189
  269   1HB   GLU  13          1HB       GLU  13  -6.525  -4.768  -3.959
  270   2HB   GLU  13          2HB       GLU  13  -7.972  -4.206  -4.793
  271   1HG   GLU  13          1HG       GLU  13  -7.598  -5.959  -6.190
  272   2HG   GLU  13          2HG       GLU  13  -6.366  -4.916  -6.903
  273    H    LYS  14           H        LYS  14  -4.885  -2.817  -3.068
  274    HA   LYS  14           HA       LYS  14  -6.702  -0.898  -1.786
  275   1HB   LYS  14          1HB       LYS  14  -3.940  -1.997  -1.122
  276   2HB   LYS  14          2HB       LYS  14  -4.925  -1.032  -0.017
  277   1HG   LYS  14          1HG       LYS  14  -6.130  -3.478  -1.257
  278   2HG   LYS  14          2HG       LYS  14  -5.003  -3.670   0.086
  279   1HD   LYS  14          1HD       LYS  14  -6.741  -1.569   0.829
  280   2HD   LYS  14          2HD       LYS  14  -7.767  -2.834   0.152
  281   1HE   LYS  14          1HE       LYS  14  -5.606  -3.696   2.033
  282   2HE   LYS  14          2HE       LYS  14  -7.033  -2.897   2.724
  283   1HZ   LYS  14          1HZ       LYS  14  -7.163  -5.117   0.754
  284   2HZ   LYS  14          2HZ       LYS  14  -7.300  -5.338   2.433
  285   3HZ   LYS  14          3HZ       LYS  14  -8.461  -4.423   1.602
  286    H    GLN  15           H        GLN  15  -3.637  -0.970  -3.449
  287    HA   GLN  15           HA       GLN  15  -2.849   1.772  -3.049
  288   1HB   GLN  15          1HB       GLN  15  -2.027  -0.680  -4.404
  289   2HB   GLN  15          2HB       GLN  15  -1.713   0.724  -5.410
  290   1HG   GLN  15          1HG       GLN  15  -0.209   1.641  -3.893
  291   2HG   GLN  15          2HG       GLN  15  -0.976   0.848  -2.515
  292   1HE2  GLN  15          2HE2      GLN  15  -0.809  -1.663  -2.590
  293   2HE2  GLN  15          1HE2      GLN  15   0.679  -2.307  -3.103
  294    H    ALA  16           H        ALA  16  -4.301   0.011  -5.795
  295    HA   ALA  16           HA       ALA  16  -4.663   2.352  -7.445
  296   1HB   ALA  16          1HB       ALA  16  -5.970  -0.389  -7.332
  297   2HB   ALA  16          2HB       ALA  16  -6.277   0.770  -8.625
  298   3HB   ALA  16          3HB       ALA  16  -4.654   0.122  -8.390
  299    H    GLN  17           H        GLN  17  -6.533   0.917  -4.829
  300    HA   GLN  17           HA       GLN  17  -8.947   2.488  -5.406
  301   1HB   GLN  17          1HB       GLN  17  -7.913   0.670  -3.234
  302   2HB   GLN  17          2HB       GLN  17  -9.349   1.646  -2.933
  303   1HG   GLN  17          1HG       GLN  17  -9.243   0.122  -5.496
  304   2HG   GLN  17          2HG       GLN  17  -9.518  -0.796  -4.015
  305   1HE2  GLN  17          2HE2      GLN  17 -10.950   1.504  -6.243
  306   2HE2  GLN  17          1HE2      GLN  17 -12.465   1.590  -5.483
  307    H    TRP  18           H        TRP  18  -6.089   2.662  -3.379
  308    HA   TRP  18           HA       TRP  18  -6.882   5.078  -1.943
  309   1HB   TRP  18          1HB       TRP  18  -5.298   3.470  -0.997
  310   2HB   TRP  18          2HB       TRP  18  -4.273   3.597  -2.412
  311    HD1  TRP  18           HD1      TRP  18  -5.083   5.391   0.825
  312    HE1  TRP  18           HE1      TRP  18  -3.505   7.427   1.055
  313    HE3  TRP  18           HE3      TRP  18  -2.923   5.346  -3.739
  314    HZ2  TRP  18           HZ2      TRP  18  -1.562   8.830  -0.510
  315    HZ3  TRP  18           HZ3      TRP  18  -1.233   6.990  -4.353
  316    HH2  TRP  18           HH2      TRP  18  -0.526   8.711  -2.769
  317    H    LYS  19           H        LYS  19  -4.641   4.250  -4.543
  318    HA   LYS  19           HA       LYS  19  -3.667   6.846  -5.157
  319   1HB   LYS  19          1HB       LYS  19  -4.060   4.280  -6.719
  320   2HB   LYS  19          2HB       LYS  19  -3.329   5.703  -7.447
  321   1HG   LYS  19          1HG       LYS  19  -1.704   5.710  -5.482
  322   2HG   LYS  19          2HG       LYS  19  -2.295   4.092  -5.121
  323   1HD   LYS  19          1HD       LYS  19  -1.145   4.948  -7.792
  324   2HD   LYS  19          2HD       LYS  19  -0.250   4.071  -6.551
  325   1HE   LYS  19          1HE       LYS  19  -2.311   2.401  -6.694
  326   2HE   LYS  19          2HE       LYS  19  -2.472   3.103  -8.316
  327   1HZ   LYS  19          1HZ       LYS  19  -0.080   2.711  -8.642
  328   2HZ   LYS  19          2HZ       LYS  19  -0.011   1.922  -7.139
  329   3HZ   LYS  19          3HZ       LYS  19  -0.936   1.266  -8.402
  330    H    ALA  20           H        ALA  20  -6.546   5.066  -6.124
  331    HA   ALA  20           HA       ALA  20  -7.431   6.810  -8.180
  332   1HB   ALA  20          1HB       ALA  20  -8.546   4.744  -6.377
  333   2HB   ALA  20          2HB       ALA  20  -9.721   5.843  -7.098
  334   3HB   ALA  20          3HB       ALA  20  -8.666   4.878  -8.131
  335    H    ALA  21           H        ALA  21  -7.573   7.007  -4.682
  336    HA   ALA  21           HA       ALA  21  -9.020   9.610  -4.930
  337   1HB   ALA  21          1HB       ALA  21 -10.299   7.773  -3.842
  338   2HB   ALA  21          2HB       ALA  21  -9.006   7.604  -2.656
  339   3HB   ALA  21          3HB       ALA  21  -9.962   9.085  -2.711
  340    H    ASN  22           H        ASN  22  -6.132   8.978  -4.986
  341    HA   ASN  22           HA       ASN  22  -5.283  11.019  -3.037
  342   1HB   ASN  22          1HB       ASN  22  -4.275   8.160  -2.996
  343   2HB   ASN  22          2HB       ASN  22  -3.523   9.491  -2.120
  344   1HD2  ASN  22          2HD2      ASN  22  -5.651   7.004  -1.695
  345   2HD2  ASN  22          1HD2      ASN  22  -6.582   7.626  -0.420
  346    HA   PRO  23           HA       PRO  23  -2.878  10.545  -7.062
  347   1HB   PRO  23          1HB       PRO  23  -3.953  12.669  -8.421
  348   2HB   PRO  23          2HB       PRO  23  -4.600  11.020  -8.556
  349   1HG   PRO  23          1HG       PRO  23  -5.601  13.320  -6.964
  350   2HG   PRO  23          2HG       PRO  23  -6.502  12.065  -7.829
  351   1HD   PRO  23          1HD       PRO  23  -6.101  12.064  -5.122
  352   2HD   PRO  23          2HD       PRO  23  -6.388  10.599  -6.072
  353    H    LEU  24           H        LEU  24  -4.037  13.110  -5.008
  354    HA   LEU  24           HA       LEU  24  -2.136  15.150  -5.486
  355   1HB   LEU  24          1HB       LEU  24  -3.007  16.018  -3.481
  356   2HB   LEU  24          2HB       LEU  24  -4.265  14.859  -3.893
  357    HG   LEU  24           HG       LEU  24  -1.928  14.131  -2.099
  358   1HD1  LEU  24          1HD1      LEU  24  -3.578  16.107  -1.401
  359   2HD1  LEU  24          2HD1      LEU  24  -4.615  14.748  -0.966
  360   3HD1  LEU  24          3HD1      LEU  24  -3.019  14.909  -0.233
  361   1HD2  LEU  24          1HD2      LEU  24  -3.831  12.536  -3.301
  362   2HD2  LEU  24          2HD2      LEU  24  -2.993  12.122  -1.806
  363   3HD2  LEU  24          3HD2      LEU  24  -4.586  12.881  -1.751
  364    H    LEU  25           H        LEU  25  -1.948  12.158  -3.699
  365    HA   LEU  25           HA       LEU  25   0.901  12.646  -2.975
  366   1HB   LEU  25          1HB       LEU  25  -1.415  11.022  -1.997
  367   2HB   LEU  25          2HB       LEU  25   0.187  10.304  -1.804
  368    HG   LEU  25           HG       LEU  25  -0.123  13.159  -1.002
  369   1HD1  LEU  25          1HD1      LEU  25  -2.097  11.592  -0.128
  370   2HD1  LEU  25          2HD1      LEU  25  -0.857  11.076   1.013
  371   3HD1  LEU  25          3HD1      LEU  25  -1.330  12.772   0.933
  372   1HD2  LEU  25          1HD2      LEU  25   1.499  10.750  -0.275
  373   2HD2  LEU  25          2HD2      LEU  25   2.031  12.401  -0.595
  374   3HD2  LEU  25          3HD2      LEU  25   1.275  12.001   0.947
  375    H    VAL  26           H        VAL  26  -0.020  12.238  -5.634
  376    HA   VAL  26           HA       VAL  26   1.542   9.876  -6.415
  377    HB   VAL  26           HB       VAL  26  -1.377   9.990  -6.088
  378   1HG1  VAL  26          1HG1      VAL  26  -0.244   9.277  -8.805
  379   2HG1  VAL  26          2HG1      VAL  26  -1.802   8.680  -8.230
  380   3HG1  VAL  26          3HG1      VAL  26  -1.541  10.415  -8.425
  381   1HG2  VAL  26          1HG2      VAL  26   0.701   7.856  -6.646
  382   2HG2  VAL  26          2HG2      VAL  26  -0.100   8.218  -5.113
  383   3HG2  VAL  26          3HG2      VAL  26  -1.014   7.486  -6.434
  384    H    GLY  27           H        GLY  27   2.743  10.768  -8.062
  385   1HA   GLY  27          1HA       GLY  27   3.242  11.933 -10.053
  386   2HA   GLY  27          2HA       GLY  27   1.513  11.891 -10.414
  387    H    VAL  28           H        VAL  28   0.174  13.450  -8.976
  388    HA   VAL  28           HA       VAL  28   0.916  16.140  -9.409
  389    HB   VAL  28           HB       VAL  28  -0.858  14.909  -7.274
  390   1HG1  VAL  28          1HG1      VAL  28  -0.159  17.396  -7.071
  391   2HG1  VAL  28          2HG1      VAL  28  -1.143  17.648  -8.513
  392   3HG1  VAL  28          3HG1      VAL  28  -1.884  17.030  -7.038
  393   1HG2  VAL  28          1HG2      VAL  28  -1.260  15.645 -10.172
  394   2HG2  VAL  28          2HG2      VAL  28  -1.679  14.142  -9.351
  395   3HG2  VAL  28          3HG2      VAL  28  -2.624  15.603  -9.054
  396    H    SER  29           H        SER  29   1.808  17.737  -7.973
  397    HA   SER  29           HA       SER  29   3.358  18.485  -6.355
  398   1HB   SER  29          1HB       SER  29   1.519  16.522  -5.057
  399   2HB   SER  29          2HB       SER  29   2.925  17.042  -4.132
  400    HG   SER  29           HG       SER  29   2.257  19.173  -4.407
  401    H    ALA  30           H        ALA  30   5.022  17.366  -4.597
  402    HA   ALA  30           HA       ALA  30   7.054  16.148  -4.489
  403   1HB   ALA  30          1HB       ALA  30   5.033  14.119  -5.505
  404   2HB   ALA  30          2HB       ALA  30   6.622  13.689  -4.870
  405   3HB   ALA  30          3HB       ALA  30   5.432  14.459  -3.821
  406    H    LYS  31           H        LYS  31   7.123  17.703  -6.733
  407    HA   LYS  31           HA       LYS  31   8.776  16.141  -8.565
  408   1HB   LYS  31          1HB       LYS  31   7.256  16.450 -10.508
  409   2HB   LYS  31          2HB       LYS  31   6.491  15.492  -9.242
  410   1HG   LYS  31          1HG       LYS  31   5.224  17.392  -8.466
  411   2HG   LYS  31          2HG       LYS  31   6.119  18.485  -9.522
  412   1HD   LYS  31          1HD       LYS  31   5.171  17.475 -11.495
  413   2HD   LYS  31          2HD       LYS  31   4.444  16.179 -10.545
  414   1HE   LYS  31          1HE       LYS  31   2.672  17.478  -9.914
  415   2HE   LYS  31          2HE       LYS  31   3.691  18.913  -9.684
  416   1HZ   LYS  31          1HZ       LYS  31   3.923  19.033 -12.123
  417   2HZ   LYS  31          2HZ       LYS  31   2.800  17.767 -12.276
  418   3HZ   LYS  31          3HZ       LYS  31   2.318  19.250 -11.609
  419    HA   PRO  32           HA       PRO  32  10.335  20.173  -9.386
  420   1HB   PRO  32          1HB       PRO  32  11.200  19.957 -11.973
  421   2HB   PRO  32          2HB       PRO  32  12.033  19.183 -10.609
  422   1HG   PRO  32          1HG       PRO  32  10.179  18.002 -12.611
  423   2HG   PRO  32          2HG       PRO  32  11.630  17.311 -11.870
  424   1HD   PRO  32          1HD       PRO  32   9.083  16.676 -11.106
  425   2HD   PRO  32          2HD       PRO  32  10.494  16.566 -10.033
  426    H    VAL  33           H        VAL  33  10.242  21.892 -11.402
  427    HA   VAL  33           HA       VAL  33   7.425  22.565 -11.690
  428    HB   VAL  33           HB       VAL  33   8.382  24.507 -12.917
  429   1HG1  VAL  33          1HG1      VAL  33   8.620  23.935 -10.265
  430   2HG1  VAL  33          2HG1      VAL  33  10.310  24.198 -10.689
  431   3HG1  VAL  33          3HG1      VAL  33   9.120  25.466 -10.982
  432   1HG2  VAL  33          1HG2      VAL  33  10.241  22.973 -13.926
  433   2HG2  VAL  33          2HG2      VAL  33  10.658  24.637 -13.517
  434   3HG2  VAL  33          3HG2      VAL  33  11.114  23.322 -12.434
  435    H    ASN  34           H        ASN  34   6.263  22.716 -13.712
  436    HA   ASN  34           HA       ASN  34   7.267  20.823 -15.802
  437   1HB   ASN  34          1HB       ASN  34   4.869  20.568 -16.324
  438   2HB   ASN  34          2HB       ASN  34   5.155  20.286 -14.608
  439   1HD2  ASN  34          2HD2      ASN  34   2.680  21.340 -16.071
  440   2HD2  ASN  34          1HD2      ASN  34   2.318  22.802 -15.287
  441    H    ARG  35           H        ARG  35   8.462  23.230 -16.098
  442    HA   ARG  35           HA       ARG  35   6.985  24.463 -18.392
  443   1HB   ARG  35          1HB       ARG  35   6.721  25.795 -16.308
  444   2HB   ARG  35          2HB       ARG  35   8.478  25.899 -16.171
  445   1HG   ARG  35          1HG       ARG  35   8.670  27.243 -18.099
  446   2HG   ARG  35          2HG       ARG  35   7.064  26.800 -18.677
  447   1HD   ARG  35          1HD       ARG  35   6.852  28.001 -16.049
  448   2HD   ARG  35          2HD       ARG  35   7.732  29.082 -17.149
  449    HE   ARG  35           HE       ARG  35   4.932  28.350 -17.390
  450   1HH1  ARG  35          1HH1      ARG  35   7.827  29.130 -19.140
  451   2HH1  ARG  35          2HH1      ARG  35   6.971  29.715 -20.525
  452   1HH2  ARG  35          2HH2      ARG  35   3.831  29.113 -19.197
  453   2HH2  ARG  35          1HH2      ARG  35   4.721  29.705 -20.559
  454    HA   PRO  36           HA       PRO  36  11.440  23.418 -19.303
  455   1HB   PRO  36          1HB       PRO  36  10.953  21.889 -21.519
  456   2HB   PRO  36          2HB       PRO  36  10.995  21.221 -19.876
  457   1HG   PRO  36          1HG       PRO  36   8.657  21.919 -21.575
  458   2HG   PRO  36          2HG       PRO  36   8.875  20.569 -20.452
  459   1HD   PRO  36          1HD       PRO  36   7.433  22.818 -19.868
  460   2HD   PRO  36          2HD       PRO  36   8.215  21.796 -18.644
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  12.002 -16.968   1.181
    2   2H5*    G   1          2H5*        G   1  13.013 -17.365   2.588
    3    H4*    G   1           H4*        G   1  10.920 -19.356   2.161
    4    H3*    G   1           H3*        G   1  10.121 -16.452   2.569
    5    H2*    G   1           H2*        G   1   8.426 -17.176   4.056
    6   2HO*    G   1          2HO*        G   1   7.550 -19.116   4.021
    7    H1*    G   1           H1*        G   1   9.960 -19.186   5.217
    8    H8     G   1           H8         G   1  12.049 -16.088   4.862
    9    H1     G   1           H1         G   1   7.728 -15.765   9.607
   10   1H2     G   1          1H2         G   1   6.556 -17.725   9.626
   11   2H2     G   1          2H2         G   1   6.215 -18.407   8.053
   12   1H5*    C   2          1H5*        C   2   6.331 -16.792   1.010
   13   2H5*    C   2          2H5*        C   2   7.374 -16.705   2.447
   14    H4*    C   2           H4*        C   2   4.707 -18.026   2.744
   15    H3*    C   2           H3*        C   2   5.118 -15.049   2.336
   16    H2*    C   2           H2*        C   2   3.628 -14.587   4.100
   17   2HO*    C   2          2HO*        C   2   1.986 -16.046   3.451
   18    H1*    C   2           H1*        C   2   4.361 -16.725   5.733
   19   1H4     C   2          1H4         C   2   7.361 -11.744   8.235
   20   2H4     C   2          2H4         C   2   8.593 -11.819   6.999
   21    H5     C   2           H5         C   2   8.187 -13.053   4.915
   22    H6     C   2           H6         C   2   7.191 -15.150   4.098
   23   1H5*    C   3          1H5*        C   3   0.158 -13.156   1.457
   24   2H5*    C   3          2H5*        C   3   1.774 -12.692   2.023
   25    H4*    C   3           H4*        C   3  -0.245 -14.179   3.723
   26    H3*    C   3           H3*        C   3   0.375 -11.230   3.478
   27    H2*    C   3           H2*        C   3   0.149 -10.978   5.805
   28   2HO*    C   3          2HO*        C   3  -1.556 -12.003   6.534
   29    H1*    C   3           H1*        C   3   1.325 -13.404   6.490
   30   1H4     C   3          1H4         C   3   5.508  -8.519   6.979
   31   2H4     C   3          2H4         C   3   6.413  -9.326   5.718
   32    H5     C   3           H5         C   3   5.089 -10.616   4.048
   33    H6     C   3           H6         C   3   3.297 -12.237   3.843
   34   1H5*    C   4          1H5*        C   4  -3.922 -10.053   4.845
   35   2H5*    C   4          2H5*        C   4  -2.154 -10.088   4.701
   36    H4*    C   4           H4*        C   4  -3.627  -9.932   7.343
   37    H3*    C   4           H3*        C   4  -2.597  -7.721   5.530
   38    H2*    C   4           H2*        C   4  -1.790  -6.562   7.397
   39   2HO*    C   4          2HO*        C   4  -3.380  -8.282   9.007
   40    H1*    C   4           H1*        C   4  -1.005  -8.777   8.880
   41   1H4     C   4          1H4         C   4   4.450  -6.832   6.332
   42   2H4     C   4          2H4         C   4   3.785  -6.862   4.718
   43    H5     C   4           H5         C   4   1.942  -8.578   4.499
   44    H6     C   4           H6         C   4  -0.108  -9.267   5.462
   45   1H5*    U   5          1H5*        U   5  -4.695  -5.836   8.465
   46   2H5*    U   5          2H5*        U   5  -5.809  -4.586   7.867
   47    H4*    U   5           H4*        U   5  -4.366  -3.546   9.466
   48    H3*    U   5           H3*        U   5  -3.537  -2.891   6.621
   49    H2*    U   5           H2*        U   5  -1.861  -1.501   7.501
   50   2HO*    U   5          2HO*        U   5  -3.673  -1.012   9.385
   51    H1*    U   5           H1*        U   5  -1.379  -3.080   9.790
   52    H3     U   5           H3         U   5   2.451  -2.384   7.451
   53    H5     U   5           H5         U   5   0.514  -5.468   5.395
   54    H6     U   5           H6         U   5  -1.436  -5.000   6.713
   55   1H5*    G   6          1H5*        G   6  -2.822  -0.049   7.499
   56   2H5*    G   6          2H5*        G   6  -3.326   1.449   8.298
   57    H4*    G   6           H4*        G   6  -2.614   2.766   6.544
   58    H3*    G   6           H3*        G   6  -3.149   0.376   4.747
   59    H2*    G   6           H2*        G   6  -1.559   1.182   3.235
   60   2HO*    G   6          2HO*        G   6  -2.369   3.589   4.156
   61    H1*    G   6           H1*        G   6   0.194   2.255   5.155
   62    H8     G   6           H8         G   6  -1.396  -1.265   5.217
   63    H1     G   6           H1         G   6   4.668  -0.990   3.092
   64   1H2     G   6          1H2         G   6   5.198   1.172   2.666
   65   2H2     G   6          2H2         G   6   4.465   2.366   3.723
   66   1H5*    A   7          1H5*        A   7  -4.922   1.903   0.467
   67   2H5*    A   7          2H5*        A   7  -3.986   0.397   0.475
   68    H4*    A   7           H4*        A   7  -3.048   1.830  -1.208
   69    H3*    A   7           H3*        A   7  -1.382   1.796   1.332
   70    H2*    A   7           H2*        A   7   0.170   3.227   0.246
   71   2HO*    A   7          2HO*        A   7   0.577   3.085  -1.806
   72    H1*    A   7           H1*        A   7  -1.745   4.591  -1.266
   73    H8     A   7           H8         A   7  -2.928   4.705   2.242
   74   1H6     A   7          1H6         A   7   1.109   9.280   3.249
   75   2H6     A   7          2H6         A   7   0.001   8.185   4.044
   76    H2     A   7           H2         A   7   2.155   7.338  -0.673
   77   1H5*    A   8          1H5*        A   8   0.728   0.743  -1.574
   78   2H5*    A   8          2H5*        A   8   2.026  -0.465  -1.703
   79    H4*    A   8           H4*        A   8   3.026   1.689  -2.001
   80    H3*    A   8           H3*        A   8   3.456   0.593   0.793
   81    H2*    A   8           H2*        A   8   4.788   2.491   1.298
   82   2HO*    A   8          2HO*        A   8   4.704   3.171  -1.463
   83    H1*    A   8           H1*        A   8   3.185   4.299  -0.127
   84    H8     A   8           H8         A   8   0.905   2.055   1.785
   85   1H6     A   8          1H6         A   8   2.258   5.006   6.893
   86   2H6     A   8          2H6         A   8   0.765   4.861   5.992
   87    H2     A   8           H2         A   8   4.979   6.682   3.603
   88   1H5*    A   9          2H5*        A   9   8.163  -0.862  -1.943
   89   2H5*    A   9          1H5*        A   9   7.135   0.050  -0.816
   90    H4*    A   9           H4*        A   9   9.214   1.074  -2.382
   91    H3*    A   9           H3*        A   9   6.887   2.392  -0.957
   92    H2*    A   9           H2*        A   9   7.613   4.473  -1.834
   93   2HO*    A   9          2HO*        A   9   9.808   4.348  -1.491
   94    H1*    A   9           H1*        A   9   8.296   3.445  -4.342
   95    H8     A   9           H8         A   9   5.840   4.780  -2.029
   96   1H6     A   9          1H6         A   9   1.322   3.995  -5.987
   97   2H6     A   9          2H6         A   9   2.055   5.424  -5.295
   98    H2     A   9           H2         A   9   5.025   1.948  -7.729
   99   1H5*    A  10          1H5*        A  10   9.692   1.160   4.099
  100   2H5*    A  10          2H5*        A  10   8.042   1.545   3.572
  101    H4*    A  10           H4*        A  10   9.981   3.801   3.583
  102    H3*    A  10           H3*        A  10   9.031   2.378   6.069
  103    H2*    A  10           H2*        A  10   8.517   4.409   7.118
  104   2HO*    A  10          2HO*        A  10   9.179   6.422   5.913
  105    H1*    A  10           H1*        A  10   7.560   5.733   4.866
  106    H8     A  10           H8         A  10   5.861   2.728   4.191
  107   1H6     A  10          1H6         A  10   1.887   3.822   8.556
  108   2H6     A  10          2H6         A  10   2.693   2.310   8.206
  109    H2     A  10           H2         A  10   5.700   6.244   9.560
  110   1H5*    A  11          1H5*        A  11  10.362   4.623   8.721
  111   2H5*    A  11          2H5*        A  11  11.041   3.494   9.917
  112    H4*    A  11           H4*        A  11   8.748   4.554  10.443
  113    H3*    A  11           H3*        A  11   9.268   1.572  10.502
  114    H2*    A  11           H2*        A  11   7.013   1.175  11.069
  115   2HO*    A  11          2HO*        A  11   6.845   3.947  11.650
  116    H1*    A  11           H1*        A  11   5.904   3.176   9.509
  117    H8     A  11           H8         A  11   8.573   1.411   7.535
  118   1H6     A  11          1H6         A  11   4.624  -3.072   6.382
  119   2H6     A  11          2H6         A  11   5.451  -1.945   5.335
  120    H2     A  11           H2         A  11   2.602  -0.183   9.284
  121   1H5*    G  12          1H5*        G  12   9.513  -1.395  13.256
  122   2H5*    G  12          2H5*        G  12   9.294  -0.464  11.764
  123    H4*    G  12           H4*        G  12   7.200   0.124  13.695
  124    H3*    G  12           H3*        G  12   7.626  -2.760  12.909
  125    H2*    G  12           H2*        G  12   5.297  -2.979  12.520
  126   2HO*    G  12          2HO*        G  12   4.894  -0.442  13.721
  127    H1*    G  12           H1*        G  12   4.937  -0.435  11.407
  128    H8     G  12           H8         G  12   7.853  -1.286   9.563
  129    H1     G  12           H1         G  12   3.124  -5.403   8.166
  130   1H2     G  12          1H2         G  12   1.387  -5.001   9.560
  131   2H2     G  12          2H2         G  12   1.807  -4.531  11.192
  132   1H5*    G  13          1H5*        G  13   4.864  -3.101  15.889
  133   2H5*    G  13          2H5*        G  13   5.341  -4.088  17.287
  134    H4*    G  13           H4*        G  13   3.234  -4.923  16.544
  135    H3*    G  13           H3*        G  13   5.539  -6.611  15.575
  136    H2*    G  13           H2*        G  13   4.054  -8.007  14.441
  137   2HO*    G  13          2HO*        G  13   1.831  -8.031  14.805
  138    H1*    G  13           H1*        G  13   2.261  -6.052  13.628
  139    H8     G  13           H8         G  13   5.750  -4.819  13.046
  140    H1     G  13           H1         G  13   3.769  -9.069   8.649
  141   1H2     G  13          1H2         G  13   2.055 -10.254   9.515
  142   2H2     G  13          2H2         G  13   0.983  -9.402  10.603
  143   1H5*    G  14          1H5*        G  14   3.714 -10.114  18.208
  144   2H5*    G  14          2H5*        G  14   4.128  -9.173  16.766
  145    H4*    G  14           H4*        G  14   1.574 -10.769  16.852
  146    H3*    G  14           H3*        G  14   4.367 -11.818  16.341
  147    H2*    G  14           H2*        G  14   3.536 -13.112  14.549
  148   2HO*    G  14          2HO*        G  14   0.866 -12.507  14.878
  149    H1*    G  14           H1*        G  14   1.708 -11.227  13.629
  150    H8     G  14           H8         G  14   4.815  -9.348  14.384
  151    H1     G  14           H1         G  14   5.262 -12.865   9.008
  152   1H2     G  14          1H2         G  14   3.708 -14.478   9.069
  153   2H2     G  14          2H2         G  14   2.220 -14.151   9.930
  154   1H5*    C  15          1H5*        C  15   1.890 -14.827  16.259
  155   2H5*    C  15          2H5*        C  15   2.222 -16.252  17.272
  156    H4*    C  15           H4*        C  15   1.855 -17.074  15.053
  157    H3*    C  15           H3*        C  15   4.809 -16.917  15.727
  158    H2*    C  15           H2*        C  15   5.285 -17.845  13.614
  159   2HO*    C  15          2HO*        C  15   2.537 -18.552  13.379
  160    H1*    C  15           H1*        C  15   3.120 -16.627  12.285
  161   1H4     C  15          1H4         C  15   8.382 -13.664  10.361
  162   2H4     C  15          2H4         C  15   8.579 -12.899  11.924
  163    H5     C  15           H5         C  15   6.820 -13.054  13.626
  164    H6     C  15           H6         C  15   4.888 -14.287  14.347
  165   2H    ASP   2          2H        ASP   2  10.558 -13.083  -0.673
  166   1H    ASP   2          1H        ASP   2  10.285 -14.026   0.713
  167   3H    ASP   2          3H        ASP   2  11.666 -13.042   0.610
  168    HA   ASP   2           HA       ASP   2  10.266 -11.793   1.973
  169   1HB   ASP   2          1HB       ASP   2   9.634 -10.917  -0.858
  170   2HB   ASP   2          2HB       ASP   2   9.780  -9.891   0.568
  171    H    ALA   3           H        ALA   3   7.959 -10.408   1.248
  172    HA   ALA   3           HA       ALA   3   5.790 -12.076   0.352
  173   1HB   ALA   3          1HB       ALA   3   6.389 -11.917   3.315
  174   2HB   ALA   3          2HB       ALA   3   4.816 -12.405   2.685
  175   3HB   ALA   3          3HB       ALA   3   6.247 -13.370   2.326
  176    H    GLN   4           H        GLN   4   6.833  -9.389   2.405
  177    HA   GLN   4           HA       GLN   4   4.273  -8.035   2.420
  178   1HB   GLN   4          1HB       GLN   4   6.256  -7.777   4.016
  179   2HB   GLN   4          2HB       GLN   4   7.063  -6.877   2.735
  180   1HG   GLN   4          1HG       GLN   4   4.350  -5.913   3.193
  181   2HG   GLN   4          2HG       GLN   4   5.334  -5.817   4.649
  182   1HE2  GLN   4          2HE2      GLN   4   4.540  -4.090   1.888
  183   2HE2  GLN   4          1HE2      GLN   4   5.909  -3.090   1.795
  184    H    THR   5           H        THR   5   7.314  -7.310   0.687
  185    HA   THR   5           HA       THR   5   6.296  -5.340  -1.084
  186    HB   THR   5           HB       THR   5   8.354  -7.550  -1.484
  187    HG1  THR   5           HG1      THR   5   8.576  -4.822  -0.742
  188   1HG2  THR   5          1HG2      THR   5   7.863  -5.013  -3.067
  189   2HG2  THR   5          2HG2      THR   5   9.267  -6.064  -3.261
  190   3HG2  THR   5          3HG2      THR   5   7.654  -6.666  -3.647
  191    H    ARG   6           H        ARG   6   6.004  -8.823  -1.016
  192    HA   ARG   6           HA       ARG   6   4.839  -9.180  -3.647
  193   1HB   ARG   6          1HB       ARG   6   5.504 -10.699  -1.249
  194   2HB   ARG   6          2HB       ARG   6   3.935 -11.180  -1.902
  195   1HG   ARG   6          1HG       ARG   6   4.974 -12.356  -3.521
  196   2HG   ARG   6          2HG       ARG   6   5.731 -10.876  -4.108
  197   1HD   ARG   6          1HD       ARG   6   7.602 -12.206  -3.584
  198   2HD   ARG   6          2HD       ARG   6   7.391 -11.280  -2.084
  199    HE   ARG   6           HE       ARG   6   5.727 -13.465  -1.739
  200   1HH1  ARG   6          1HH1      ARG   6   9.074 -13.019  -2.539
  201   2HH1  ARG   6          2HH1      ARG   6   9.569 -14.505  -1.801
  202   1HH2  ARG   6          1HH2      ARG   6   6.381 -15.393  -0.784
  203   2HH2  ARG   6          2HH2      ARG   6   8.053 -15.842  -0.813
  204    H    ARG   7           H        ARG   7   3.564  -8.969  -0.314
  205    HA   ARG   7           HA       ARG   7   0.835  -9.283  -1.009
  206   1HB   ARG   7          1HB       ARG   7   1.609  -9.415   1.280
  207   2HB   ARG   7          2HB       ARG   7   2.234  -7.766   1.217
  208   1HG   ARG   7          1HG       ARG   7  -0.168  -7.013   0.744
  209   2HG   ARG   7          2HG       ARG   7  -0.665  -8.649   1.171
  210   1HD   ARG   7          1HD       ARG   7  -0.271  -8.316   3.398
  211   2HD   ARG   7          2HD       ARG   7   1.147  -7.297   3.105
  212    HE   ARG   7           HE       ARG   7  -0.297  -5.425   3.046
  213   1HH1  ARG   7          1HH1      ARG   7  -2.078  -8.369   2.648
  214   2HH1  ARG   7          2HH1      ARG   7  -3.613  -7.574   2.707
  215   1HH2  ARG   7          1HH2      ARG   7  -2.260  -4.405   3.123
  216   2HH2  ARG   7          2HH2      ARG   7  -3.717  -5.326   2.976
  217    H    ARG   8           H        ARG   8   2.963  -6.484  -1.063
  218    HA   ARG   8           HA       ARG   8   1.104  -4.364  -1.382
  219   1HB   ARG   8          1HB       ARG   8   3.845  -4.758  -1.405
  220   2HB   ARG   8          2HB       ARG   8   3.540  -4.338  -3.083
  221   1HG   ARG   8          1HG       ARG   8   4.051  -2.357  -1.641
  222   2HG   ARG   8          2HG       ARG   8   2.485  -2.256  -2.438
  223   1HD   ARG   8          1HD       ARG   8   2.740  -1.718   0.170
  224   2HD   ARG   8          2HD       ARG   8   1.306  -2.550  -0.449
  225    HE   ARG   8           HE       ARG   8   3.480  -4.384   0.216
  226   1HH1  ARG   8          1HH1      ARG   8   0.747  -2.620   1.409
  227   2HH1  ARG   8          2HH1      ARG   8   0.477  -3.700   2.728
  228   1HH2  ARG   8          1HH2      ARG   8   3.122  -5.778   1.926
  229   2HH2  ARG   8          2HH2      ARG   8   1.815  -5.481   3.022
  230    H    GLU   9           H        GLU   9   2.445  -6.627  -3.755
  231    HA   GLU   9           HA       GLU   9   1.207  -5.464  -6.064
  232   1HB   GLU   9          1HB       GLU   9   1.819  -8.378  -5.428
  233   2HB   GLU   9          2HB       GLU   9   1.618  -7.697  -7.043
  234   1HG   GLU   9          1HG       GLU   9   3.536  -6.041  -6.005
  235   2HG   GLU   9          2HG       GLU   9   3.940  -7.570  -5.222
  236    H    ARG  10           H        ARG  10   0.125  -7.566  -3.502
  237    HA   ARG  10           HA       ARG  10  -2.484  -8.129  -4.677
  238   1HB   ARG  10          1HB       ARG  10  -0.854  -8.903  -2.417
  239   2HB   ARG  10          2HB       ARG  10  -2.468  -8.467  -1.858
  240   1HG   ARG  10          1HG       ARG  10  -3.457 -10.236  -2.919
  241   2HG   ARG  10          2HG       ARG  10  -2.364 -10.147  -4.301
  242   1HD   ARG  10          1HD       ARG  10  -0.540 -11.019  -2.673
  243   2HD   ARG  10          2HD       ARG  10  -1.900 -11.481  -1.629
  244    HE   ARG  10           HE       ARG  10  -2.634 -12.407  -4.144
  245   1HH1  ARG  10          1HH1      ARG  10   0.096 -12.814  -2.038
  246   2HH1  ARG  10          2HH1      ARG  10   0.443 -14.412  -2.606
  247   1HH2  ARG  10          1HH2      ARG  10  -2.172 -14.484  -4.874
  248   2HH2  ARG  10          2HH2      ARG  10  -0.832 -15.353  -4.203
  249    H    ARG  11           H        ARG  11  -0.981  -5.499  -3.075
  250    HA   ARG  11           HA       ARG  11  -3.559  -4.412  -2.088
  251   1HB   ARG  11          1HB       ARG  11  -0.670  -3.503  -1.911
  252   2HB   ARG  11          2HB       ARG  11  -2.034  -2.664  -1.172
  253   1HG   ARG  11          1HG       ARG  11  -1.082  -5.481  -0.540
  254   2HG   ARG  11          2HG       ARG  11  -0.984  -4.090   0.519
  255   1HD   ARG  11          1HD       ARG  11  -3.105  -4.443   1.248
  256   2HD   ARG  11          2HD       ARG  11  -3.720  -4.481  -0.406
  257    HE   ARG  11           HE       ARG  11  -2.205  -6.875   0.291
  258   1HH1  ARG  11          1HH1      ARG  11  -5.306  -5.306   0.369
  259   2HH1  ARG  11          2HH1      ARG  11  -6.186  -6.792   0.445
  260   1HH2  ARG  11          1HH2      ARG  11  -3.366  -8.798   0.390
  261   2HH2  ARG  11          2HH2      ARG  11  -5.096  -8.760   0.457
  262    H    ALA  12           H        ALA  12  -2.029  -4.529  -5.027
  263    HA   ALA  12           HA       ALA  12  -1.909  -1.827  -5.941
  264   1HB   ALA  12          1HB       ALA  12  -1.240  -3.952  -7.155
  265   2HB   ALA  12          2HB       ALA  12  -2.952  -4.275  -7.428
  266   3HB   ALA  12          3HB       ALA  12  -2.198  -2.852  -8.145
  267    H    GLU  13           H        GLU  13  -4.607  -3.926  -5.189
  268    HA   GLU  13           HA       GLU  13  -6.654  -2.282  -6.455
  269   1HB   GLU  13          1HB       GLU  13  -6.698  -4.443  -4.316
  270   2HB   GLU  13          2HB       GLU  13  -8.137  -3.794  -5.103
  271   1HG   GLU  13          1HG       GLU  13  -7.827  -5.101  -6.914
  272   2HG   GLU  13          2HG       GLU  13  -6.148  -4.583  -7.071
  273    H    LYS  14           H        LYS  14  -5.111  -2.548  -3.276
  274    HA   LYS  14           HA       LYS  14  -6.921  -0.624  -1.998
  275   1HB   LYS  14          1HB       LYS  14  -4.176  -1.735  -1.268
  276   2HB   LYS  14          2HB       LYS  14  -5.247  -0.867  -0.163
  277   1HG   LYS  14          1HG       LYS  14  -6.059  -3.410  -1.590
  278   2HG   LYS  14          2HG       LYS  14  -5.331  -3.398   0.016
  279   1HD   LYS  14          1HD       LYS  14  -7.175  -2.366   0.997
  280   2HD   LYS  14          2HD       LYS  14  -7.716  -1.656  -0.526
  281   1HE   LYS  14          1HE       LYS  14  -8.468  -3.818  -1.342
  282   2HE   LYS  14          2HE       LYS  14  -7.771  -4.637   0.070
  283   1HZ   LYS  14          1HZ       LYS  14  -9.180  -3.196   1.480
  284   2HZ   LYS  14          2HZ       LYS  14  -9.935  -2.601   0.083
  285   3HZ   LYS  14          3HZ       LYS  14 -10.083  -4.243   0.492
  286    H    GLN  15           H        GLN  15  -3.793  -0.709  -3.537
  287    HA   GLN  15           HA       GLN  15  -2.946   1.989  -3.032
  288   1HB   GLN  15          1HB       GLN  15  -2.184  -0.431  -4.482
  289   2HB   GLN  15          2HB       GLN  15  -1.794   1.007  -5.410
  290   1HG   GLN  15          1HG       GLN  15  -0.287   1.784  -3.823
  291   2HG   GLN  15          2HG       GLN  15  -1.121   0.970  -2.499
  292   1HE2  GLN  15          2HE2      GLN  15  -1.063  -1.540  -2.669
  293   2HE2  GLN  15          1HE2      GLN  15   0.404  -2.230  -3.180
  294    H    ALA  16           H        ALA  16  -4.399   0.404  -5.883
  295    HA   ALA  16           HA       ALA  16  -4.606   2.808  -7.457
  296   1HB   ALA  16          1HB       ALA  16  -6.131   0.176  -7.463
  297   2HB   ALA  16          2HB       ALA  16  -6.230   1.373  -8.754
  298   3HB   ALA  16          3HB       ALA  16  -4.700   0.562  -8.419
  299    H    GLN  17           H        GLN  17  -6.604   1.407  -4.923
  300    HA   GLN  17           HA       GLN  17  -8.922   3.116  -5.498
  301   1HB   GLN  17          1HB       GLN  17  -8.009   1.247  -3.303
  302   2HB   GLN  17          2HB       GLN  17  -9.464   2.219  -3.104
  303   1HG   GLN  17          1HG       GLN  17 -10.501   1.211  -5.016
  304   2HG   GLN  17          2HG       GLN  17  -8.998   0.422  -5.492
  305   1HE2  GLN  17          2HE2      GLN  17  -9.763  -1.765  -5.278
  306   2HE2  GLN  17          1HE2      GLN  17 -10.202  -2.434  -3.781
  307    H    TRP  18           H        TRP  18  -6.132   3.071  -3.381
  308    HA   TRP  18           HA       TRP  18  -6.821   5.494  -1.910
  309   1HB   TRP  18          1HB       TRP  18  -5.377   3.743  -0.977
  310   2HB   TRP  18          2HB       TRP  18  -4.288   3.875  -2.343
  311    HD1  TRP  18           HD1      TRP  18  -5.095   5.545   0.953
  312    HE1  TRP  18           HE1      TRP  18  -3.427   7.488   1.317
  313    HE3  TRP  18           HE3      TRP  18  -2.856   5.622  -3.561
  314    HZ2  TRP  18           HZ2      TRP  18  -1.383   8.868  -0.144
  315    HZ3  TRP  18           HZ3      TRP  18  -1.079   7.204  -4.072
  316    HH2  TRP  18           HH2      TRP  18  -0.318   8.813  -2.392
  317    H    LYS  19           H        LYS  19  -4.578   4.604  -4.484
  318    HA   LYS  19           HA       LYS  19  -3.399   7.146  -4.960
  319   1HB   LYS  19          1HB       LYS  19  -3.903   4.674  -6.634
  320   2HB   LYS  19          2HB       LYS  19  -3.031   6.062  -7.265
  321   1HG   LYS  19          1HG       LYS  19  -1.418   5.885  -5.384
  322   2HG   LYS  19          2HG       LYS  19  -2.252   4.430  -4.841
  323   1HD   LYS  19          1HD       LYS  19  -0.531   3.539  -6.147
  324   2HD   LYS  19          2HD       LYS  19  -1.867   3.610  -7.297
  325   1HE   LYS  19          1HE       LYS  19  -1.028   5.709  -8.220
  326   2HE   LYS  19          2HE       LYS  19   0.257   5.764  -6.997
  327   1HZ   LYS  19          1HZ       LYS  19   1.042   3.609  -7.797
  328   2HZ   LYS  19          2HZ       LYS  19  -0.153   3.606  -9.001
  329   3HZ   LYS  19          3HZ       LYS  19   1.083   4.771  -9.037
  330    H    ALA  20           H        ALA  20  -6.351   5.607  -6.122
  331    HA   ALA  20           HA       ALA  20  -7.002   7.482  -8.149
  332   1HB   ALA  20          1HB       ALA  20  -8.347   5.450  -6.479
  333   2HB   ALA  20          2HB       ALA  20  -9.407   6.671  -7.179
  334   3HB   ALA  20          3HB       ALA  20  -8.399   5.673  -8.228
  335    H    ALA  21           H        ALA  21  -7.324   7.576  -4.657
  336    HA   ALA  21           HA       ALA  21  -8.541  10.296  -4.883
  337   1HB   ALA  21          1HB       ALA  21  -8.871   8.072  -2.857
  338   2HB   ALA  21          2HB       ALA  21  -9.500   9.699  -2.602
  339   3HB   ALA  21          3HB       ALA  21 -10.106   8.719  -3.936
  340    H    ASN  22           H        ASN  22  -5.700   9.455  -4.790
  341    HA   ASN  22           HA       ASN  22  -4.844  11.355  -2.705
  342   1HB   ASN  22          1HB       ASN  22  -4.046   8.433  -2.700
  343   2HB   ASN  22          2HB       ASN  22  -3.273   9.677  -1.724
  344   1HD2  ASN  22          2HD2      ASN  22  -5.532   7.308  -1.497
  345   2HD2  ASN  22          1HD2      ASN  22  -6.523   7.950  -0.278
  346    HA   PRO  23           HA       PRO  23  -2.165  10.858  -6.563
  347   1HB   PRO  23          1HB       PRO  23  -2.945  13.144  -7.861
  348   2HB   PRO  23          2HB       PRO  23  -3.715  11.569  -8.146
  349   1HG   PRO  23          1HG       PRO  23  -4.636  13.853  -6.477
  350   2HG   PRO  23          2HG       PRO  23  -5.572  12.750  -7.500
  351   1HD   PRO  23          1HD       PRO  23  -5.417  12.525  -4.784
  352   2HD   PRO  23          2HD       PRO  23  -5.716  11.148  -5.857
  353    H    LEU  24           H        LEU  24  -3.265  13.434  -4.475
  354    HA   LEU  24           HA       LEU  24  -1.125  15.294  -4.678
  355   1HB   LEU  24          1HB       LEU  24  -2.124  16.193  -2.759
  356   2HB   LEU  24          2HB       LEU  24  -3.434  15.162  -3.324
  357    HG   LEU  24           HG       LEU  24  -1.362  14.194  -1.329
  358   1HD1  LEU  24          1HD1      LEU  24  -3.852  15.813  -0.936
  359   2HD1  LEU  24          2HD1      LEU  24  -3.416  14.600   0.268
  360   3HD1  LEU  24          3HD1      LEU  24  -2.304  15.920  -0.097
  361   1HD2  LEU  24          1HD2      LEU  24  -3.318  12.835  -2.770
  362   2HD2  LEU  24          2HD2      LEU  24  -2.581  12.268  -1.273
  363   3HD2  LEU  24          3HD2      LEU  24  -4.108  13.149  -1.228
  364    H    LEU  25           H        LEU  25  -1.430  12.242  -2.977
  365    HA   LEU  25           HA       LEU  25   1.346  12.445  -1.929
  366   1HB   LEU  25          1HB       LEU  25  -1.168  10.928  -1.340
  367   2HB   LEU  25          2HB       LEU  25   0.358  10.119  -0.975
  368    HG   LEU  25           HG       LEU  25  -0.048  12.955  -0.073
  369   1HD1  LEU  25          1HD1      LEU  25  -1.539  10.588   0.851
  370   2HD1  LEU  25          2HD1      LEU  25  -0.707  11.455   2.142
  371   3HD1  LEU  25          3HD1      LEU  25  -1.868  12.299   1.118
  372   1HD2  LEU  25          1HD2      LEU  25   1.439  10.559   1.053
  373   2HD2  LEU  25          2HD2      LEU  25   2.164  11.880   0.136
  374   3HD2  LEU  25          3HD2      LEU  25   1.468  12.189   1.726
  375    H    VAL  26           H        VAL  26   0.583  12.169  -4.712
  376    HA   VAL  26           HA       VAL  26   2.093   9.721  -5.401
  377    HB   VAL  26           HB       VAL  26  -0.796  10.163  -5.555
  378   1HG1  VAL  26          1HG1      VAL  26   0.697   9.645  -8.141
  379   2HG1  VAL  26          2HG1      VAL  26  -0.975   9.140  -7.896
  380   3HG1  VAL  26          3HG1      VAL  26  -0.552  10.852  -7.822
  381   1HG2  VAL  26          1HG2      VAL  26   0.348   8.170  -4.653
  382   2HG2  VAL  26          2HG2      VAL  26  -0.745   7.731  -5.967
  383   3HG2  VAL  26          3HG2      VAL  26   0.997   7.813  -6.255
  384    H    GLY  27           H        GLY  27   3.694  10.583  -6.666
  385   1HA   GLY  27          1HA       GLY  27   4.667  11.755  -8.480
  386   2HA   GLY  27          2HA       GLY  27   3.036  12.163  -9.025
  387    H    VAL  28           H        VAL  28   1.899  13.661  -7.199
  388    HA   VAL  28           HA       VAL  28   3.177  16.201  -7.259
  389    HB   VAL  28           HB       VAL  28   1.014  15.027  -5.489
  390   1HG1  VAL  28          1HG1      VAL  28   2.396  17.511  -5.228
  391   2HG1  VAL  28          2HG1      VAL  28   0.788  17.868  -5.863
  392   3HG1  VAL  28          3HG1      VAL  28   0.961  16.972  -4.354
  393   1HG2  VAL  28          1HG2      VAL  28   1.104  16.373  -8.170
  394   2HG2  VAL  28          2HG2      VAL  28   0.152  14.982  -7.652
  395   3HG2  VAL  28          3HG2      VAL  28  -0.313  16.606  -7.148
  396    H    SER  29           H        SER  29   4.395  17.302  -5.683
  397    HA   SER  29           HA       SER  29   5.978  17.482  -3.945
  398   1HB   SER  29          1HB       SER  29   3.912  15.723  -2.596
  399   2HB   SER  29          2HB       SER  29   5.041  16.812  -1.794
  400    HG   SER  29           HG       SER  29   2.748  17.521  -2.325
  401    H    ALA  30           H        ALA  30   6.918  15.813  -2.024
  402    HA   ALA  30           HA       ALA  30   8.437  14.027  -1.714
  403   1HB   ALA  30          1HB       ALA  30   6.255  12.758  -3.401
  404   2HB   ALA  30          2HB       ALA  30   7.464  11.853  -2.489
  405   3HB   ALA  30          3HB       ALA  30   6.290  12.859  -1.640
  406    H    LYS  31           H        LYS  31   9.644  15.569  -3.474
  407    HA   LYS  31           HA       LYS  31  10.547  13.713  -5.641
  408   1HB   LYS  31          1HB       LYS  31   9.560  16.554  -5.764
  409   2HB   LYS  31          2HB       LYS  31  10.717  15.979  -6.966
  410   1HG   LYS  31          1HG       LYS  31   8.645  14.006  -6.625
  411   2HG   LYS  31          2HG       LYS  31   7.907  15.576  -6.942
  412   1HD   LYS  31          1HD       LYS  31   8.313  14.579  -9.084
  413   2HD   LYS  31          2HD       LYS  31   9.544  15.825  -8.874
  414   1HE   LYS  31          1HE       LYS  31  10.804  13.966  -9.616
  415   2HE   LYS  31          2HE       LYS  31  10.969  13.859  -7.852
  416   1HZ   LYS  31          1HZ       LYS  31   8.990  12.430  -7.822
  417   2HZ   LYS  31          2HZ       LYS  31   8.942  12.464  -9.520
  418   3HZ   LYS  31          3HZ       LYS  31  10.253  11.737  -8.718
  419    HA   PRO  32           HA       PRO  32  14.060  15.606  -3.292
  420   1HB   PRO  32          1HB       PRO  32  15.203  13.275  -2.447
  421   2HB   PRO  32          2HB       PRO  32  13.925  14.105  -1.539
  422   1HG   PRO  32          1HG       PRO  32  13.774  11.679  -3.220
  423   2HG   PRO  32          2HG       PRO  32  12.827  12.132  -1.798
  424   1HD   PRO  32          1HD       PRO  32  11.987  12.310  -4.454
  425   2HD   PRO  32          2HD       PRO  32  11.219  13.102  -3.064
  426    H    VAL  33           H        VAL  33  15.790  16.114  -4.589
  427    HA   VAL  33           HA       VAL  33  16.814  14.018  -6.476
  428    HB   VAL  33           HB       VAL  33  17.121  15.869  -8.102
  429   1HG1  VAL  33          1HG1      VAL  33  14.446  15.205  -6.950
  430   2HG1  VAL  33          2HG1      VAL  33  14.528  16.491  -8.154
  431   3HG1  VAL  33          3HG1      VAL  33  15.092  14.868  -8.555
  432   1HG2  VAL  33          1HG2      VAL  33  15.904  17.498  -5.858
  433   2HG2  VAL  33          2HG2      VAL  33  17.444  17.766  -6.673
  434   3HG2  VAL  33          3HG2      VAL  33  15.930  18.054  -7.531
  435    H    ASN  34           H        ASN  34  18.945  13.600  -6.059
  436    HA   ASN  34           HA       ASN  34  20.738  15.833  -5.255
  437   1HB   ASN  34          1HB       ASN  34  19.992  13.391  -3.658
  438   2HB   ASN  34          2HB       ASN  34  21.571  14.144  -3.433
  439   1HD2  ASN  34          2HD2      ASN  34  21.659  16.058  -2.187
  440   2HD2  ASN  34          1HD2      ASN  34  20.288  16.855  -1.581
  441    H    ARG  35           H        ARG  35  20.853  14.721  -7.732
  442    HA   ARG  35           HA       ARG  35  22.571  12.375  -7.883
  443   1HB   ARG  35          1HB       ARG  35  21.205  14.298  -9.650
  444   2HB   ARG  35          2HB       ARG  35  22.717  13.674 -10.307
  445   1HG   ARG  35          1HG       ARG  35  21.902  11.552 -10.526
  446   2HG   ARG  35          2HG       ARG  35  20.949  11.658  -9.045
  447   1HD   ARG  35          1HD       ARG  35  19.164  11.804 -10.470
  448   2HD   ARG  35          2HD       ARG  35  19.679  13.491 -10.675
  449    HE   ARG  35           HE       ARG  35  20.481  12.916 -12.817
  450   1HH1  ARG  35          1HH1      ARG  35  20.131  10.097 -10.823
  451   2HH1  ARG  35          2HH1      ARG  35  20.537   8.999 -12.098
  452   1HH2  ARG  35          1HH2      ARG  35  21.009  11.480 -14.468
  453   2HH2  ARG  35          2HH2      ARG  35  21.032   9.778 -14.152
  454    HA   PRO  36           HA       PRO  36  25.968  15.555  -8.926
  455   1HB   PRO  36          1HB       PRO  36  25.428  18.221  -8.649
  456   2HB   PRO  36          2HB       PRO  36  25.131  17.328 -10.153
  457   1HG   PRO  36          1HG       PRO  36  23.219  18.181  -8.050
  458   2HG   PRO  36          2HG       PRO  36  23.004  18.089  -9.804
  459   1HD   PRO  36          1HD       PRO  36  22.042  16.235  -8.020
  460   2HD   PRO  36          2HD       PRO  36  22.373  15.903  -9.733
  Start of MODEL   21
    1   1H5*    G   1          1H5*        G   1  12.397 -14.859   2.061
    2   2H5*    G   1          2H5*        G   1  13.426 -15.009   3.503
    3    H4*    G   1           H4*        G   1  12.121 -17.531   2.917
    4    H3*    G   1           H3*        G   1  10.353 -15.075   3.131
    5    H2*    G   1           H2*        G   1   8.910 -16.233   4.604
    6   2HO*    G   1          2HO*        G   1  10.127 -18.709   4.435
    7    H1*    G   1           H1*        G   1  10.884 -17.664   5.939
    8    H8     G   1           H8         G   1  11.932 -14.077   5.494
    9    H1     G   1           H1         G   1   7.607 -14.949  10.162
   10   1H2     G   1          1H2         G   1   6.861 -17.023  10.131
   11   2H2     G   1          2H2         G   1   7.286 -18.142   8.856
   12   1H5*    C   2          1H5*        C   2   7.356 -18.383   2.865
   13   2H5*    C   2          2H5*        C   2   6.642 -17.945   1.296
   14    H4*    C   2           H4*        C   2   4.842 -18.308   2.869
   15    H3*    C   2           H3*        C   2   5.380 -15.378   2.279
   16    H2*    C   2           H2*        C   2   3.621 -14.781   3.721
   17   2HO*    C   2          2HO*        C   2   2.001 -16.135   3.050
   18    H1*    C   2           H1*        C   2   4.031 -16.834   5.588
   19   1H4     C   2          1H4         C   2   6.476 -11.748   8.445
   20   2H4     C   2          2H4         C   2   7.802 -11.678   7.310
   21    H5     C   2           H5         C   2   7.997 -13.210   5.433
   22    H6     C   2           H6         C   2   6.947 -15.043   4.241
   23   1H5*    C   3          1H5*        C   3   0.471 -13.686   1.462
   24   2H5*    C   3          2H5*        C   3   2.081 -13.173   2.013
   25    H4*    C   3           H4*        C   3   0.176 -14.744   3.762
   26    H3*    C   3           H3*        C   3   0.433 -11.750   3.400
   27    H2*    C   3           H2*        C   3   0.241 -11.441   5.729
   28   2HO*    C   3          2HO*        C   3  -1.448 -12.669   6.325
   29    H1*    C   3           H1*        C   3   1.670 -13.713   6.485
   30   1H4     C   3          1H4         C   3   5.612  -8.712   6.999
   31   2H4     C   3          2H4         C   3   6.114  -8.949   5.340
   32    H5     C   3           H5         C   3   5.208 -10.719   3.948
   33    H6     C   3           H6         C   3   3.513 -12.461   3.783
   34   1H5*    C   4          1H5*        C   4  -3.299 -11.767   5.610
   35   2H5*    C   4          2H5*        C   4  -4.331 -10.561   4.810
   36    H4*    C   4           H4*        C   4  -3.870 -10.022   7.201
   37    H3*    C   4           H3*        C   4  -2.710  -8.113   5.136
   38    H2*    C   4           H2*        C   4  -1.958  -6.762   6.883
   39   2HO*    C   4          2HO*        C   4  -2.947  -6.579   8.728
   40    H1*    C   4           H1*        C   4  -1.322  -8.878   8.615
   41   1H4     C   4          1H4         C   4   3.820  -6.339   5.647
   42   2H4     C   4          2H4         C   4   4.215  -8.008   5.318
   43    H5     C   4           H5         C   4   1.906  -8.965   4.408
   44    H6     C   4           H6         C   4  -0.226  -9.587   5.275
   45   1H5*    U   5          1H5*        U   5  -5.032  -4.832   6.257
   46   2H5*    U   5          2H5*        U   5  -3.659  -5.931   6.376
   47    H4*    U   5           H4*        U   5  -4.138  -4.214   8.753
   48    H3*    U   5           H3*        U   5  -3.169  -3.108   6.086
   49    H2*    U   5           H2*        U   5  -1.583  -1.826   7.261
   50   2HO*    U   5          2HO*        U   5  -1.904  -2.021   9.764
   51    H1*    U   5           H1*        U   5  -1.145  -3.728   9.293
   52    H3     U   5           H3         U   5   2.692  -2.636   7.022
   53    H5     U   5           H5         U   5   0.902  -5.697   4.803
   54    H6     U   5           H6         U   5  -1.067  -5.389   6.137
   55   1H5*    G   6          1H5*        G   6  -2.432  -0.539   7.005
   56   2H5*    G   6          2H5*        G   6  -2.741   0.928   7.947
   57    H4*    G   6           H4*        G   6  -2.484   2.305   6.014
   58    H3*    G   6           H3*        G   6  -2.476  -0.302   4.453
   59    H2*    G   6           H2*        G   6  -1.105   0.734   2.849
   60   2HO*    G   6          2HO*        G   6  -1.948   2.718   2.502
   61    H1*    G   6           H1*        G   6   0.459   2.108   4.690
   62    H8     G   6           H8         G   6  -0.789  -1.525   5.051
   63    H1     G   6           H1         G   6   5.143  -0.896   2.669
   64   1H2     G   6          1H2         G   6   5.446   1.275   2.065
   65   2H2     G   6          2H2         G   6   4.715   2.451   3.141
   66   1H5*    A   7          1H5*        A   7  -4.674   2.082   0.908
   67   2H5*    A   7          2H5*        A   7  -3.413   1.179   1.754
   68    H4*    A   7           H4*        A   7  -3.126   2.266  -0.725
   69    H3*    A   7           H3*        A   7  -0.975   1.915   1.398
   70    H2*    A   7           H2*        A   7   0.529   3.044  -0.042
   71   2HO*    A   7          2HO*        A   7  -0.667   3.461  -2.284
   72    H1*    A   7           H1*        A   7  -1.379   4.729  -1.163
   73    H8     A   7           H8         A   7  -1.572   4.791   2.588
   74   1H6     A   7          1H6         A   7   3.266   8.233   2.865
   75   2H6     A   7          2H6         A   7   1.640   8.832   3.109
   76    H2     A   7           H2         A   7   2.615   7.209  -1.637
   77   1H5*    A   8          1H5*        A   8   0.903   0.884  -1.972
   78   2H5*    A   8          2H5*        A   8   2.082  -0.425  -1.740
   79    H4*    A   8           H4*        A   8   3.136   1.732  -2.388
   80    H3*    A   8           H3*        A   8   3.695   0.638   0.394
   81    H2*    A   8           H2*        A   8   5.139   2.454   0.835
   82   2HO*    A   8          2HO*        A   8   5.847   3.845  -0.805
   83    H1*    A   8           H1*        A   8   3.597   4.366  -0.498
   84    H8     A   8           H8         A   8   1.292   2.182   1.495
   85   1H6     A   8          1H6         A   8   2.734   5.609   6.454
   86   2H6     A   8          2H6         A   8   1.689   4.352   5.832
   87    H2     A   8           H2         A   8   5.616   6.634   3.176
   88   1H5*    A   9          2H5*        A   9   7.951  -1.398  -2.480
   89   2H5*    A   9          1H5*        A   9   7.090  -0.324  -1.357
   90    H4*    A   9           H4*        A   9   9.286   0.347  -2.945
   91    H3*    A   9           H3*        A   9   7.202   1.997  -1.495
   92    H2*    A   9           H2*        A   9   8.087   3.957  -2.471
   93   2HO*    A   9          2HO*        A   9  10.331   2.354  -3.132
   94    H1*    A   9           H1*        A   9   8.622   2.822  -4.965
   95    H8     A   9           H8         A   9   6.392   4.502  -2.689
   96   1H6     A   9          1H6         A   9   2.110   4.695  -7.025
   97   2H6     A   9          2H6         A   9   2.133   4.594  -5.279
   98    H2     A   9           H2         A   9   5.060   1.411  -8.153
   99   1H5*    A  10          1H5*        A  10   9.961   0.902   3.473
  100   2H5*    A  10          2H5*        A  10   8.280   1.349   3.141
  101    H4*    A  10           H4*        A  10  10.353   3.514   3.301
  102    H3*    A  10           H3*        A  10   9.180   1.960   5.608
  103    H2*    A  10           H2*        A  10   8.777   3.932   6.817
  104   2HO*    A  10          2HO*        A  10   9.725   5.897   6.287
  105    H1*    A  10           H1*        A  10   8.026   5.515   4.654
  106    H8     A  10           H8         A  10   6.189   2.632   3.714
  107   1H6     A  10          1H6         A  10   2.514   2.646   6.931
  108   2H6     A  10          2H6         A  10   2.354   3.299   8.546
  109    H2     A  10           H2         A  10   5.942   5.902   9.236
  110   1H5*    A  11          1H5*        A  11  10.331   4.689   8.751
  111   2H5*    A  11          2H5*        A  11  11.068   3.405   9.737
  112    H4*    A  11           H4*        A  11   8.710   4.321  10.390
  113    H3*    A  11           H3*        A  11   9.439   1.389  10.182
  114    H2*    A  11           H2*        A  11   7.234   0.792  10.739
  115   2HO*    A  11          2HO*        A  11   6.582   3.461  11.387
  116    H1*    A  11           H1*        A  11   5.964   2.858   9.377
  117    H8     A  11           H8         A  11   8.708   1.322   7.269
  118   1H6     A  11          1H6         A  11   4.916  -3.235   5.910
  119   2H6     A  11          2H6         A  11   5.697  -2.034   4.913
  120    H2     A  11           H2         A  11   2.778  -0.544   8.916
  121   1H5*    G  12          1H5*        G  12   8.866  -1.586  13.449
  122   2H5*    G  12          2H5*        G  12   8.828  -0.783  11.869
  123    H4*    G  12           H4*        G  12   6.645   0.091  13.602
  124    H3*    G  12           H3*        G  12   6.947  -2.860  12.997
  125    H2*    G  12           H2*        G  12   4.667  -2.991  12.416
  126   2HO*    G  12          2HO*        G  12   3.281  -1.912  13.540
  127    H1*    G  12           H1*        G  12   4.511  -0.491  11.177
  128    H8     G  12           H8         G  12   7.500  -1.453   9.576
  129    H1     G  12           H1         G  12   2.857  -5.611   8.024
  130   1H2     G  12          1H2         G  12   1.020  -5.124   9.276
  131   2H2     G  12          2H2         G  12   1.354  -4.641  10.924
  132   1H5*    G  13          1H5*        G  13   4.265  -3.427  16.326
  133   2H5*    G  13          2H5*        G  13   4.936  -4.658  17.413
  134    H4*    G  13           H4*        G  13   2.766  -5.346  16.470
  135    H3*    G  13           H3*        G  13   5.195  -6.853  15.451
  136    H2*    G  13           H2*        G  13   3.811  -8.173  14.133
  137   2HO*    G  13          2HO*        G  13   1.379  -7.226  15.039
  138    H1*    G  13           H1*        G  13   1.964  -6.177  13.491
  139    H8     G  13           H8         G  13   5.308  -4.707  12.889
  140    H1     G  13           H1         G  13   3.712  -9.148   8.526
  141   1H2     G  13          1H2         G  13   1.626  -9.956   9.114
  142   2H2     G  13          2H2         G  13   1.519 -10.293  10.828
  143   1H5*    G  14          1H5*        G  14   0.183  -8.970  16.429
  144   2H5*    G  14          2H5*        G  14   0.443  -9.857  17.947
  145    H4*    G  14           H4*        G  14  -0.269 -11.506  16.394
  146    H3*    G  14           H3*        G  14   2.760 -11.536  16.490
  147    H2*    G  14           H2*        G  14   2.681 -13.372  14.985
  148   2HO*    G  14          2HO*        G  14  -0.070 -13.494  15.664
  149    H1*    G  14           H1*        G  14   0.573 -12.362  13.460
  150    H8     G  14           H8         G  14   3.291  -9.871  14.483
  151    H1     G  14           H1         G  14   4.482 -13.122   9.061
  152   1H2     G  14          1H2         G  14   2.713 -14.470   8.643
  153   2H2     G  14          2H2         G  14   1.918 -15.160  10.041
  154   1H5*    C  15          1H5*        C  15   1.196 -15.380  16.383
  155   2H5*    C  15          2H5*        C  15   1.927 -16.375  17.663
  156    H4*    C  15           H4*        C  15   2.109 -17.594  15.581
  157    H3*    C  15           H3*        C  15   4.727 -16.327  16.445
  158    H2*    C  15           H2*        C  15   5.764 -17.337  14.583
  159   2HO*    C  15          2HO*        C  15   4.764 -19.031  13.428
  160    H1*    C  15           H1*        C  15   3.519 -17.140  12.887
  161   1H4     C  15          1H4         C  15   7.517 -12.709  10.782
  162   2H4     C  15          2H4         C  15   7.533 -11.893  12.335
  163    H5     C  15           H5         C  15   5.809 -12.435  14.009
  164    H6     C  15           H6         C  15   4.315 -14.156  14.796
  165   2H    ASP   2          2H        ASP   2   9.747 -10.137  -2.339
  166   1H    ASP   2          1H        ASP   2   9.516 -11.740  -2.842
  167   3H    ASP   2          3H        ASP   2  11.032 -11.245  -2.258
  168    HA   ASP   2           HA       ASP   2  10.147 -12.365  -0.432
  169   1HB   ASP   2          1HB       ASP   2   9.228  -9.494  -0.122
  170   2HB   ASP   2          2HB       ASP   2   9.813 -10.569   1.146
  171    H    ALA   3           H        ALA   3   8.065 -11.586   1.236
  172    HA   ALA   3           HA       ALA   3   5.704 -12.595  -0.279
  173   1HB   ALA   3          1HB       ALA   3   6.367 -12.364   2.674
  174   2HB   ALA   3          2HB       ALA   3   4.884 -13.076   2.040
  175   3HB   ALA   3          3HB       ALA   3   6.440 -13.834   1.703
  176    H    GLN   4           H        GLN   4   6.645 -10.016   1.981
  177    HA   GLN   4           HA       GLN   4   4.085  -8.687   1.936
  178   1HB   GLN   4          1HB       GLN   4   5.918  -8.432   3.650
  179   2HB   GLN   4          2HB       GLN   4   6.864  -7.567   2.442
  180   1HG   GLN   4          1HG       GLN   4   5.029  -5.915   2.215
  181   2HG   GLN   4          2HG       GLN   4   4.145  -6.748   3.496
  182   1HE2  GLN   4          2HE2      GLN   4   5.709  -4.007   3.173
  183   2HE2  GLN   4          1HE2      GLN   4   6.556  -3.912   4.641
  184    H    THR   5           H        THR   5   7.173  -7.925   0.333
  185    HA   THR   5           HA       THR   5   6.332  -5.801  -1.312
  186    HB   THR   5           HB       THR   5   8.168  -8.141  -1.956
  187    HG1  THR   5           HG1      THR   5   8.972  -7.177  -0.191
  188   1HG2  THR   5          1HG2      THR   5   7.540  -5.569  -3.310
  189   2HG2  THR   5          2HG2      THR   5   9.234  -6.060  -3.269
  190   3HG2  THR   5          3HG2      THR   5   8.026  -7.117  -4.002
  191    H    ARG   6           H        ARG   6   5.843  -9.270  -1.599
  192    HA   ARG   6           HA       ARG   6   4.581  -9.253  -4.220
  193   1HB   ARG   6          1HB       ARG   6   5.271 -11.081  -2.063
  194   2HB   ARG   6          2HB       ARG   6   3.635 -11.396  -2.651
  195   1HG   ARG   6          1HG       ARG   6   4.921 -11.090  -5.019
  196   2HG   ARG   6          2HG       ARG   6   6.248 -11.722  -4.042
  197   1HD   ARG   6          1HD       ARG   6   3.508 -13.020  -4.281
  198   2HD   ARG   6          2HD       ARG   6   4.977 -13.571  -5.113
  199    HE   ARG   6           HE       ARG   6   5.776 -13.390  -2.476
  200   1HH1  ARG   6          1HH1      ARG   6   3.147 -14.949  -4.125
  201   2HH1  ARG   6          2HH1      ARG   6   3.040 -16.238  -2.975
  202   1HH2  ARG   6          1HH2      ARG   6   5.627 -15.066  -0.993
  203   2HH2  ARG   6          2HH2      ARG   6   4.437 -16.305  -1.210
  204    H    ARG   7           H        ARG   7   3.478  -9.355  -0.842
  205    HA   ARG   7           HA       ARG   7   0.705  -9.471  -1.348
  206   1HB   ARG   7          1HB       ARG   7   1.608  -9.854   0.843
  207   2HB   ARG   7          2HB       ARG   7   2.398  -8.279   0.861
  208   1HG   ARG   7          1HG       ARG   7  -0.006  -7.304   0.643
  209   2HG   ARG   7          2HG       ARG   7  -0.537  -8.907   1.152
  210   1HD   ARG   7          1HD       ARG   7   0.429  -8.696   3.264
  211   2HD   ARG   7          2HD       ARG   7   1.598  -7.481   2.725
  212    HE   ARG   7           HE       ARG   7  -0.055  -5.835   3.077
  213   1HH1  ARG   7          1HH1      ARG   7  -1.463  -8.995   2.842
  214   2HH1  ARG   7          2HH1      ARG   7  -3.054  -8.448   3.238
  215   1HH2  ARG   7          1HH2      ARG   7  -2.132  -5.131   3.594
  216   2HH2  ARG   7          2HH2      ARG   7  -3.433  -6.272   3.662
  217    H    ARG   8           H        ARG   8   2.954  -6.762  -1.328
  218    HA   ARG   8           HA       ARG   8   1.181  -4.552  -1.305
  219   1HB   ARG   8          1HB       ARG   8   3.845  -4.923  -1.431
  220   2HB   ARG   8          2HB       ARG   8   3.559  -4.643  -3.143
  221   1HG   ARG   8          1HG       ARG   8   4.147  -2.569  -1.844
  222   2HG   ARG   8          2HG       ARG   8   2.621  -2.466  -2.713
  223   1HD   ARG   8          1HD       ARG   8   2.686  -1.637  -0.235
  224   2HD   ARG   8          2HD       ARG   8   1.347  -2.685  -0.727
  225    HE   ARG   8           HE       ARG   8   3.679  -4.161   0.256
  226   1HH1  ARG   8          1HH1      ARG   8   0.694  -2.567   1.056
  227   2HH1  ARG   8          2HH1      ARG   8   0.468  -3.468   2.512
  228   1HH2  ARG   8          1HH2      ARG   8   3.353  -5.317   2.156
  229   2HH2  ARG   8          2HH2      ARG   8   1.960  -5.013   3.132
  230    H    GLU   9           H        GLU   9   2.176  -6.668  -3.965
  231    HA   GLU   9           HA       GLU   9   0.756  -5.225  -6.021
  232   1HB   GLU   9          1HB       GLU   9   1.398  -8.191  -5.754
  233   2HB   GLU   9          2HB       GLU   9   1.011  -7.359  -7.260
  234   1HG   GLU   9          1HG       GLU   9   3.071  -5.823  -6.245
  235   2HG   GLU   9          2HG       GLU   9   3.545  -7.455  -5.777
  236    H    ARG  10           H        ARG  10  -0.079  -7.621  -3.624
  237    HA   ARG  10           HA       ARG  10  -2.799  -8.057  -4.553
  238   1HB   ARG  10          1HB       ARG  10  -0.966  -8.956  -2.481
  239   2HB   ARG  10          2HB       ARG  10  -2.556  -8.621  -1.799
  240   1HG   ARG  10          1HG       ARG  10  -3.389 -10.509  -2.698
  241   2HG   ARG  10          2HG       ARG  10  -2.863 -10.016  -4.307
  242   1HD   ARG  10          1HD       ARG  10  -0.471 -10.755  -3.186
  243   2HD   ARG  10          2HD       ARG  10  -1.590 -11.901  -2.421
  244    HE   ARG  10           HE       ARG  10  -1.937 -12.879  -4.540
  245   1HH1  ARG  10          2HH1      ARG  10  -0.635  -9.677  -4.845
  246   2HH1  ARG  10          1HH1      ARG  10  -0.466  -9.782  -6.564
  247   1HH2  ARG  10          1HH2      ARG  10  -1.715 -13.006  -6.774
  248   2HH2  ARG  10          2HH2      ARG  10  -1.076 -11.657  -7.652
  249    H    ARG  11           H        ARG  11  -1.112  -5.576  -2.841
  250    HA   ARG  11           HA       ARG  11  -3.566  -4.576  -1.515
  251   1HB   ARG  11          1HB       ARG  11  -0.686  -3.634  -1.653
  252   2HB   ARG  11          2HB       ARG  11  -1.948  -2.853  -0.701
  253   1HG   ARG  11          1HG       ARG  11  -0.994  -5.717  -0.379
  254   2HG   ARG  11          2HG       ARG  11  -0.653  -4.395   0.723
  255   1HD   ARG  11          1HD       ARG  11  -2.619  -4.725   1.784
  256   2HD   ARG  11          2HD       ARG  11  -3.510  -4.583   0.261
  257    HE   ARG  11           HE       ARG  11  -2.103  -7.109   0.411
  258   1HH1  ARG  11          1HH1      ARG  11  -4.916  -5.387   1.493
  259   2HH1  ARG  11          2HH1      ARG  11  -5.858  -6.823   1.704
  260   1HH2  ARG  11          1HH2      ARG  11  -3.334  -8.966   0.688
  261   2HH2  ARG  11          2HH2      ARG  11  -4.967  -8.842   1.251
  262    H    ALA  12           H        ALA  12  -2.451  -4.478  -4.639
  263    HA   ALA  12           HA       ALA  12  -2.495  -1.747  -5.426
  264   1HB   ALA  12          1HB       ALA  12  -2.040  -3.766  -6.858
  265   2HB   ALA  12          2HB       ALA  12  -3.761  -4.149  -6.811
  266   3HB   ALA  12          3HB       ALA  12  -3.208  -2.670  -7.595
  267    H    GLU  13           H        GLU  13  -5.053  -3.888  -4.345
  268    HA   GLU  13           HA       GLU  13  -7.283  -2.216  -5.165
  269   1HB   GLU  13          1HB       GLU  13  -6.947  -4.392  -3.068
  270   2HB   GLU  13          2HB       GLU  13  -8.502  -3.741  -3.591
  271   1HG   GLU  13          1HG       GLU  13  -7.971  -4.437  -5.925
  272   2HG   GLU  13          2HG       GLU  13  -6.478  -5.171  -5.340
  273    H    LYS  14           H        LYS  14  -5.244  -2.584  -2.284
  274    HA   LYS  14           HA       LYS  14  -6.727  -0.669  -0.660
  275   1HB   LYS  14          1HB       LYS  14  -3.911  -1.819  -0.562
  276   2HB   LYS  14          2HB       LYS  14  -4.634  -0.863   0.735
  277   1HG   LYS  14          1HG       LYS  14  -5.861  -3.414  -0.347
  278   2HG   LYS  14          2HG       LYS  14  -4.805  -3.362   1.064
  279   1HD   LYS  14          1HD       LYS  14  -6.350  -1.817   2.188
  280   2HD   LYS  14          2HD       LYS  14  -7.403  -1.827   0.773
  281   1HE   LYS  14          1HE       LYS  14  -6.794  -4.543   1.666
  282   2HE   LYS  14          2HE       LYS  14  -7.582  -3.585   2.935
  283   1HZ   LYS  14          1HZ       LYS  14  -8.520  -3.553   0.126
  284   2HZ   LYS  14          2HZ       LYS  14  -9.105  -4.682   1.252
  285   3HZ   LYS  14          3HZ       LYS  14  -9.341  -3.020   1.511
  286    H    GLN  15           H        GLN  15  -3.894  -0.689  -2.718
  287    HA   GLN  15           HA       GLN  15  -2.998   1.998  -2.422
  288   1HB   GLN  15          1HB       GLN  15  -2.651  -0.384  -4.116
  289   2HB   GLN  15          2HB       GLN  15  -2.365   1.107  -4.993
  290   1HG   GLN  15          1HG       GLN  15  -0.530   1.665  -3.719
  291   2HG   GLN  15          2HG       GLN  15  -1.159   0.843  -2.292
  292   1HE2  GLN  15          2HE2      GLN  15  -1.295  -1.640  -2.523
  293   2HE2  GLN  15          1HE2      GLN  15  -0.013  -2.406  -3.339
  294    H    ALA  16           H        ALA  16  -5.023   0.481  -4.936
  295    HA   ALA  16           HA       ALA  16  -5.601   2.922  -6.343
  296   1HB   ALA  16          1HB       ALA  16  -5.844   0.435  -7.032
  297   2HB   ALA  16          2HB       ALA  16  -7.388   0.483  -6.180
  298   3HB   ALA  16          3HB       ALA  16  -7.111   1.539  -7.564
  299    H    GLN  17           H        GLN  17  -6.916   1.531  -3.400
  300    HA   GLN  17           HA       GLN  17  -9.384   3.140  -3.506
  301   1HB   GLN  17          1HB       GLN  17  -7.999   1.207  -1.689
  302   2HB   GLN  17          2HB       GLN  17  -9.138   2.322  -0.936
  303   1HG   GLN  17          1HG       GLN  17 -10.092   1.030  -3.424
  304   2HG   GLN  17          2HG       GLN  17  -9.873  -0.051  -2.047
  305   1HE2  GLN  17          2HE2      GLN  17 -11.171   0.371  -0.100
  306   2HE2  GLN  17          1HE2      GLN  17 -12.551   1.356  -0.170
  307    H    TRP  18           H        TRP  18  -6.201   3.215  -2.100
  308    HA   TRP  18           HA       TRP  18  -6.565   5.655  -0.543
  309   1HB   TRP  18          1HB       TRP  18  -4.940   3.923   0.040
  310   2HB   TRP  18          2HB       TRP  18  -4.219   4.025  -1.551
  311    HD1  TRP  18           HD1      TRP  18  -4.214   5.762   1.805
  312    HE1  TRP  18           HE1      TRP  18  -2.439   7.631   1.758
  313    HE3  TRP  18           HE3      TRP  18  -3.043   5.693  -3.092
  314    HZ2  TRP  18           HZ2      TRP  18  -0.717   8.912  -0.156
  315    HZ3  TRP  18           HZ3      TRP  18  -1.355   7.188  -4.019
  316    HH2  TRP  18           HH2      TRP  18  -0.178   8.771  -2.581
  317    H    LYS  19           H        LYS  19  -4.925   4.740  -3.540
  318    HA   LYS  19           HA       LYS  19  -3.918   7.265  -4.316
  319   1HB   LYS  19          1HB       LYS  19  -4.865   4.814  -5.827
  320   2HB   LYS  19          2HB       LYS  19  -4.127   6.191  -6.634
  321   1HG   LYS  19          1HG       LYS  19  -2.133   5.949  -5.161
  322   2HG   LYS  19          2HG       LYS  19  -2.850   4.488  -4.489
  323   1HD   LYS  19          1HD       LYS  19  -3.057   3.814  -7.045
  324   2HD   LYS  19          2HD       LYS  19  -1.728   4.963  -7.219
  325   1HE   LYS  19          1HE       LYS  19  -1.611   2.862  -5.062
  326   2HE   LYS  19          2HE       LYS  19  -1.133   2.464  -6.725
  327   1HZ   LYS  19          1HZ       LYS  19  -0.159   4.863  -5.278
  328   2HZ   LYS  19          2HZ       LYS  19   0.690   3.395  -5.301
  329   3HZ   LYS  19          3HZ       LYS  19   0.411   4.238  -6.751
  330    H    ALA  20           H        ALA  20  -7.073   5.738  -4.698
  331    HA   ALA  20           HA       ALA  20  -8.211   7.654  -6.462
  332   1HB   ALA  20          1HB       ALA  20  -9.192   5.708  -4.411
  333   2HB   ALA  20          2HB       ALA  20 -10.339   6.824  -5.149
  334   3HB   ALA  20          3HB       ALA  20  -9.438   5.693  -6.158
  335    H    ALA  21           H        ALA  21  -7.659   7.639  -2.996
  336    HA   ALA  21           HA       ALA  21  -8.901  10.352  -2.815
  337   1HB   ALA  21          1HB       ALA  21  -9.635   8.094  -1.509
  338   2HB   ALA  21          2HB       ALA  21  -8.424   8.710  -0.386
  339   3HB   ALA  21          3HB       ALA  21  -9.821   9.701  -0.807
  340    H    ASN  22           H        ASN  22  -6.157   9.637  -3.583
  341    HA   ASN  22           HA       ASN  22  -4.778  11.443  -1.701
  342   1HB   ASN  22          1HB       ASN  22  -4.029   8.547  -2.130
  343   2HB   ASN  22          2HB       ASN  22  -2.901   9.738  -1.482
  344   1HD2  ASN  22          2HD2      ASN  22  -5.147   7.481  -0.532
  345   2HD2  ASN  22          1HD2      ASN  22  -5.543   8.100   0.996
  346    HA   PRO  23           HA       PRO  23  -3.364  11.421  -6.202
  347   1HB   PRO  23          1HB       PRO  23  -4.582  13.760  -6.969
  348   2HB   PRO  23          2HB       PRO  23  -5.340  12.169  -7.184
  349   1HG   PRO  23          1HG       PRO  23  -5.815  14.223  -5.086
  350   2HG   PRO  23          2HG       PRO  23  -6.968  13.159  -5.907
  351   1HD   PRO  23          1HD       PRO  23  -6.026  12.695  -3.393
  352   2HD   PRO  23          2HD       PRO  23  -6.554  11.398  -4.482
  353    H    LEU  24           H        LEU  24  -3.832  13.590  -3.548
  354    HA   LEU  24           HA       LEU  24  -1.915  15.629  -4.160
  355   1HB   LEU  24          1HB       LEU  24  -2.437  16.329  -1.991
  356   2HB   LEU  24          2HB       LEU  24  -3.803  15.262  -2.289
  357    HG   LEU  24           HG       LEU  24  -1.250  14.285  -0.970
  358   1HD1  LEU  24          1HD1      LEU  24  -2.427  16.218   0.246
  359   2HD1  LEU  24          2HD1      LEU  24  -3.759  15.089   0.499
  360   3HD1  LEU  24          3HD1      LEU  24  -2.164  14.736   1.164
  361   1HD2  LEU  24          1HD2      LEU  24  -3.483  12.928  -1.957
  362   2HD2  LEU  24          2HD2      LEU  24  -2.328  12.287  -0.791
  363   3HD2  LEU  24          3HD2      LEU  24  -3.812  13.063  -0.233
  364    H    LEU  25           H        LEU  25  -1.695  12.456  -2.671
  365    HA   LEU  25           HA       LEU  25   1.252  12.700  -2.328
  366   1HB   LEU  25          1HB       LEU  25  -0.997  10.971  -1.325
  367   2HB   LEU  25          2HB       LEU  25   0.635  10.296  -1.331
  368    HG   LEU  25           HG       LEU  25   0.259  13.036  -0.190
  369   1HD1  LEU  25          1HD1      LEU  25  -1.491  11.198   0.670
  370   2HD1  LEU  25          2HD1      LEU  25  -0.105  10.707   1.642
  371   3HD1  LEU  25          3HD1      LEU  25  -0.737  12.348   1.773
  372   1HD2  LEU  25          1HD2      LEU  25   1.960  10.632   0.552
  373   2HD2  LEU  25          2HD2      LEU  25   2.501  12.021  -0.391
  374   3HD2  LEU  25          3HD2      LEU  25   2.059  12.224   1.305
  375    H    VAL  26           H        VAL  26  -0.086  12.646  -4.858
  376    HA   VAL  26           HA       VAL  26   1.114  10.219  -6.081
  377    HB   VAL  26           HB       VAL  26  -1.707  10.990  -5.668
  378   1HG1  VAL  26          1HG1      VAL  26  -0.746  10.193  -8.426
  379   2HG1  VAL  26          2HG1      VAL  26  -2.422  10.054  -7.890
  380   3HG1  VAL  26          3HG1      VAL  26  -1.653  11.639  -7.976
  381   1HG2  VAL  26          1HG2      VAL  26  -0.089   8.516  -6.192
  382   2HG2  VAL  26          2HG2      VAL  26  -1.163   8.889  -4.841
  383   3HG2  VAL  26          3HG2      VAL  26  -1.838   8.459  -6.415
  384    H    GLY  27           H        GLY  27   1.753  10.649  -8.294
  385   1HA   GLY  27          1HA       GLY  27   2.638  13.209  -8.978
  386   2HA   GLY  27          2HA       GLY  27   2.287  11.965 -10.178
  387    H    VAL  28           H        VAL  28   1.065  14.831  -8.584
  388    HA   VAL  28           HA       VAL  28  -0.836  16.176  -9.051
  389    HB   VAL  28           HB       VAL  28  -0.595  14.960 -11.804
  390   1HG1  VAL  28          1HG1      VAL  28  -2.241  16.905 -10.804
  391   2HG1  VAL  28          2HG1      VAL  28  -0.870  17.874 -11.360
  392   3HG1  VAL  28          3HG1      VAL  28  -1.723  16.820 -12.490
  393   1HG2  VAL  28          1HG2      VAL  28   1.199  17.013 -10.465
  394   2HG2  VAL  28          2HG2      VAL  28   1.686  15.439 -11.094
  395   3HG2  VAL  28          3HG2      VAL  28   1.172  16.711 -12.203
  396    H    SER  29           H        SER  29  -2.754  15.342 -11.209
  397    HA   SER  29           HA       SER  29  -4.559  13.869  -9.523
  398   1HB   SER  29          1HB       SER  29  -5.384  15.520 -11.077
  399   2HB   SER  29          2HB       SER  29  -4.578  14.726 -12.426
  400    HG   SER  29           HG       SER  29  -6.268  13.506 -12.606
  401    H    ALA  30           H        ALA  30  -2.333  12.257  -9.712
  402    HA   ALA  30           HA       ALA  30  -1.519  10.154 -10.415
  403   1HB   ALA  30          1HB       ALA  30  -4.350  10.141  -9.765
  404   2HB   ALA  30          2HB       ALA  30  -3.958   8.845 -10.896
  405   3HB   ALA  30          3HB       ALA  30  -3.108   8.957  -9.353
  406    H    LYS  31           H        LYS  31  -0.797  11.266 -12.506
  407    HA   LYS  31           HA       LYS  31  -2.348  10.224 -14.851
  408   1HB   LYS  31          1HB       LYS  31  -1.213  12.160 -16.042
  409   2HB   LYS  31          2HB       LYS  31  -2.351  12.637 -14.782
  410   1HG   LYS  31          1HG       LYS  31  -0.585  13.116 -13.237
  411   2HG   LYS  31          2HG       LYS  31   0.616  12.333 -14.265
  412   1HD   LYS  31          1HD       LYS  31  -0.980  14.705 -15.233
  413   2HD   LYS  31          2HD       LYS  31   0.520  14.910 -14.327
  414   1HE   LYS  31          1HE       LYS  31   1.817  14.221 -16.084
  415   2HE   LYS  31          2HE       LYS  31   0.656  12.971 -16.574
  416   1HZ   LYS  31          1HZ       LYS  31   0.167  15.884 -16.880
  417   2HZ   LYS  31          2HZ       LYS  31   0.778  14.902 -18.124
  418   3HZ   LYS  31          3HZ       LYS  31  -0.774  14.616 -17.497
  419    HA   PRO  32           HA       PRO  32   1.344   7.848 -15.508
  420   1HB   PRO  32          1HB       PRO  32   0.657   6.768 -17.923
  421   2HB   PRO  32          2HB       PRO  32  -0.030   6.206 -16.386
  422   1HG   PRO  32          1HG       PRO  32  -1.221   7.951 -18.465
  423   2HG   PRO  32          2HG       PRO  32  -1.992   6.760 -17.408
  424   1HD   PRO  32          1HD       PRO  32  -2.062   9.497 -17.028
  425   2HD   PRO  32          2HD       PRO  32  -2.356   8.284 -15.765
  426    H    VAL  33           H        VAL  33   2.591   7.411 -17.886
  427    HA   VAL  33           HA       VAL  33   3.439  10.149 -18.700
  428    HB   VAL  33           HB       VAL  33   5.428   8.907 -19.542
  429   1HG1  VAL  33          1HG1      VAL  33   5.198   9.653 -17.139
  430   2HG1  VAL  33          2HG1      VAL  33   4.673   8.017 -16.747
  431   3HG1  VAL  33          3HG1      VAL  33   6.297   8.295 -17.377
  432   1HG2  VAL  33          1HG2      VAL  33   3.749   6.773 -19.777
  433   2HG2  VAL  33          2HG2      VAL  33   5.504   6.623 -19.708
  434   3HG2  VAL  33          3HG2      VAL  33   4.541   6.385 -18.250
  435    H    ASN  34           H        ASN  34   4.567   9.391 -21.211
  436    HA   ASN  34           HA       ASN  34   2.209   8.502 -22.822
  437   1HB   ASN  34          1HB       ASN  34   3.835  11.049 -23.054
  438   2HB   ASN  34          2HB       ASN  34   2.766  10.475 -24.335
  439   1HD2  ASN  34          2HD2      ASN  34   0.426  10.407 -23.866
  440   2HD2  ASN  34          1HD2      ASN  34  -0.225  11.312 -22.586
  441    H    ARG  35           H        ARG  35   3.230   8.776 -25.325
  442    HA   ARG  35           HA       ARG  35   4.641   7.677 -26.870
  443   1HB   ARG  35          1HB       ARG  35   6.609   8.458 -24.691
  444   2HB   ARG  35          2HB       ARG  35   7.052   8.012 -26.339
  445   1HG   ARG  35          1HG       ARG  35   6.375  10.010 -27.203
  446   2HG   ARG  35          2HG       ARG  35   4.985  10.119 -26.123
  447   1HD   ARG  35          1HD       ARG  35   6.751  10.544 -24.249
  448   2HD   ARG  35          2HD       ARG  35   7.843  10.928 -25.595
  449    HE   ARG  35           HE       ARG  35   5.485  12.302 -26.179
  450   1HH1  ARG  35          1HH1      ARG  35   7.755  12.181 -23.558
  451   2HH1  ARG  35          2HH1      ARG  35   7.495  13.829 -23.100
  452   1HH2  ARG  35          1HH2      ARG  35   5.153  14.444 -25.577
  453   2HH2  ARG  35          2HH2      ARG  35   6.029  15.105 -24.237
  454    HA   PRO  36           HA       PRO  36   4.723   3.886 -24.118
  455   1HB   PRO  36          1HB       PRO  36   2.735   2.499 -25.384
  456   2HB   PRO  36          2HB       PRO  36   2.425   3.620 -24.043
  457   1HG   PRO  36          1HG       PRO  36   2.077   4.024 -26.969
  458   2HG   PRO  36          2HG       PRO  36   1.080   4.595 -25.622
  459   1HD   PRO  36          1HD       PRO  36   2.873   6.166 -26.969
  460   2HD   PRO  36          2HD       PRO  36   2.366   6.452 -25.289
  Start of MODEL   22
    1   1H5*    G   1          1H5*        G   1  11.839 -16.099   0.462
    2   2H5*    G   1          2H5*        G   1  11.899 -14.850   1.724
    3    H4*    G   1           H4*        G   1  11.140 -17.774   2.047
    4    H3*    G   1           H3*        G   1   9.635 -15.152   2.373
    5    H2*    G   1           H2*        G   1   8.323 -16.165   4.051
    6   2HO*    G   1          2HO*        G   1   7.685 -18.116   3.487
    7    H1*    G   1           H1*        G   1  10.415 -17.714   5.093
    8    H8     G   1           H8         G   1  11.486 -14.146   4.554
    9    H1     G   1           H1         G   1   7.769 -14.989   9.727
   10   1H2     G   1          1H2         G   1   6.701 -16.959   9.543
   11   2H2     G   1          2H2         G   1   7.481 -18.238   8.639
   12   1H5*    C   2          1H5*        C   2   5.956 -16.670   1.088
   13   2H5*    C   2          2H5*        C   2   7.036 -16.216   2.426
   14    H4*    C   2           H4*        C   2   4.837 -18.189   2.956
   15    H3*    C   2           H3*        C   2   4.477 -15.204   2.553
   16    H2*    C   2           H2*        C   2   3.076 -15.104   4.435
   17   2HO*    C   2          2HO*        C   2   2.872 -17.923   4.166
   18    H1*    C   2           H1*        C   2   4.434 -17.004   5.970
   19   1H4     C   2          1H4         C   2   6.268 -11.427   8.342
   20   2H4     C   2          2H4         C   2   7.375 -11.183   7.012
   21    H5     C   2           H5         C   2   7.222 -12.526   4.973
   22    H6     C   2           H6         C   2   6.621 -14.749   4.141
   23   1H5*    C   3          1H5*        C   3   0.035 -14.006   1.714
   24   2H5*    C   3          2H5*        C   3   1.070 -12.612   2.086
   25    H4*    C   3           H4*        C   3  -0.471 -14.402   3.935
   26    H3*    C   3           H3*        C   3   0.097 -11.451   3.629
   27    H2*    C   3           H2*        C   3  -0.139 -11.116   5.928
   28   2HO*    C   3          2HO*        C   3  -1.951 -12.171   6.510
   29    H1*    C   3           H1*        C   3   1.052 -13.490   6.744
   30   1H4     C   3          1H4         C   3   5.250  -8.610   7.026
   31   2H4     C   3          2H4         C   3   6.110  -9.417   5.734
   32    H5     C   3           H5         C   3   4.768 -10.761   4.137
   33    H6     C   3           H6         C   3   2.983 -12.400   4.012
   34   1H5*    C   4          1H5*        C   4  -4.333 -10.289   4.828
   35   2H5*    C   4          2H5*        C   4  -2.577 -10.217   4.610
   36    H4*    C   4           H4*        C   4  -4.081  -9.745   7.201
   37    H3*    C   4           H3*        C   4  -2.689  -7.881   5.250
   38    H2*    C   4           H2*        C   4  -2.039  -6.534   7.066
   39   2HO*    C   4          2HO*        C   4  -3.275  -6.301   8.740
   40    H1*    C   4           H1*        C   4  -1.508  -8.645   8.804
   41   1H4     C   4          1H4         C   4   3.749  -6.383   5.783
   42   2H4     C   4          2H4         C   4   4.078  -8.076   5.514
   43    H5     C   4           H5         C   4   1.707  -8.913   4.592
   44    H6     C   4           H6         C   4  -0.454  -9.386   5.450
   45   1H5*    U   5          1H5*        U   5  -4.950  -5.724   7.808
   46   2H5*    U   5          2H5*        U   5  -5.848  -4.340   7.146
   47    H4*    U   5           H4*        U   5  -4.448  -3.604   8.996
   48    H3*    U   5           H3*        U   5  -3.434  -2.720   6.269
   49    H2*    U   5           H2*        U   5  -1.715  -1.553   7.361
   50   2HO*    U   5          2HO*        U   5  -3.399  -1.713   9.638
   51    H1*    U   5           H1*        U   5  -1.454  -3.381   9.492
   52    H3     U   5           H3         U   5   2.465  -2.616   7.252
   53    H5     U   5           H5         U   5   0.557  -5.693   5.159
   54    H6     U   5           H6         U   5  -1.439  -5.131   6.359
   55   1H5*    G   6          1H5*        G   6  -2.495  -0.082   7.363
   56   2H5*    G   6          2H5*        G   6  -2.815   1.410   8.263
   57    H4*    G   6           H4*        G   6  -2.100   2.762   6.515
   58    H3*    G   6           H3*        G   6  -2.750   0.432   4.672
   59    H2*    G   6           H2*        G   6  -1.148   1.215   3.165
   60   2HO*    G   6          2HO*        G   6  -1.097   3.677   4.594
   61    H1*    G   6           H1*        G   6   0.634   2.213   5.105
   62    H8     G   6           H8         G   6  -0.967  -1.301   5.114
   63    H1     G   6           H1         G   6   4.963  -0.960   2.653
   64   1H2     G   6          1H2         G   6   5.481   1.216   2.286
   65   2H2     G   6          2H2         G   6   4.766   2.394   3.370
   66   1H5*    A   7          1H5*        A   7  -4.615   1.803   0.517
   67   2H5*    A   7          2H5*        A   7  -3.623   0.330   0.521
   68    H4*    A   7           H4*        A   7  -2.817   1.800  -1.218
   69    H3*    A   7           H3*        A   7  -1.020   1.768   1.231
   70    H2*    A   7           H2*        A   7   0.453   3.226   0.079
   71   2HO*    A   7          2HO*        A   7  -0.217   3.595  -2.293
   72    H1*    A   7           H1*        A   7  -1.557   4.576  -1.316
   73    H8     A   7           H8         A   7  -2.548   4.633   2.252
   74   1H6     A   7          1H6         A   7   0.843   9.465   3.007
   75   2H6     A   7          2H6         A   7   0.963   8.017   3.980
   76    H2     A   7           H2         A   7   2.279   7.436  -0.928
   77   1H5*    A   8          1H5*        A   8   1.024   0.950  -1.769
   78   2H5*    A   8          2H5*        A   8   2.344  -0.224  -1.946
   79    H4*    A   8           H4*        A   8   3.271   1.976  -2.272
   80    H3*    A   8           H3*        A   8   3.849   0.797   0.468
   81    H2*    A   8           H2*        A   8   5.122   2.704   1.039
   82   2HO*    A   8          2HO*        A   8   5.773   4.217  -0.500
   83    H1*    A   8           H1*        A   8   3.436   4.537  -0.262
   84    H8     A   8           H8         A   8   1.241   2.147   1.559
   85   1H6     A   8          1H6         A   8   1.767   3.917   6.196
   86   2H6     A   8          2H6         A   8   1.994   5.618   6.532
   87    H2     A   8           H2         A   8   5.280   6.725   3.580
   88   1H5*    A   9          2H5*        A   9   8.379  -0.646  -2.480
   89   2H5*    A   9          1H5*        A   9   7.402   0.218  -1.274
   90    H4*    A   9           H4*        A   9   9.498   1.288  -2.766
   91    H3*    A   9           H3*        A   9   7.183   2.576  -1.292
   92    H2*    A   9           H2*        A   9   7.970   4.687  -2.033
   93   2HO*    A   9          2HO*        A   9  10.345   3.489  -1.955
   94    H1*    A   9           H1*        A   9   8.644   3.794  -4.594
   95    H8     A   9           H8         A   9   6.236   5.061  -2.214
   96   1H6     A   9          1H6         A   9   1.896   4.873  -5.051
   97   2H6     A   9          2H6         A   9   2.236   5.734  -6.535
   98    H2     A   9           H2         A   9   5.287   2.528  -8.033
   99   1H5*    A  10          1H5*        A  10  10.056   1.275   3.721
  100   2H5*    A  10          2H5*        A  10   8.346   1.607   3.366
  101    H4*    A  10           H4*        A  10  10.234   3.916   3.684
  102    H3*    A  10           H3*        A  10   9.143   2.184   5.906
  103    H2*    A  10           H2*        A  10   8.562   4.079   7.161
  104   2HO*    A  10          2HO*        A  10  10.659   5.183   5.837
  105    H1*    A  10           H1*        A  10   7.740   5.674   5.031
  106    H8     A  10           H8         A  10   6.160   2.664   3.980
  107   1H6     A  10          1H6         A  10   2.450   2.267   7.122
  108   2H6     A  10          2H6         A  10   2.033   3.113   8.595
  109    H2     A  10           H2         A  10   5.447   5.881   9.499
  110   1H5*    A  11          1H5*        A  11  10.445   4.269   8.709
  111   2H5*    A  11          2H5*        A  11  11.060   3.121   9.920
  112    H4*    A  11           H4*        A  11   8.771   4.241  10.367
  113    H3*    A  11           H3*        A  11   9.249   1.254  10.478
  114    H2*    A  11           H2*        A  11   6.974   0.891  10.980
  115   2HO*    A  11          2HO*        A  11   5.680   2.361  11.876
  116    H1*    A  11           H1*        A  11   5.937   2.885   9.361
  117    H8     A  11           H8         A  11   8.647   1.070   7.485
  118   1H6     A  11          1H6         A  11   4.696  -3.376   6.261
  119   2H6     A  11          2H6         A  11   5.541  -2.257   5.218
  120    H2     A  11           H2         A  11   2.590  -0.415   9.046
  121   1H5*    G  12          1H5*        G  12   9.223  -1.669  13.350
  122   2H5*    G  12          2H5*        G  12   9.113  -0.787  11.816
  123    H4*    G  12           H4*        G  12   6.970  -0.018  13.625
  124    H3*    G  12           H3*        G  12   7.303  -2.954  13.007
  125    H2*    G  12           H2*        G  12   4.988  -3.102  12.534
  126   2HO*    G  12          2HO*        G  12   4.863  -0.842  14.152
  127    H1*    G  12           H1*        G  12   4.771  -0.608  11.280
  128    H8     G  12           H8         G  12   7.732  -1.681   9.613
  129    H1     G  12           H1         G  12   2.859  -5.606   8.165
  130   1H2     G  12          1H2         G  12   1.166  -5.248   9.523
  131   2H2     G  12          2H2         G  12   1.353  -4.308  10.988
  132   1H5*    G  13          1H5*        G  13   4.673  -3.137  16.054
  133   2H5*    G  13          2H5*        G  13   5.054  -4.126  17.481
  134    H4*    G  13           H4*        G  13   3.023  -5.000  16.593
  135    H3*    G  13           H3*        G  13   5.420  -6.630  15.722
  136    H2*    G  13           H2*        G  13   3.985  -8.042  14.525
  137   2HO*    G  13          2HO*        G  13   1.813  -6.885  15.939
  138    H1*    G  13           H1*        G  13   2.160  -6.074  13.730
  139    H8     G  13           H8         G  13   5.626  -4.852  13.051
  140    H1     G  13           H1         G  13   3.532  -9.140   8.742
  141   1H2     G  13          1H2         G  13   1.487  -9.856   9.379
  142   2H2     G  13          2H2         G  13   1.199  -9.975  11.101
  143   1H5*    G  14          1H5*        G  14   1.370  -9.574  17.896
  144   2H5*    G  14          2H5*        G  14   2.733 -10.491  18.576
  145    H4*    G  14           H4*        G  14   0.933 -11.825  17.289
  146    H3*    G  14           H3*        G  14   3.882 -11.989  16.623
  147    H2*    G  14           H2*        G  14   3.384 -13.573  14.943
  148   2HO*    G  14          2HO*        G  14   1.274 -14.127  16.560
  149    H1*    G  14           H1*        G  14   1.027 -12.364  14.078
  150    H8     G  14           H8         G  14   3.571  -9.684  14.638
  151    H1     G  14           H1         G  14   4.558 -13.030   9.228
  152   1H2     G  14          1H2         G  14   3.530 -15.105   9.543
  153   2H2     G  14          2H2         G  14   1.902 -14.881  10.144
  154   1H5*    C  15          1H5*        C  15   2.481 -15.590  16.849
  155   2H5*    C  15          2H5*        C  15   3.287 -16.801  17.877
  156    H4*    C  15           H4*        C  15   3.070 -17.801  15.718
  157    H3*    C  15           H3*        C  15   5.862 -16.707  16.167
  158    H2*    C  15           H2*        C  15   6.472 -17.551  14.052
  159   2HO*    C  15          2HO*        C  15   5.247 -19.627  14.602
  160    H1*    C  15           H1*        C  15   3.955 -17.126  12.855
  161   1H4     C  15          1H4         C  15   7.831 -12.759  10.411
  162   2H4     C  15          2H4         C  15   7.998 -11.955  11.961
  163    H5     C  15           H5         C  15   6.512 -12.552  13.830
  164    H6     C  15           H6         C  15   5.092 -14.275  14.737
  165   2H    ASP   2          2H        ASP   2   9.270 -11.781  -2.286
  166   1H    ASP   2          1H        ASP   2   9.166 -13.456  -2.020
  167   3H    ASP   2          3H        ASP   2  10.630 -12.638  -1.745
  168    HA   ASP   2           HA       ASP   2   9.753 -12.942   0.400
  169   1HB   ASP   2          1HB       ASP   2   8.805 -10.225  -0.545
  170   2HB   ASP   2          2HB       ASP   2   9.412 -10.646   1.054
  171    H    ALA   3           H        ALA   3   7.661 -11.536   1.579
  172    HA   ALA   3           HA       ALA   3   5.236 -12.872   0.427
  173   1HB   ALA   3          1HB       ALA   3   6.144 -12.417   3.280
  174   2HB   ALA   3          2HB       ALA   3   4.552 -13.043   2.852
  175   3HB   ALA   3          3HB       ALA   3   5.999 -13.967   2.449
  176    H    GLN   4           H        GLN   4   6.283 -10.183   2.524
  177    HA   GLN   4           HA       GLN   4   3.781  -8.761   2.351
  178   1HB   GLN   4          1HB       GLN   4   5.546  -8.459   4.098
  179   2HB   GLN   4          2HB       GLN   4   6.609  -7.778   2.872
  180   1HG   GLN   4          1HG       GLN   4   4.938  -5.989   2.441
  181   2HG   GLN   4          2HG       GLN   4   3.933  -6.645   3.734
  182   1HE2  GLN   4          2HE2      GLN   4   5.294  -3.980   3.626
  183   2HE2  GLN   4          1HE2      GLN   4   6.295  -3.928   4.992
  184    H    THR   5           H        THR   5   6.932  -8.174   0.802
  185    HA   THR   5           HA       THR   5   6.173  -6.132  -0.985
  186    HB   THR   5           HB       THR   5   8.016  -8.511  -1.433
  187    HG1  THR   5           HG1      THR   5   9.436  -7.416  -0.304
  188   1HG2  THR   5          1HG2      THR   5   7.567  -5.919  -2.877
  189   2HG2  THR   5          2HG2      THR   5   9.171  -6.656  -2.876
  190   3HG2  THR   5          3HG2      THR   5   7.793  -7.537  -3.539
  191    H    ARG   6           H        ARG   6   5.626  -9.602  -1.068
  192    HA   ARG   6           HA       ARG   6   4.476  -9.738  -3.737
  193   1HB   ARG   6          1HB       ARG   6   5.033 -11.425  -1.432
  194   2HB   ARG   6          2HB       ARG   6   3.414 -11.747  -2.066
  195   1HG   ARG   6          1HG       ARG   6   4.761 -11.658  -4.395
  196   2HG   ARG   6          2HG       ARG   6   6.082 -12.174  -3.345
  197   1HD   ARG   6          1HD       ARG   6   3.387 -13.551  -3.270
  198   2HD   ARG   6          2HD       ARG   6   4.665 -14.055  -4.393
  199    HE   ARG   6           HE       ARG   6   5.664 -13.729  -1.683
  200   1HH1  ARG   6          1HH1      ARG   6   3.997 -15.849  -3.868
  201   2HH1  ARG   6          2HH1      ARG   6   4.472 -17.284  -3.025
  202   1HH2  ARG   6          1HH2      ARG   6   6.275 -15.600  -0.595
  203   2HH2  ARG   6          2HH2      ARG   6   5.756 -17.145  -1.180
  204    H    ARG   7           H        ARG   7   3.245  -9.579  -0.413
  205    HA   ARG   7           HA       ARG   7   0.487  -9.672  -0.990
  206   1HB   ARG   7          1HB       ARG   7   1.233  -9.929   1.240
  207   2HB   ARG   7          2HB       ARG   7   2.230  -8.483   1.158
  208   1HG   ARG   7          1HG       ARG   7  -0.098  -7.265   0.813
  209   2HG   ARG   7          2HG       ARG   7  -0.729  -8.719   1.589
  210   1HD   ARG   7          1HD       ARG   7  -0.110  -7.897   3.599
  211   2HD   ARG   7          2HD       ARG   7   1.578  -7.859   3.062
  212    HE   ARG   7           HE       ARG   7  -0.285  -5.578   3.004
  213   1HH1  ARG   7          1HH1      ARG   7   2.659  -6.999   1.833
  214   2HH1  ARG   7          2HH1      ARG   7   3.334  -5.484   1.363
  215   1HH2  ARG   7          1HH2      ARG   7   0.604  -3.622   2.389
  216   2HH2  ARG   7          2HH2      ARG   7   2.180  -3.579   1.674
  217    H    ARG   8           H        ARG   8   2.793  -7.008  -1.099
  218    HA   ARG   8           HA       ARG   8   1.053  -4.768  -1.319
  219   1HB   ARG   8          1HB       ARG   8   3.687  -5.094  -1.253
  220   2HB   ARG   8          2HB       ARG   8   3.530  -5.090  -3.007
  221   1HG   ARG   8          1HG       ARG   8   3.874  -2.824  -2.536
  222   2HG   ARG   8          2HG       ARG   8   2.119  -2.929  -2.637
  223   1HD   ARG   8          1HD       ARG   8   2.883  -1.646  -0.622
  224   2HD   ARG   8          2HD       ARG   8   1.966  -3.100  -0.183
  225    HE   ARG   8           HE       ARG   8   3.953  -4.010   0.707
  226   1HH1  ARG   8          1HH1      ARG   8   4.653  -1.423  -1.496
  227   2HH1  ARG   8          2HH1      ARG   8   6.351  -1.452  -1.169
  228   1HH2  ARG   8          1HH2      ARG   8   6.164  -4.035   1.123
  229   2HH2  ARG   8          2HH2      ARG   8   7.203  -2.919   0.303
  230    H    GLU   9           H        GLU   9   2.170  -7.078  -3.764
  231    HA   GLU   9           HA       GLU   9   0.930  -5.796  -6.010
  232   1HB   GLU   9          1HB       GLU   9   1.427  -8.740  -5.406
  233   2HB   GLU   9          2HB       GLU   9   1.099  -8.081  -7.009
  234   1HG   GLU   9          1HG       GLU   9   3.262  -6.635  -5.709
  235   2HG   GLU   9          2HG       GLU   9   3.616  -8.360  -5.800
  236    H    ARG  10           H        ARG  10  -0.220  -7.801  -3.413
  237    HA   ARG  10           HA       ARG  10  -2.890  -8.189  -4.536
  238   1HB   ARG  10          1HB       ARG  10  -1.252  -9.149  -2.374
  239   2HB   ARG  10          2HB       ARG  10  -2.772  -8.560  -1.704
  240   1HG   ARG  10          1HG       ARG  10  -4.009 -10.192  -2.724
  241   2HG   ARG  10          2HG       ARG  10  -2.999 -10.193  -4.171
  242   1HD   ARG  10          1HD       ARG  10  -1.211 -11.382  -2.874
  243   2HD   ARG  10          2HD       ARG  10  -2.332 -11.487  -1.503
  244    HE   ARG  10           HE       ARG  10  -3.609 -12.424  -3.912
  245   1HH1  ARG  10          1HH1      ARG  10  -1.280 -13.276  -1.483
  246   2HH1  ARG  10          2HH1      ARG  10  -1.543 -14.978  -1.661
  247   1HH2  ARG  10          1HH2      ARG  10  -3.943 -14.638  -4.134
  248   2HH2  ARG  10          2HH2      ARG  10  -3.043 -15.747  -3.153
  249    H    ARG  11           H        ARG  11  -1.168  -5.686  -2.942
  250    HA   ARG  11           HA       ARG  11  -3.623  -4.459  -1.818
  251   1HB   ARG  11          1HB       ARG  11  -0.701  -3.647  -1.864
  252   2HB   ARG  11          2HB       ARG  11  -1.980  -2.768  -1.035
  253   1HG   ARG  11          1HG       ARG  11  -1.090  -5.607  -0.451
  254   2HG   ARG  11          2HG       ARG  11  -0.813  -4.198   0.565
  255   1HD   ARG  11          1HD       ARG  11  -2.846  -4.439   1.533
  256   2HD   ARG  11          2HD       ARG  11  -3.643  -4.458  -0.048
  257    HE   ARG  11           HE       ARG  11  -2.261  -6.941   0.349
  258   1HH1  ARG  11          1HH1      ARG  11  -5.037  -5.145   1.406
  259   2HH1  ARG  11          2HH1      ARG  11  -5.955  -6.561   1.789
  260   1HH2  ARG  11          1HH2      ARG  11  -3.464  -8.776   0.850
  261   2HH2  ARG  11          2HH2      ARG  11  -5.070  -8.606   1.476
  262    H    ALA  12           H        ALA  12  -2.215  -4.636  -4.840
  263    HA   ALA  12           HA       ALA  12  -2.052  -1.975  -5.828
  264   1HB   ALA  12          1HB       ALA  12  -1.638  -4.227  -6.987
  265   2HB   ALA  12          2HB       ALA  12  -3.386  -4.343  -7.193
  266   3HB   ALA  12          3HB       ALA  12  -2.491  -3.032  -7.966
  267    H    GLU  13           H        GLU  13  -4.784  -3.953  -4.932
  268    HA   GLU  13           HA       GLU  13  -6.856  -2.272  -6.064
  269   1HB   GLU  13          1HB       GLU  13  -8.112  -4.052  -5.336
  270   2HB   GLU  13          2HB       GLU  13  -6.557  -4.789  -4.982
  271   1HG   GLU  13          1HG       GLU  13  -7.827  -5.031  -3.003
  272   2HG   GLU  13          2HG       GLU  13  -6.695  -3.720  -2.699
  273    H    LYS  14           H        LYS  14  -5.228  -2.627  -2.949
  274    HA   LYS  14           HA       LYS  14  -6.769  -0.549  -1.589
  275   1HB   LYS  14          1HB       LYS  14  -3.999  -1.709  -1.060
  276   2HB   LYS  14          2HB       LYS  14  -4.979  -0.818   0.107
  277   1HG   LYS  14          1HG       LYS  14  -5.817  -3.423  -1.192
  278   2HG   LYS  14          2HG       LYS  14  -5.104  -3.295   0.413
  279   1HD   LYS  14          1HD       LYS  14  -6.970  -2.190   1.299
  280   2HD   LYS  14          2HD       LYS  14  -7.539  -1.674  -0.288
  281   1HE   LYS  14          1HE       LYS  14  -7.824  -4.214  -0.782
  282   2HE   LYS  14          2HE       LYS  14  -7.744  -4.403   0.981
  283   1HZ   LYS  14          1HZ       LYS  14  -9.489  -2.401  -0.335
  284   2HZ   LYS  14          2HZ       LYS  14 -10.027  -3.969   0.032
  285   3HZ   LYS  14          3HZ       LYS  14  -9.537  -2.929   1.279
  286    H    GLN  15           H        GLN  15  -3.746  -0.756  -3.337
  287    HA   GLN  15           HA       GLN  15  -2.826   1.940  -2.951
  288   1HB   GLN  15          1HB       GLN  15  -2.179  -0.523  -4.373
  289   2HB   GLN  15          2HB       GLN  15  -1.826   0.880  -5.366
  290   1HG   GLN  15          1HG       GLN  15  -0.239   1.705  -3.876
  291   2HG   GLN  15          2HG       GLN  15  -0.981   0.896  -2.497
  292   1HE2  GLN  15          2HE2      GLN  15  -0.996  -1.668  -2.826
  293   2HE2  GLN  15          1HE2      GLN  15   0.473  -2.327  -3.363
  294    H    ALA  16           H        ALA  16  -4.483   0.325  -5.664
  295    HA   ALA  16           HA       ALA  16  -4.747   2.711  -7.265
  296   1HB   ALA  16          1HB       ALA  16  -4.886   0.361  -8.085
  297   2HB   ALA  16          2HB       ALA  16  -6.394   0.153  -7.194
  298   3HB   ALA  16          3HB       ALA  16  -6.316   1.289  -8.541
  299    H    GLN  17           H        GLN  17  -6.674   1.320  -4.648
  300    HA   GLN  17           HA       GLN  17  -8.977   3.075  -5.143
  301   1HB   GLN  17          1HB       GLN  17  -8.035   1.130  -3.043
  302   2HB   GLN  17          2HB       GLN  17  -9.371   2.214  -2.664
  303   1HG   GLN  17          1HG       GLN  17  -9.373   0.588  -5.202
  304   2HG   GLN  17          2HG       GLN  17  -9.950  -0.099  -3.684
  305   1HE2  GLN  17          2HE2      GLN  17 -11.422   1.800  -2.472
  306   2HE2  GLN  17          1HE2      GLN  17 -12.651   2.402  -3.477
  307    H    TRP  18           H        TRP  18  -6.085   3.011  -3.167
  308    HA   TRP  18           HA       TRP  18  -6.683   5.440  -1.665
  309   1HB   TRP  18          1HB       TRP  18  -5.178   3.687  -0.814
  310   2HB   TRP  18          2HB       TRP  18  -4.171   3.831  -2.240
  311    HD1  TRP  18           HD1      TRP  18  -4.818   5.505   1.091
  312    HE1  TRP  18           HE1      TRP  18  -3.151   7.460   1.368
  313    HE3  TRP  18           HE3      TRP  18  -2.816   5.583  -3.531
  314    HZ2  TRP  18           HZ2      TRP  18  -1.195   8.852  -0.205
  315    HZ3  TRP  18           HZ3      TRP  18  -1.079   7.178  -4.145
  316    HH2  TRP  18           HH2      TRP  18  -0.247   8.799  -2.508
  317    H    LYS  19           H        LYS  19  -4.579   4.537  -4.351
  318    HA   LYS  19           HA       LYS  19  -3.438   7.080  -4.908
  319   1HB   LYS  19          1HB       LYS  19  -4.035   4.602  -6.544
  320   2HB   LYS  19          2HB       LYS  19  -3.186   5.984  -7.218
  321   1HG   LYS  19          1HG       LYS  19  -1.435   5.789  -5.523
  322   2HG   LYS  19          2HG       LYS  19  -2.288   4.438  -4.779
  323   1HD   LYS  19          1HD       LYS  19  -1.821   2.990  -6.541
  324   2HD   LYS  19          2HD       LYS  19  -1.605   4.306  -7.696
  325   1HE   LYS  19          1HE       LYS  19   0.606   4.522  -7.197
  326   2HE   LYS  19          2HE       LYS  19   0.314   4.366  -5.453
  327   1HZ   LYS  19          1HZ       LYS  19  -0.202   1.962  -5.932
  328   2HZ   LYS  19          2HZ       LYS  19   0.464   2.201  -7.473
  329   3HZ   LYS  19          3HZ       LYS  19   1.430   2.405  -6.090
  330    H    ALA  20           H        ALA  20  -6.434   5.519  -5.905
  331    HA   ALA  20           HA       ALA  20  -7.218   7.349  -7.914
  332   1HB   ALA  20          1HB       ALA  20  -8.546   5.469  -6.015
  333   2HB   ALA  20          2HB       ALA  20  -9.562   6.575  -6.937
  334   3HB   ALA  20          3HB       ALA  20  -8.516   5.431  -7.778
  335    H    ALA  21           H        ALA  21  -7.332   7.531  -4.410
  336    HA   ALA  21           HA       ALA  21  -8.529  10.259  -4.639
  337   1HB   ALA  21          1HB       ALA  21  -9.828   8.276  -3.568
  338   2HB   ALA  21          2HB       ALA  21  -8.703   8.468  -2.223
  339   3HB   ALA  21          3HB       ALA  21  -9.771   9.797  -2.675
  340    H    ASN  22           H        ASN  22  -5.696   9.368  -4.639
  341    HA   ASN  22           HA       ASN  22  -4.748  11.289  -2.610
  342   1HB   ASN  22          1HB       ASN  22  -3.967   8.365  -2.615
  343   2HB   ASN  22          2HB       ASN  22  -3.151   9.613  -1.679
  344   1HD2  ASN  22          2HD2      ASN  22  -5.386   7.254  -1.328
  345   2HD2  ASN  22          1HD2      ASN  22  -6.334   7.912  -0.083
  346    HA   PRO  23           HA       PRO  23  -2.151  10.769  -6.514
  347   1HB   PRO  23          1HB       PRO  23  -3.003  13.002  -7.860
  348   2HB   PRO  23          2HB       PRO  23  -3.736  11.402  -8.098
  349   1HG   PRO  23          1HG       PRO  23  -4.706  13.711  -6.500
  350   2HG   PRO  23          2HG       PRO  23  -5.618  12.535  -7.460
  351   1HD   PRO  23          1HD       PRO  23  -5.389  12.447  -4.731
  352   2HD   PRO  23          2HD       PRO  23  -5.721  11.024  -5.736
  353    H    LEU  24           H        LEU  24  -3.263  13.250  -4.367
  354    HA   LEU  24           HA       LEU  24  -1.186  15.204  -4.638
  355   1HB   LEU  24          1HB       LEU  24  -2.267  16.137  -2.793
  356   2HB   LEU  24          2HB       LEU  24  -3.527  15.033  -3.329
  357    HG   LEU  24           HG       LEU  24  -1.451  14.248  -1.258
  358   1HD1  LEU  24          1HD1      LEU  24  -2.993  16.291  -0.722
  359   2HD1  LEU  24          2HD1      LEU  24  -4.256  15.070  -0.571
  360   3HD1  LEU  24          3HD1      LEU  24  -2.830  14.998   0.465
  361   1HD2  LEU  24          1HD2      LEU  24  -3.355  12.754  -2.672
  362   2HD2  LEU  24          2HD2      LEU  24  -2.553  12.256  -1.184
  363   3HD2  LEU  24          3HD2      LEU  24  -4.123  13.058  -1.118
  364    H    LEU  25           H        LEU  25  -1.462  12.193  -2.845
  365    HA   LEU  25           HA       LEU  25   1.249  12.513  -1.671
  366   1HB   LEU  25          1HB       LEU  25  -1.209  10.840  -1.241
  367   2HB   LEU  25          2HB       LEU  25   0.342  10.181  -0.713
  368    HG   LEU  25           HG       LEU  25  -0.358  12.998   0.040
  369   1HD1  LEU  25          1HD1      LEU  25  -1.691  10.512   0.994
  370   2HD1  LEU  25          2HD1      LEU  25  -1.205  11.672   2.229
  371   3HD1  LEU  25          3HD1      LEU  25  -2.302  12.165   0.940
  372   1HD2  LEU  25          1HD2      LEU  25   1.331  10.738   1.104
  373   2HD2  LEU  25          2HD2      LEU  25   1.817  12.385   0.699
  374   3HD2  LEU  25          3HD2      LEU  25   0.867  12.079   2.153
  375    H    VAL  26           H        VAL  26   0.676  12.158  -4.493
  376    HA   VAL  26           HA       VAL  26   2.098   9.589  -5.014
  377    HB   VAL  26           HB       VAL  26  -0.540  10.646  -5.791
  378   1HG1  VAL  26          1HG1      VAL  26   1.411   9.775  -7.932
  379   2HG1  VAL  26          2HG1      VAL  26  -0.329   9.558  -8.123
  380   3HG1  VAL  26          3HG1      VAL  26   0.339  11.177  -7.919
  381   1HG2  VAL  26          1HG2      VAL  26   0.366   8.350  -4.764
  382   2HG2  VAL  26          2HG2      VAL  26  -1.097   8.414  -5.747
  383   3HG2  VAL  26          3HG2      VAL  26   0.428   7.900  -6.470
  384    H    GLY  27           H        GLY  27   3.375   9.708  -7.071
  385   1HA   GLY  27          1HA       GLY  27   4.803  12.199  -7.313
  386   2HA   GLY  27          2HA       GLY  27   4.991  10.809  -8.381
  387    H    VAL  28           H        VAL  28   2.550  13.331  -7.674
  388    HA   VAL  28           HA       VAL  28   0.935  14.277  -9.146
  389    HB   VAL  28           HB       VAL  28   3.040  15.621  -9.195
  390   1HG1  VAL  28          1HG1      VAL  28   3.629  13.795 -11.535
  391   2HG1  VAL  28          2HG1      VAL  28   4.417  15.362 -11.341
  392   3HG1  VAL  28          3HG1      VAL  28   4.634  14.109 -10.120
  393   1HG2  VAL  28          1HG2      VAL  28   0.896  16.073 -10.618
  394   2HG2  VAL  28          2HG2      VAL  28   2.364  16.978 -10.989
  395   3HG2  VAL  28          3HG2      VAL  28   1.904  15.596 -11.984
  396    H    SER  29           H        SER  29   1.104  11.497  -9.612
  397    HA   SER  29           HA       SER  29   0.481  11.393 -12.530
  398   1HB   SER  29          1HB       SER  29   2.843  10.650 -11.952
  399   2HB   SER  29          2HB       SER  29   2.120   9.339 -11.024
  400    HG   SER  29           HG       SER  29   2.512   9.539 -13.674
  401    H    ALA  30           H        ALA  30   0.032   8.602 -12.526
  402    HA   ALA  30           HA       ALA  30  -1.638   7.011 -12.006
  403   1HB   ALA  30          1HB       ALA  30  -0.589   8.064  -9.606
  404   2HB   ALA  30          2HB       ALA  30  -2.338   8.073  -9.389
  405   3HB   ALA  30          3HB       ALA  30  -1.508   6.568  -9.785
  406    H    LYS  31           H        LYS  31  -2.528   9.057 -13.565
  407    HA   LYS  31           HA       LYS  31  -5.184   9.789 -12.375
  408   1HB   LYS  31          1HB       LYS  31  -3.454  11.254 -14.396
  409   2HB   LYS  31          2HB       LYS  31  -5.015  11.816 -13.795
  410   1HG   LYS  31          1HG       LYS  31  -3.950  11.588 -11.439
  411   2HG   LYS  31          2HG       LYS  31  -2.410  11.553 -12.300
  412   1HD   LYS  31          1HD       LYS  31  -4.494  13.734 -12.609
  413   2HD   LYS  31          2HD       LYS  31  -3.066  13.858 -11.582
  414   1HE   LYS  31          1HE       LYS  31  -2.623  13.050 -14.426
  415   2HE   LYS  31          2HE       LYS  31  -3.027  14.749 -14.108
  416   1HZ   LYS  31          1HZ       LYS  31  -1.322  14.715 -12.331
  417   2HZ   LYS  31          2HZ       LYS  31  -0.859  13.164 -12.837
  418   3HZ   LYS  31          3HZ       LYS  31  -0.671  14.488 -13.884
  419    HA   PRO  32           HA       PRO  32  -6.563   7.291 -15.815
  420   1HB   PRO  32          1HB       PRO  32  -9.246   7.641 -15.413
  421   2HB   PRO  32          2HB       PRO  32  -8.261   6.532 -14.439
  422   1HG   PRO  32          1HG       PRO  32  -9.232   9.266 -13.790
  423   2HG   PRO  32          2HG       PRO  32  -9.073   7.847 -12.746
  424   1HD   PRO  32          1HD       PRO  32  -7.296   9.923 -12.768
  425   2HD   PRO  32          2HD       PRO  32  -6.871   8.263 -12.297
  426    H    VAL  33           H        VAL  33  -7.920   7.703 -17.803
  427    HA   VAL  33           HA       VAL  33  -8.345  10.616 -18.354
  428    HB   VAL  33           HB       VAL  33  -7.241  10.224 -20.555
  429   1HG1  VAL  33          1HG1      VAL  33  -5.587   9.428 -18.139
  430   2HG1  VAL  33          2HG1      VAL  33  -4.937  10.011 -19.673
  431   3HG1  VAL  33          3HG1      VAL  33  -5.917  11.078 -18.667
  432   1HG2  VAL  33          1HG2      VAL  33  -7.758   7.750 -20.585
  433   2HG2  VAL  33          2HG2      VAL  33  -6.088   8.141 -20.996
  434   3HG2  VAL  33          3HG2      VAL  33  -6.480   7.529 -19.389
  435    H    ASN  34           H        ASN  34 -10.098  11.034 -19.746
  436    HA   ASN  34           HA       ASN  34 -11.470   8.768 -21.080
  437   1HB   ASN  34          1HB       ASN  34 -12.123   9.477 -18.504
  438   2HB   ASN  34          2HB       ASN  34 -13.254  10.455 -19.441
  439   1HD2  ASN  34          2HD2      ASN  34 -14.172   8.999 -21.453
  440   2HD2  ASN  34          1HD2      ASN  34 -14.753   7.477 -20.977
  441    H    ARG  35           H        ARG  35 -12.424   9.477 -22.967
  442    HA   ARG  35           HA       ARG  35 -13.577  12.083 -23.355
  443   1HB   ARG  35          1HB       ARG  35 -10.688  11.777 -23.615
  444   2HB   ARG  35          2HB       ARG  35 -11.410  12.351 -25.119
  445   1HG   ARG  35          1HG       ARG  35 -11.966  14.367 -24.229
  446   2HG   ARG  35          2HG       ARG  35 -12.464  13.658 -22.693
  447   1HD   ARG  35          1HD       ARG  35  -9.602  13.359 -23.001
  448   2HD   ARG  35          2HD       ARG  35 -10.060  15.061 -23.207
  449    HE   ARG  35           HE       ARG  35 -10.296  13.537 -20.743
  450   1HH1  ARG  35          1HH1      ARG  35 -11.680  16.069 -22.673
  451   2HH1  ARG  35          2HH1      ARG  35 -12.402  16.867 -21.317
  452   1HH2  ARG  35          1HH2      ARG  35 -11.239  14.583 -18.990
  453   2HH2  ARG  35          2HH2      ARG  35 -12.153  16.031 -19.242
  454    HA   PRO  36           HA       PRO  36 -13.254   9.906 -27.595
  455   1HB   PRO  36          1HB       PRO  36 -11.706   7.659 -27.811
  456   2HB   PRO  36          2HB       PRO  36 -11.079   9.296 -28.091
  457   1HG   PRO  36          1HG       PRO  36 -10.820   7.556 -25.690
  458   2HG   PRO  36          2HG       PRO  36  -9.634   8.640 -26.433
  459   1HD   PRO  36          1HD       PRO  36 -11.049   9.276 -24.200
  460   2HD   PRO  36          2HD       PRO  36 -10.445  10.485 -25.351
  Start of MODEL   23
    1   1H5*    G   1          1H5*        G   1  11.725 -15.658   1.541
    2   2H5*    G   1          2H5*        G   1  12.988 -16.602   2.362
    3    H4*    G   1           H4*        G   1  10.992 -18.462   2.149
    4    H3*    G   1           H3*        G   1   9.709 -15.732   2.520
    5    H2*    G   1           H2*        G   1   8.219 -16.688   4.090
    6   2HO*    G   1          2HO*        G   1   7.569 -18.680   3.960
    7    H1*    G   1           H1*        G   1  10.108 -18.387   5.235
    8    H8     G   1           H8         G   1  11.597 -14.969   4.730
    9    H1     G   1           H1         G   1   7.511 -15.317   9.677
   10   1H2     G   1          1H2         G   1   6.160 -17.141   9.336
   11   2H2     G   1          2H2         G   1   6.999 -18.541   8.704
   12   1H5*    C   2          1H5*        C   2   5.951 -16.860   1.067
   13   2H5*    C   2          2H5*        C   2   7.053 -16.531   2.424
   14    H4*    C   2           H4*        C   2   4.715 -18.326   2.935
   15    H3*    C   2           H3*        C   2   4.529 -15.335   2.459
   16    H2*    C   2           H2*        C   2   3.105 -15.117   4.311
   17   2HO*    C   2          2HO*        C   2   2.314 -17.579   3.598
   18    H1*    C   2           H1*        C   2   4.322 -17.067   5.906
   19   1H4     C   2          1H4         C   2   6.402 -11.576   8.267
   20   2H4     C   2          2H4         C   2   7.536 -11.394   6.951
   21    H5     C   2           H5         C   2   7.443 -12.811   4.968
   22    H6     C   2           H6         C   2   6.757 -15.032   4.181
   23   1H5*    C   3          1H5*        C   3   0.166 -13.790   1.424
   24   2H5*    C   3          2H5*        C   3   1.330 -12.541   1.905
   25    H4*    C   3           H4*        C   3  -0.408 -14.288   3.635
   26    H3*    C   3           H3*        C   3   0.250 -11.349   3.392
   27    H2*    C   3           H2*        C   3  -0.051 -11.038   5.689
   28   2HO*    C   3          2HO*        C   3  -0.881 -13.553   6.378
   29    H1*    C   3           H1*        C   3   1.045 -13.459   6.507
   30   1H4     C   3          1H4         C   3   5.343  -8.687   6.996
   31   2H4     C   3          2H4         C   3   6.242  -9.513   5.743
   32    H5     C   3           H5         C   3   4.939 -10.830   4.087
   33    H6     C   3           H6         C   3   3.125 -12.419   3.879
   34   1H5*    C   4          1H5*        C   4  -3.970  -9.995   4.474
   35   2H5*    C   4          2H5*        C   4  -2.198 -10.038   4.472
   36    H4*    C   4           H4*        C   4  -3.921  -9.636   6.933
   37    H3*    C   4           H3*        C   4  -2.507  -7.658   5.116
   38    H2*    C   4           H2*        C   4  -1.853  -6.396   6.954
   39   2HO*    C   4          2HO*        C   4  -3.191  -7.782   8.920
   40    H1*    C   4           H1*        C   4  -1.397  -8.523   8.686
   41   1H4     C   4          1H4         C   4   3.942  -6.241   5.800
   42   2H4     C   4          2H4         C   4   4.301  -7.935   5.582
   43    H5     C   4           H5         C   4   1.981  -8.839   4.612
   44    H6     C   4           H6         C   4  -0.221  -9.281   5.390
   45   1H5*    U   5          1H5*        U   5  -4.824  -4.324   6.160
   46   2H5*    U   5          2H5*        U   5  -3.524  -5.507   6.297
   47    H4*    U   5           H4*        U   5  -4.010  -3.909   8.743
   48    H3*    U   5           H3*        U   5  -2.925  -2.664   6.184
   49    H2*    U   5           H2*        U   5  -1.300  -1.558   7.470
   50   2HO*    U   5          2HO*        U   5  -2.042  -0.666   9.225
   51    H1*    U   5           H1*        U   5  -0.995  -3.607   9.372
   52    H3     U   5           H3         U   5   2.867  -2.449   7.128
   53    H5     U   5           H5         U   5   1.202  -5.702   5.102
   54    H6     U   5           H6         U   5  -0.888  -5.198   6.221
   55   1H5*    G   6          1H5*        G   6  -2.210  -0.160   7.451
   56   2H5*    G   6          2H5*        G   6  -2.576   1.319   8.353
   57    H4*    G   6           H4*        G   6  -1.832   2.693   6.642
   58    H3*    G   6           H3*        G   6  -2.471   0.399   4.750
   59    H2*    G   6           H2*        G   6  -0.867   1.221   3.270
   60   2HO*    G   6          2HO*        G   6  -1.509   3.639   4.443
   61    H1*    G   6           H1*        G   6   0.896   2.199   5.239
   62    H8     G   6           H8         G   6  -0.645  -1.337   5.160
   63    H1     G   6           H1         G   6   5.269  -0.830   2.686
   64   1H2     G   6          1H2         G   6   5.748   1.365   2.383
   65   2H2     G   6          2H2         G   6   4.993   2.509   3.476
   66   1H5*    A   7          1H5*        A   7  -4.403   1.407   0.717
   67   2H5*    A   7          2H5*        A   7  -3.288   0.026   0.747
   68    H4*    A   7           H4*        A   7  -2.654   1.525  -1.045
   69    H3*    A   7           H3*        A   7  -0.788   1.665   1.349
   70    H2*    A   7           H2*        A   7   0.540   3.205   0.127
   71   2HO*    A   7          2HO*        A   7  -0.893   2.546  -2.224
   72    H1*    A   7           H1*        A   7  -1.604   4.381  -1.223
   73    H8     A   7           H8         A   7  -2.512   4.469   2.360
   74   1H6     A   7          1H6         A   7   1.599   8.802   3.362
   75   2H6     A   7          2H6         A   7  -0.146   8.779   3.484
   76    H2     A   7           H2         A   7   2.084   7.444  -0.994
   77   1H5*    A   8          1H5*        A   8   1.194   0.853  -1.666
   78   2H5*    A   8          2H5*        A   8   2.581  -0.232  -1.912
   79    H4*    A   8           H4*        A   8   3.385   2.001  -2.221
   80    H3*    A   8           H3*        A   8   4.044   0.876   0.521
   81    H2*    A   8           H2*        A   8   5.205   2.856   1.075
   82   2HO*    A   8          2HO*        A   8   5.205   4.462  -0.895
   83    H1*    A   8           H1*        A   8   3.403   4.578  -0.222
   84    H8     A   8           H8         A   8   1.354   2.082   1.600
   85   1H6     A   8          1H6         A   8   1.496   3.979   6.090
   86   2H6     A   8          2H6         A   8   2.282   5.392   6.757
   87    H2     A   8           H2         A   8   5.189   6.818   3.647
   88   1H5*    A   9          2H5*        A   9   8.668  -0.264  -2.420
   89   2H5*    A   9          1H5*        A   9   7.632   0.539  -1.221
   90    H4*    A   9           H4*        A   9   9.643   1.742  -2.737
   91    H3*    A   9           H3*        A   9   7.257   2.870  -1.245
   92    H2*    A   9           H2*        A   9   7.874   5.028  -2.011
   93   2HO*    A   9          2HO*        A   9   9.888   5.243  -3.225
   94    H1*    A   9           H1*        A   9   8.588   4.169  -4.572
   95    H8     A   9           H8         A   9   6.104   5.266  -2.179
   96   1H6     A   9          1H6         A   9   2.027   5.580  -6.477
   97   2H6     A   9          2H6         A   9   1.771   4.709  -4.982
   98    H2     A   9           H2         A   9   5.320   2.628  -7.978
   99   1H5*    A  10          1H5*        A  10  10.187   1.696   3.752
  100   2H5*    A  10          2H5*        A  10   8.471   1.990   3.409
  101    H4*    A  10           H4*        A  10  10.307   4.345   3.679
  102    H3*    A  10           H3*        A  10   9.297   2.604   5.930
  103    H2*    A  10           H2*        A  10   8.679   4.491   7.185
  104   2HO*    A  10          2HO*        A  10  10.720   5.651   5.806
  105    H1*    A  10           H1*        A  10   7.783   6.049   5.056
  106    H8     A  10           H8         A  10   6.256   3.026   4.011
  107   1H6     A  10          1H6         A  10   2.900   2.163   8.005
  108   2H6     A  10          2H6         A  10   1.947   3.629   7.950
  109    H2     A  10           H2         A  10   5.592   6.131   9.598
  110   1H5*    A  11          1H5*        A  11  10.529   4.807   9.091
  111   2H5*    A  11          2H5*        A  11  11.116   3.449  10.078
  112    H4*    A  11           H4*        A  11   8.768   4.573  10.570
  113    H3*    A  11           H3*        A  11   9.401   1.614  10.558
  114    H2*    A  11           H2*        A  11   7.141   1.118  11.010
  115   2HO*    A  11          2HO*        A  11   5.669   2.920  11.499
  116    H1*    A  11           H1*        A  11   6.034   3.131   9.458
  117    H8     A  11           H8         A  11   8.832   1.534   7.529
  118   1H6     A  11          1H6         A  11   4.680  -2.312   5.311
  119   2H6     A  11          2H6         A  11   6.307  -2.584   5.878
  120    H2     A  11           H2         A  11   2.871  -0.355   9.030
  121   1H5*    G  12          1H5*        G  12   9.268  -1.423  13.371
  122   2H5*    G  12          2H5*        G  12   9.183  -0.502  11.858
  123    H4*    G  12           H4*        G  12   6.997   0.226  13.619
  124    H3*    G  12           H3*        G  12   7.371  -2.707  13.015
  125    H2*    G  12           H2*        G  12   5.069  -2.884  12.498
  126   2HO*    G  12          2HO*        G  12   3.666  -1.784  13.582
  127    H1*    G  12           H1*        G  12   4.848  -0.392  11.240
  128    H8     G  12           H8         G  12   7.848  -1.446   9.614
  129    H1     G  12           H1         G  12   3.036  -5.434   8.124
  130   1H2     G  12          1H2         G  12   1.200  -4.804   9.334
  131   2H2     G  12          2H2         G  12   1.558  -4.362  10.989
  132   1H5*    G  13          1H5*        G  13   4.333  -2.911  15.693
  133   2H5*    G  13          2H5*        G  13   4.714  -3.822  17.171
  134    H4*    G  13           H4*        G  13   2.684  -4.749  16.317
  135    H3*    G  13           H3*        G  13   5.096  -6.418  15.587
  136    H2*    G  13           H2*        G  13   3.704  -7.894  14.424
  137   2HO*    G  13          2HO*        G  13   1.236  -7.087  14.817
  138    H1*    G  13           H1*        G  13   1.907  -6.000  13.444
  139    H8     G  13           H8         G  13   5.441  -4.814  12.953
  140    H1     G  13           H1         G  13   3.521  -9.130   8.593
  141   1H2     G  13          1H2         G  13   1.465  -9.838   9.119
  142   2H2     G  13          2H2         G  13   0.953  -9.784  10.792
  143   1H5*    G  14          1H5*        G  14   1.083  -9.053  17.346
  144   2H5*    G  14          2H5*        G  14   2.162 -10.105  18.291
  145    H4*    G  14           H4*        G  14   0.492 -11.342  16.846
  146    H3*    G  14           H3*        G  14   3.457 -11.721  16.355
  147    H2*    G  14           H2*        G  14   2.929 -13.310  14.682
  148   2HO*    G  14          2HO*        G  14   0.569 -13.519  16.115
  149    H1*    G  14           H1*        G  14   0.730 -11.931  13.666
  150    H8     G  14           H8         G  14   3.428  -9.436  14.315
  151    H1     G  14           H1         G  14   4.493 -13.001   9.061
  152   1H2     G  14          1H2         G  14   2.699 -14.440   8.847
  153   2H2     G  14          2H2         G  14   2.254 -15.176  10.370
  154   1H5*    C  15          1H5*        C  15   1.743 -15.238  16.497
  155   2H5*    C  15          2H5*        C  15   2.423 -16.469  17.588
  156    H4*    C  15           H4*        C  15   2.188 -17.487  15.419
  157    H3*    C  15           H3*        C  15   5.054 -16.693  16.020
  158    H2*    C  15           H2*        C  15   5.688 -17.645  13.959
  159   2HO*    C  15          2HO*        C  15   4.135 -19.539  14.493
  160    H1*    C  15           H1*        C  15   3.308 -16.970  12.606
  161   1H4     C  15          1H4         C  15   7.780 -13.091  10.350
  162   2H4     C  15          2H4         C  15   7.956 -12.297  11.904
  163    H5     C  15           H5         C  15   6.298 -12.686  13.681
  164    H6     C  15           H6         C  15   4.605 -14.205  14.501
  165   2H    ASP   2          2H        ASP   2   9.921 -11.532  -1.726
  166   1H    ASP   2          1H        ASP   2   9.698 -13.215  -1.686
  167   3H    ASP   2          3H        ASP   2  11.177 -12.540  -1.195
  168    HA   ASP   2           HA       ASP   2  10.105 -13.045   0.818
  169   1HB   ASP   2          1HB       ASP   2   9.388 -10.176   0.166
  170   2HB   ASP   2          2HB       ASP   2   9.845 -10.833   1.735
  171    H    ALA   3           H        ALA   3   8.001 -11.668   2.009
  172    HA   ALA   3           HA       ALA   3   5.629 -12.782   0.551
  173   1HB   ALA   3          1HB       ALA   3   6.269 -13.890   2.669
  174   2HB   ALA   3          2HB       ALA   3   6.133 -12.345   3.508
  175   3HB   ALA   3          3HB       ALA   3   4.699 -13.100   2.812
  176    H    GLN   4           H        GLN   4   6.750 -10.088   2.594
  177    HA   GLN   4           HA       GLN   4   4.279  -8.598   2.390
  178   1HB   GLN   4          1HB       GLN   4   6.074  -8.336   4.142
  179   2HB   GLN   4          2HB       GLN   4   7.113  -7.632   2.906
  180   1HG   GLN   4          1HG       GLN   4   5.363  -5.882   2.501
  181   2HG   GLN   4          2HG       GLN   4   4.450  -6.541   3.859
  182   1HE2  GLN   4          2HE2      GLN   4   5.867  -3.856   3.534
  183   2HE2  GLN   4          1HE2      GLN   4   6.899  -3.755   4.877
  184    H    THR   5           H        THR   5   7.467  -8.109   0.872
  185    HA   THR   5           HA       THR   5   6.764  -6.100  -0.972
  186    HB   THR   5           HB       THR   5   8.559  -8.517  -1.393
  187    HG1  THR   5           HG1      THR   5   9.090  -5.947  -0.312
  188   1HG2  THR   5          1HG2      THR   5   8.280  -5.840  -2.740
  189   2HG2  THR   5          2HG2      THR   5   9.793  -6.747  -2.809
  190   3HG2  THR   5          3HG2      THR   5   8.313  -7.443  -3.475
  191    H    ARG   6           H        ARG   6   6.205  -9.572  -1.010
  192    HA   ARG   6           HA       ARG   6   5.067  -9.743  -3.681
  193   1HB   ARG   6          1HB       ARG   6   5.632 -11.398  -1.366
  194   2HB   ARG   6          2HB       ARG   6   3.995 -11.712  -1.951
  195   1HG   ARG   6          1HG       ARG   6   5.729 -11.518  -4.228
  196   2HG   ARG   6          2HG       ARG   6   6.476 -12.617  -3.068
  197   1HD   ARG   6          1HD       ARG   6   3.586 -12.819  -3.989
  198   2HD   ARG   6          2HD       ARG   6   4.917 -13.814  -4.614
  199    HE   ARG   6           HE       ARG   6   5.057 -13.992  -1.806
  200   1HH1  ARG   6          1HH1      ARG   6   2.822 -14.760  -4.349
  201   2HH1  ARG   6          2HH1      ARG   6   2.122 -16.090  -3.491
  202   1HH2  ARG   6          1HH2      ARG   6   4.137 -15.725  -0.699
  203   2HH2  ARG   6          2HH2      ARG   6   2.860 -16.635  -1.437
  204    H    ARG   7           H        ARG   7   3.822  -9.528  -0.367
  205    HA   ARG   7           HA       ARG   7   1.064  -9.626  -0.971
  206   1HB   ARG   7          1HB       ARG   7   1.713  -9.860   1.275
  207   2HB   ARG   7          2HB       ARG   7   2.804  -8.483   1.192
  208   1HG   ARG   7          1HG       ARG   7   0.577  -7.117   0.800
  209   2HG   ARG   7          2HG       ARG   7  -0.174  -8.520   1.559
  210   1HD   ARG   7          1HD       ARG   7   0.509  -7.832   3.598
  211   2HD   ARG   7          2HD       ARG   7   2.190  -7.730   3.041
  212    HE   ARG   7           HE       ARG   7   0.321  -5.498   3.187
  213   1HH1  ARG   7          1HH1      ARG   7   3.061  -6.831   1.542
  214   2HH1  ARG   7          2HH1      ARG   7   3.635  -5.298   1.008
  215   1HH2  ARG   7          1HH2      ARG   7   1.071  -3.507   2.491
  216   2HH2  ARG   7          2HH2      ARG   7   2.514  -3.418   1.542
  217    H    ARG   8           H        ARG   8   3.384  -6.972  -1.054
  218    HA   ARG   8           HA       ARG   8   1.670  -4.728  -1.300
  219   1HB   ARG   8          1HB       ARG   8   4.292  -5.049  -1.236
  220   2HB   ARG   8          2HB       ARG   8   4.142  -5.099  -2.990
  221   1HG   ARG   8          1HG       ARG   8   4.515  -2.817  -2.543
  222   2HG   ARG   8          2HG       ARG   8   2.764  -2.919  -2.727
  223   1HD   ARG   8          1HD       ARG   8   3.417  -1.588  -0.713
  224   2HD   ARG   8          2HD       ARG   8   2.505  -3.044  -0.274
  225    HE   ARG   8           HE       ARG   8   4.472  -3.918   0.704
  226   1HH1  ARG   8          1HH1      ARG   8   5.209  -1.313  -1.464
  227   2HH1  ARG   8          2HH1      ARG   8   6.887  -1.290  -1.048
  228   1HH2  ARG   8          1HH2      ARG   8   6.653  -3.877   1.237
  229   2HH2  ARG   8          2HH2      ARG   8   7.702  -2.731   0.471
  230    H    GLU   9           H        GLU   9   2.776  -7.053  -3.731
  231    HA   GLU   9           HA       GLU   9   1.468  -5.803  -5.968
  232   1HB   GLU   9          1HB       GLU   9   2.057  -8.732  -5.379
  233   2HB   GLU   9          2HB       GLU   9   1.718  -8.066  -6.977
  234   1HG   GLU   9          1HG       GLU   9   3.847  -6.591  -5.638
  235   2HG   GLU   9          2HG       GLU   9   4.238  -8.305  -5.782
  236    H    ARG  10           H        ARG  10   0.477  -7.947  -3.403
  237    HA   ARG  10           HA       ARG  10  -2.217  -8.395  -4.419
  238   1HB   ARG  10          1HB       ARG  10  -0.479  -9.254  -2.270
  239   2HB   ARG  10          2HB       ARG  10  -2.045  -8.782  -1.612
  240   1HG   ARG  10          1HG       ARG  10  -3.150 -10.496  -2.650
  241   2HG   ARG  10          2HG       ARG  10  -2.122 -10.424  -4.082
  242   1HD   ARG  10          1HD       ARG  10  -0.286 -11.291  -2.311
  243   2HD   ARG  10          2HD       ARG  10  -1.743 -11.977  -1.566
  244    HE   ARG  10           HE       ARG  10  -0.603 -12.790  -4.119
  245   1HH1  ARG  10          1HH1      ARG  10  -3.523 -12.420  -2.275
  246   2HH1  ARG  10          2HH1      ARG  10  -4.377 -13.633  -3.165
  247   1HH2  ARG  10          1HH2      ARG  10  -1.724 -14.365  -5.267
  248   2HH2  ARG  10          2HH2      ARG  10  -3.365 -14.730  -4.850
  249    H    ARG  11           H        ARG  11  -0.532  -5.839  -2.824
  250    HA   ARG  11           HA       ARG  11  -2.989  -4.725  -1.614
  251   1HB   ARG  11          1HB       ARG  11  -0.124  -3.753  -1.833
  252   2HB   ARG  11          2HB       ARG  11  -1.405  -2.896  -0.983
  253   1HG   ARG  11          1HG       ARG  11  -0.295  -5.636  -0.310
  254   2HG   ARG  11          2HG       ARG  11  -0.135  -4.168   0.643
  255   1HD   ARG  11          1HD       ARG  11  -2.137  -4.516   1.648
  256   2HD   ARG  11          2HD       ARG  11  -2.943  -4.782   0.094
  257    HE   ARG  11           HE       ARG  11  -1.398  -7.060   0.434
  258   1HH1  ARG  11          1HH1      ARG  11  -3.803  -5.395   2.305
  259   2HH1  ARG  11          2HH1      ARG  11  -4.372  -6.838   3.074
  260   1HH2  ARG  11          1HH2      ARG  11  -2.146  -8.927   1.439
  261   2HH2  ARG  11          2HH2      ARG  11  -3.440  -8.827   2.587
  262    H    ALA  12           H        ALA  12  -1.698  -4.843  -4.714
  263    HA   ALA  12           HA       ALA  12  -1.833  -2.177  -5.691
  264   1HB   ALA  12          1HB       ALA  12  -1.195  -4.341  -6.895
  265   2HB   ALA  12          2HB       ALA  12  -2.920  -4.675  -7.051
  266   3HB   ALA  12          3HB       ALA  12  -2.222  -3.256  -7.831
  267    H    GLU  13           H        GLU  13  -4.341  -4.379  -4.630
  268    HA   GLU  13           HA       GLU  13  -6.572  -2.855  -5.725
  269   1HB   GLU  13          1HB       GLU  13  -6.301  -4.987  -3.574
  270   2HB   GLU  13          2HB       GLU  13  -7.846  -4.398  -4.189
  271   1HG   GLU  13          1HG       GLU  13  -7.016  -5.037  -6.516
  272   2HG   GLU  13          2HG       GLU  13  -5.695  -5.885  -5.710
  273    H    LYS  14           H        LYS  14  -4.705  -2.982  -2.719
  274    HA   LYS  14           HA       LYS  14  -6.455  -1.106  -1.288
  275   1HB   LYS  14          1HB       LYS  14  -3.615  -2.116  -0.827
  276   2HB   LYS  14          2HB       LYS  14  -4.589  -1.250   0.364
  277   1HG   LYS  14          1HG       LYS  14  -5.498  -3.835  -0.917
  278   2HG   LYS  14          2HG       LYS  14  -4.575  -3.789   0.587
  279   1HD   LYS  14          1HD       LYS  14  -6.373  -2.135   1.422
  280   2HD   LYS  14          2HD       LYS  14  -7.336  -2.692   0.052
  281   1HE   LYS  14          1HE       LYS  14  -7.321  -4.966   0.858
  282   2HE   LYS  14          2HE       LYS  14  -6.120  -4.570   2.105
  283   1HZ   LYS  14          1HZ       LYS  14  -8.783  -3.273   1.881
  284   2HZ   LYS  14          2HZ       LYS  14  -8.440  -4.555   2.941
  285   3HZ   LYS  14          3HZ       LYS  14  -7.651  -3.062   3.125
  286    H    GLN  15           H        GLN  15  -3.496  -1.103  -3.147
  287    HA   GLN  15           HA       GLN  15  -2.732   1.649  -2.770
  288   1HB   GLN  15          1HB       GLN  15  -1.961  -0.774  -4.214
  289   2HB   GLN  15          2HB       GLN  15  -1.729   0.655  -5.208
  290   1HG   GLN  15          1HG       GLN  15  -0.165   1.581  -3.748
  291   2HG   GLN  15          2HG       GLN  15  -0.799   0.696  -2.362
  292   1HE2  GLN  15          2HE2      GLN  15  -0.563  -1.828  -2.621
  293   2HE2  GLN  15          1HE2      GLN  15   0.914  -2.371  -3.261
  294    H    ALA  16           H        ALA  16  -4.345  -0.109  -5.419
  295    HA   ALA  16           HA       ALA  16  -4.862   2.231  -7.025
  296   1HB   ALA  16          1HB       ALA  16  -6.150  -0.515  -6.830
  297   2HB   ALA  16          2HB       ALA  16  -6.509   0.639  -8.114
  298   3HB   ALA  16          3HB       ALA  16  -4.881  -0.019  -7.950
  299    H    GLN  17           H        GLN  17  -6.569   0.715  -4.326
  300    HA   GLN  17           HA       GLN  17  -9.027   2.266  -4.712
  301   1HB   GLN  17          1HB       GLN  17  -7.820   0.410  -2.687
  302   2HB   GLN  17          2HB       GLN  17  -9.143   1.447  -2.159
  303   1HG   GLN  17          1HG       GLN  17  -9.843   0.334  -4.704
  304   2HG   GLN  17          2HG       GLN  17  -9.310  -0.978  -3.654
  305   1HE2  GLN  17          2HE2      GLN  17 -11.100   2.074  -2.929
  306   2HE2  GLN  17          1HE2      GLN  17 -12.405   1.297  -2.171
  307    H    TRP  18           H        TRP  18  -6.064   2.469  -2.842
  308    HA   TRP  18           HA       TRP  18  -6.782   4.875  -1.365
  309   1HB   TRP  18          1HB       TRP  18  -5.101   3.276  -0.561
  310   2HB   TRP  18          2HB       TRP  18  -4.182   3.461  -2.041
  311    HD1  TRP  18           HD1      TRP  18  -4.826   5.194   1.272
  312    HE1  TRP  18           HE1      TRP  18  -3.273   7.257   1.427
  313    HE3  TRP  18           HE3      TRP  18  -2.986   5.244  -3.419
  314    HZ2  TRP  18           HZ2      TRP  18  -1.466   8.710  -0.248
  315    HZ3  TRP  18           HZ3      TRP  18  -1.371   6.923  -4.135
  316    HH2  TRP  18           HH2      TRP  18  -0.592   8.647  -2.577
  317    H    LYS  19           H        LYS  19  -4.712   4.111  -4.124
  318    HA   LYS  19           HA       LYS  19  -3.836   6.729  -4.782
  319   1HB   LYS  19          1HB       LYS  19  -4.309   4.183  -6.357
  320   2HB   LYS  19          2HB       LYS  19  -3.617   5.621  -7.092
  321   1HG   LYS  19          1HG       LYS  19  -1.769   5.597  -5.488
  322   2HG   LYS  19          2HG       LYS  19  -2.460   4.180  -4.697
  323   1HD   LYS  19          1HD       LYS  19  -1.835   2.758  -6.381
  324   2HD   LYS  19          2HD       LYS  19  -2.039   3.985  -7.632
  325   1HE   LYS  19          1HE       LYS  19   0.256   4.016  -7.626
  326   2HE   LYS  19          2HE       LYS  19   0.054   5.031  -6.184
  327   1HZ   LYS  19          1HZ       LYS  19  -0.025   2.081  -5.999
  328   2HZ   LYS  19          2HZ       LYS  19   1.455   2.913  -5.955
  329   3HZ   LYS  19          3HZ       LYS  19   0.279   3.215  -4.772
  330    H    ALA  20           H        ALA  20  -6.731   4.891  -5.582
  331    HA   ALA  20           HA       ALA  20  -7.804   6.598  -7.564
  332   1HB   ALA  20          1HB       ALA  20  -8.764   4.575  -5.618
  333   2HB   ALA  20          2HB       ALA  20  -9.993   5.631  -6.316
  334   3HB   ALA  20          3HB       ALA  20  -8.985   4.638  -7.368
  335    H    ALA  21           H        ALA  21  -7.716   6.841  -4.062
  336    HA   ALA  21           HA       ALA  21  -9.174   9.443  -4.254
  337   1HB   ALA  21          1HB       ALA  21 -10.068   7.270  -2.984
  338   2HB   ALA  21          2HB       ALA  21  -9.002   7.873  -1.715
  339   3HB   ALA  21          3HB       ALA  21 -10.321   8.881  -2.310
  340    H    ASN  22           H        ASN  22  -6.292   8.791  -4.468
  341    HA   ASN  22           HA       ASN  22  -5.327  10.858  -2.599
  342   1HB   ASN  22          1HB       ASN  22  -4.322   7.999  -2.583
  343   2HB   ASN  22          2HB       ASN  22  -3.532   9.339  -1.754
  344   1HD2  ASN  22          2HD2      ASN  22  -5.577   6.835  -1.173
  345   2HD2  ASN  22          1HD2      ASN  22  -6.462   7.463   0.131
  346    HA   PRO  23           HA       PRO  23  -3.144  10.336  -6.753
  347   1HB   PRO  23          1HB       PRO  23  -4.272  12.471  -8.053
  348   2HB   PRO  23          2HB       PRO  23  -4.941  10.829  -8.147
  349   1HG   PRO  23          1HG       PRO  23  -5.829  13.143  -6.510
  350   2HG   PRO  23          2HG       PRO  23  -6.790  11.895  -7.321
  351   1HD   PRO  23          1HD       PRO  23  -6.248  11.900  -4.640
  352   2HD   PRO  23          2HD       PRO  23  -6.595  10.431  -5.567
  353    H    LEU  24           H        LEU  24  -4.128  12.875  -4.595
  354    HA   LEU  24           HA       LEU  24  -2.226  14.908  -5.202
  355   1HB   LEU  24          1HB       LEU  24  -3.052  15.836  -3.218
  356   2HB   LEU  24          2HB       LEU  24  -4.318  14.657  -3.541
  357    HG   LEU  24           HG       LEU  24  -1.917  14.005  -1.805
  358   1HD1  LEU  24          1HD1      LEU  24  -4.460  15.445  -1.154
  359   2HD1  LEU  24          2HD1      LEU  24  -3.765  14.351   0.042
  360   3HD1  LEU  24          3HD1      LEU  24  -2.828  15.725  -0.546
  361   1HD2  LEU  24          1HD2      LEU  24  -3.914  12.391  -2.873
  362   2HD2  LEU  24          2HD2      LEU  24  -2.943  11.994  -1.457
  363   3HD2  LEU  24          3HD2      LEU  24  -4.525  12.752  -1.263
  364    H    LEU  25           H        LEU  25  -2.039  11.957  -3.316
  365    HA   LEU  25           HA       LEU  25   0.819  12.431  -2.630
  366   1HB   LEU  25          1HB       LEU  25  -1.472  10.716  -1.717
  367   2HB   LEU  25          2HB       LEU  25   0.163  10.094  -1.470
  368    HG   LEU  25           HG       LEU  25  -0.495  12.911  -0.656
  369   1HD1  LEU  25          1HD1      LEU  25  -2.148  11.115   0.291
  370   2HD1  LEU  25          2HD1      LEU  25  -0.767  10.613   1.267
  371   3HD1  LEU  25          3HD1      LEU  25  -1.396  12.255   1.406
  372   1HD2  LEU  25          1HD2      LEU  25   1.539  10.799   0.025
  373   2HD2  LEU  25          2HD2      LEU  25   1.802  12.473  -0.466
  374   3HD2  LEU  25          3HD2      LEU  25   1.217  12.111   1.159
  375    H    VAL  26           H        VAL  26  -0.154  12.036  -5.283
  376    HA   VAL  26           HA       VAL  26   1.348   9.619  -6.110
  377    HB   VAL  26           HB       VAL  26  -1.565  10.095  -6.004
  378   1HG1  VAL  26          1HG1      VAL  26  -0.297   9.102  -8.573
  379   2HG1  VAL  26          2HG1      VAL  26  -2.003   8.912  -8.162
  380   3HG1  VAL  26          3HG1      VAL  26  -1.322  10.526  -8.377
  381   1HG2  VAL  26          1HG2      VAL  26  -0.221   8.189  -4.994
  382   2HG2  VAL  26          2HG2      VAL  26  -1.633   7.704  -5.932
  383   3HG2  VAL  26          3HG2      VAL  26  -0.021   7.567  -6.634
  384    H    GLY  27           H        GLY  27   2.083   9.875  -8.356
  385   1HA   GLY  27          1HA       GLY  27   2.697  12.466  -9.249
  386   2HA   GLY  27          2HA       GLY  27   2.569  11.077 -10.336
  387    H    VAL  28           H        VAL  28   1.490  14.069 -10.298
  388    HA   VAL  28           HA       VAL  28  -1.237  14.317 -10.175
  389    HB   VAL  28           HB       VAL  28   0.541  15.131 -12.502
  390   1HG1  VAL  28          1HG1      VAL  28  -2.159  15.264 -12.502
  391   2HG1  VAL  28          2HG1      VAL  28  -1.800  16.752 -11.620
  392   3HG1  VAL  28          3HG1      VAL  28  -1.148  16.509 -13.241
  393   1HG2  VAL  28          1HG2      VAL  28   0.044  16.201  -9.745
  394   2HG2  VAL  28          2HG2      VAL  28   1.551  16.125 -10.657
  395   3HG2  VAL  28          3HG2      VAL  28   0.342  17.348 -11.051
  396    H    SER  29           H        SER  29  -3.035  13.599 -11.334
  397    HA   SER  29           HA       SER  29  -4.269  12.072 -12.618
  398   1HB   SER  29          1HB       SER  29  -3.626  13.524 -14.412
  399   2HB   SER  29          2HB       SER  29  -1.977  12.902 -14.407
  400    HG   SER  29           HG       SER  29  -2.609  11.347 -15.665
  401    H    ALA  30           H        ALA  30  -2.209  11.080 -10.830
  402    HA   ALA  30           HA       ALA  30  -0.761   9.210 -10.462
  403   1HB   ALA  30          1HB       ALA  30  -3.543   8.757 -10.673
  404   2HB   ALA  30          2HB       ALA  30  -2.756   7.355 -11.397
  405   3HB   ALA  30          3HB       ALA  30  -2.370   7.826  -9.740
  406    H    LYS  31           H        LYS  31   0.873   9.411 -12.099
  407    HA   LYS  31           HA       LYS  31   0.584   7.416 -14.306
  408   1HB   LYS  31          1HB       LYS  31   1.833   9.141 -15.726
  409   2HB   LYS  31          2HB       LYS  31   0.164   9.544 -15.328
  410   1HG   LYS  31          1HG       LYS  31   1.003  10.914 -13.405
  411   2HG   LYS  31          2HG       LYS  31   2.652  10.591 -13.942
  412   1HD   LYS  31          1HD       LYS  31   1.037  11.509 -16.165
  413   2HD   LYS  31          2HD       LYS  31   0.956  12.659 -14.831
  414   1HE   LYS  31          1HE       LYS  31   2.870  13.282 -16.169
  415   2HE   LYS  31          2HE       LYS  31   3.514  12.495 -14.714
  416   1HZ   LYS  31          1HZ       LYS  31   3.424  10.367 -15.968
  417   2HZ   LYS  31          2HZ       LYS  31   3.045  11.246 -17.368
  418   3HZ   LYS  31          3HZ       LYS  31   4.541  11.482 -16.597
  419    HA   PRO  32           HA       PRO  32   4.457   6.613 -12.047
  420   1HB   PRO  32          1HB       PRO  32   4.572   3.956 -12.696
  421   2HB   PRO  32          2HB       PRO  32   3.605   4.581 -11.345
  422   1HG   PRO  32          1HG       PRO  32   2.743   3.781 -14.078
  423   2HG   PRO  32          2HG       PRO  32   1.934   3.539 -12.523
  424   1HD   PRO  32          1HD       PRO  32   1.230   5.484 -14.300
  425   2HD   PRO  32          2HD       PRO  32   0.983   5.621 -12.545
  426    H    VAL  33           H        VAL  33   6.116   7.489 -13.251
  427    HA   VAL  33           HA       VAL  33   7.363   5.971 -15.372
  428    HB   VAL  33           HB       VAL  33   5.355   6.834 -16.536
  429   1HG1  VAL  33          1HG1      VAL  33   5.326   8.940 -15.021
  430   2HG1  VAL  33          2HG1      VAL  33   6.476   9.610 -16.177
  431   3HG1  VAL  33          3HG1      VAL  33   4.864   9.136 -16.711
  432   1HG2  VAL  33          1HG2      VAL  33   8.025   8.023 -17.328
  433   2HG2  VAL  33          2HG2      VAL  33   7.300   6.526 -17.913
  434   3HG2  VAL  33          3HG2      VAL  33   6.603   8.080 -18.369
  435    H    ASN  34           H        ASN  34   6.974   9.060 -13.704
  436    HA   ASN  34           HA       ASN  34   9.476  10.232 -14.549
  437   1HB   ASN  34          1HB       ASN  34   7.193  10.855 -12.947
  438   2HB   ASN  34          2HB       ASN  34   8.623  11.141 -11.957
  439   1HD2  ASN  34          2HD2      ASN  34   6.796  12.299 -14.702
  440   2HD2  ASN  34          1HD2      ASN  34   7.797  13.621 -15.062
  441    H    ARG  35           H        ARG  35  10.563   7.946 -14.125
  442    HA   ARG  35           HA       ARG  35  11.218   7.268 -11.375
  443   1HB   ARG  35          1HB       ARG  35  11.722   6.338 -14.115
  444   2HB   ARG  35          2HB       ARG  35  13.100   6.092 -13.042
  445   1HG   ARG  35          1HG       ARG  35  11.637   4.138 -12.943
  446   2HG   ARG  35          2HG       ARG  35  11.584   4.989 -11.400
  447   1HD   ARG  35          1HD       ARG  35   9.538   6.253 -12.599
  448   2HD   ARG  35          2HD       ARG  35   9.454   4.713 -13.478
  449    HE   ARG  35           HE       ARG  35   9.838   4.080 -10.747
  450   1HH1  ARG  35          1HH1      ARG  35   7.482   5.603 -12.788
  451   2HH1  ARG  35          2HH1      ARG  35   6.146   5.149 -11.785
  452   1HH2  ARG  35          1HH2      ARG  35   8.099   3.496  -9.451
  453   2HH2  ARG  35          2HH2      ARG  35   6.494   3.961  -9.903
  454    HA   PRO  36           HA       PRO  36  15.426   9.266 -12.402
  455   1HB   PRO  36          1HB       PRO  36  15.709  10.638 -14.750
  456   2HB   PRO  36          2HB       PRO  36  16.032   8.899 -14.604
  457   1HG   PRO  36          1HG       PRO  36  13.668  10.297 -15.731
  458   2HG   PRO  36          2HG       PRO  36  14.447   8.795 -16.248
  459   1HD   PRO  36          1HD       PRO  36  12.125   8.917 -14.787
  460   2HD   PRO  36          2HD       PRO  36  13.225   7.521 -14.813
  Start of MODEL   24
    1   1H5*    G   1          1H5*        G   1  11.519 -12.999   1.708
    2   2H5*    G   1          2H5*        G   1  13.007 -13.041   2.681
    3    H4*    G   1           H4*        G   1  12.211 -15.717   2.506
    4    H3*    G   1           H3*        G   1   9.815 -13.884   2.825
    5    H2*    G   1           H2*        G   1   8.994 -15.237   4.581
    6   2HO*    G   1          2HO*        G   1  10.593 -17.197   3.355
    7    H1*    G   1           H1*        G   1  11.454 -15.883   5.691
    8    H8     G   1           H8         G   1  11.307 -12.217   4.844
    9    H1     G   1           H1         G   1   8.107 -13.778  10.190
   10   1H2     G   1          1H2         G   1   7.761 -15.984  10.229
   11   2H2     G   1          2H2         G   1   8.843 -17.035   9.342
   12   1H5*    C   2          1H5*        C   2   7.411 -18.273   2.784
   13   2H5*    C   2          2H5*        C   2   6.585 -17.662   1.331
   14    H4*    C   2           H4*        C   2   4.993 -18.385   3.105
   15    H3*    C   2           H3*        C   2   5.084 -15.427   2.412
   16    H2*    C   2           H2*        C   2   3.377 -15.030   3.974
   17   2HO*    C   2          2HO*        C   2   2.752 -17.685   3.465
   18    H1*    C   2           H1*        C   2   4.203 -16.963   5.838
   19   1H4     C   2          1H4         C   2   6.091 -11.504   8.415
   20   2H4     C   2          2H4         C   2   7.241 -11.223   7.131
   21    H5     C   2           H5         C   2   7.162 -12.514   5.055
   22    H6     C   2           H6         C   2   6.729 -14.808   4.252
   23   1H5*    C   3          1H5*        C   3   0.577 -14.038   1.355
   24   2H5*    C   3          2H5*        C   3   1.678 -12.734   1.826
   25    H4*    C   3           H4*        C   3   0.050 -14.571   3.575
   26    H3*    C   3           H3*        C   3   0.430 -11.582   3.297
   27    H2*    C   3           H2*        C   3   0.065 -11.296   5.596
   28   2HO*    C   3          2HO*        C   3  -1.398 -13.601   5.311
   29    H1*    C   3           H1*        C   3   1.356 -13.615   6.441
   30   1H4     C   3          1H4         C   3   5.406  -8.728   7.244
   31   2H4     C   3          2H4         C   3   6.128  -9.118   5.700
   32    H5     C   3           H5         C   3   5.010 -10.572   4.098
   33    H6     C   3           H6         C   3   3.318 -12.284   3.815
   34   1H5*    C   4          1H5*        C   4  -3.453 -11.587   5.264
   35   2H5*    C   4          2H5*        C   4  -4.414 -10.344   4.431
   36    H4*    C   4           H4*        C   4  -4.118  -9.889   6.866
   37    H3*    C   4           H3*        C   4  -2.871  -7.944   4.897
   38    H2*    C   4           H2*        C   4  -2.088  -6.644   6.654
   39   2HO*    C   4          2HO*        C   4  -2.777  -7.262   8.887
   40    H1*    C   4           H1*        C   4  -1.459  -8.739   8.373
   41   1H4     C   4          1H4         C   4   4.125  -7.340   5.744
   42   2H4     C   4          2H4         C   4   3.413  -7.170   4.161
   43    H5     C   4           H5         C   4   1.657  -9.168   4.118
   44    H6     C   4           H6         C   4  -0.541  -9.588   5.020
   45   1H5*    U   5          1H5*        U   5  -5.134  -4.628   6.105
   46   2H5*    U   5          2H5*        U   5  -3.796  -5.769   6.206
   47    H4*    U   5           H4*        U   5  -4.270  -4.119   8.633
   48    H3*    U   5           H3*        U   5  -3.204  -2.964   6.025
   49    H2*    U   5           H2*        U   5  -1.592  -1.786   7.271
   50   2HO*    U   5          2HO*        U   5  -3.347  -1.225   8.909
   51    H1*    U   5           H1*        U   5  -1.247  -3.773   9.233
   52    H3     U   5           H3         U   5   2.650  -2.802   7.015
   53    H5     U   5           H5         U   5   0.702  -5.671   4.665
   54    H6     U   5           H6         U   5  -1.249  -5.318   6.013
   55   1H5*    G   6          1H5*        G   6  -2.661  -0.342   7.383
   56   2H5*    G   6          2H5*        G   6  -3.190   1.145   8.186
   57    H4*    G   6           H4*        G   6  -2.180   2.481   6.640
   58    H3*    G   6           H3*        G   6  -2.913   0.372   4.576
   59    H2*    G   6           H2*        G   6  -1.210   1.183   3.192
   60   2HO*    G   6          2HO*        G   6  -1.693   3.547   4.549
   61    H1*    G   6           H1*        G   6   0.564   1.879   5.265
   62    H8     G   6           H8         G   6  -1.284  -1.488   4.871
   63    H1     G   6           H1         G   6   4.799  -1.401   2.785
   64   1H2     G   6          1H2         G   6   5.490   0.753   2.645
   65   2H2     G   6          2H2         G   6   4.810   1.877   3.805
   66   1H5*    A   7          1H5*        A   7  -4.561   2.074   0.515
   67   2H5*    A   7          2H5*        A   7  -3.642   0.556   0.479
   68    H4*    A   7           H4*        A   7  -2.745   2.075  -1.184
   69    H3*    A   7           H3*        A   7  -0.967   1.786   1.264
   70    H2*    A   7           H2*        A   7   0.592   3.222   0.207
   71   2HO*    A   7          2HO*        A   7  -0.168   3.729  -2.173
   72    H1*    A   7           H1*        A   7  -1.321   4.766  -1.121
   73    H8     A   7           H8         A   7  -2.383   4.768   2.407
   74   1H6     A   7          1H6         A   7   0.560   8.597   3.942
   75   2H6     A   7          2H6         A   7   2.280   8.278   3.954
   76    H2     A   7           H2         A   7   2.830   7.164  -0.473
   77   1H5*    A   8          1H5*        A   8   1.108   0.746  -1.758
   78   2H5*    A   8          2H5*        A   8   2.370  -0.499  -1.841
   79    H4*    A   8           H4*        A   8   3.415   1.659  -2.039
   80    H3*    A   8           H3*        A   8   3.786   0.369   0.677
   81    H2*    A   8           H2*        A   8   5.035   2.239   1.417
   82   2HO*    A   8          2HO*        A   8   5.582   2.494  -1.267
   83    H1*    A   8           H1*        A   8   3.538   4.172   0.063
   84    H8     A   8           H8         A   8   1.163   1.767   1.649
   85   1H6     A   8          1H6         A   8   1.873   3.496   6.704
   86   2H6     A   8          2H6         A   8   1.096   5.033   6.399
   87    H2     A   8           H2         A   8   5.080   6.259   4.053
   88   1H5*    A   9          2H5*        A   9   8.345  -1.839  -1.233
   89   2H5*    A   9          1H5*        A   9   7.336  -0.715  -0.298
   90    H4*    A   9           H4*        A   9   9.239  -0.018  -2.209
   91    H3*    A   9           H3*        A   9   6.876   1.481  -1.048
   92    H2*    A   9           H2*        A   9   7.348   3.278  -2.510
   93   2HO*    A   9          2HO*        A   9   9.420   2.716  -3.895
   94    H1*    A   9           H1*        A   9   8.023   1.660  -4.684
   95    H8     A   9           H8         A   9   5.536   3.366  -2.658
   96   1H6     A   9          1H6         A   9   1.174   1.607  -6.656
   97   2H6     A   9          2H6         A   9   1.398   2.306  -5.068
   98    H2     A   9           H2         A   9   4.808  -0.963  -7.336
   99   1H5*    A  10          1H5*        A  10  10.171   1.212   3.614
  100   2H5*    A  10          2H5*        A  10   8.428   1.441   3.408
  101    H4*    A  10           H4*        A  10  10.191   3.854   3.694
  102    H3*    A  10           H3*        A  10   9.353   1.970   5.902
  103    H2*    A  10           H2*        A  10   8.766   3.778   7.282
  104   2HO*    A  10          2HO*        A  10  10.790   4.976   6.116
  105    H1*    A  10           H1*        A  10   7.714   5.409   5.283
  106    H8     A  10           H8         A  10   6.232   2.317   4.260
  107   1H6     A  10          1H6         A  10   2.466   2.082   7.551
  108   2H6     A  10          2H6         A  10   2.756   2.004   9.274
  109    H2     A  10           H2         A  10   5.732   5.391   9.885
  110   1H5*    A  11          1H5*        A  11  10.786   3.894   8.964
  111   2H5*    A  11          2H5*        A  11  11.397   2.534   9.932
  112    H4*    A  11           H4*        A  11   9.116   3.645  10.573
  113    H3*    A  11           H3*        A  11   9.601   0.666  10.343
  114    H2*    A  11           H2*        A  11   7.341   0.257  10.885
  115   2HO*    A  11          2HO*        A  11   6.015   2.165  11.524
  116    H1*    A  11           H1*        A  11   6.268   2.418   9.525
  117    H8     A  11           H8         A  11   8.880   0.763   7.375
  118   1H6     A  11          1H6         A  11   4.964  -3.532   5.931
  119   2H6     A  11          2H6         A  11   5.439  -2.240   4.854
  120    H2     A  11           H2         A  11   2.858  -0.789   9.018
  121   1H5*    G  12          1H5*        G  12   9.688  -2.530  12.823
  122   2H5*    G  12          2H5*        G  12   9.492  -1.433  11.444
  123    H4*    G  12           H4*        G  12   7.417  -0.986  13.424
  124    H3*    G  12           H3*        G  12   7.743  -3.782  12.324
  125    H2*    G  12           H2*        G  12   5.408  -3.892  12.007
  126   2HO*    G  12          2HO*        G  12   4.553  -1.536  12.928
  127    H1*    G  12           H1*        G  12   5.129  -1.257  11.136
  128    H8     G  12           H8         G  12   7.980  -2.160   9.167
  129    H1     G  12           H1         G  12   2.955  -5.868   7.647
  130   1H2     G  12          1H2         G  12   1.234  -5.297   9.085
  131   2H2     G  12          2H2         G  12   1.782  -5.144  10.740
  132   1H5*    G  13          1H5*        G  13   4.445  -4.024  17.323
  133   2H5*    G  13          2H5*        G  13   5.671  -5.108  16.669
  134    H4*    G  13           H4*        G  13   2.830  -5.461  16.819
  135    H3*    G  13           H3*        G  13   5.166  -7.047  15.735
  136    H2*    G  13           H2*        G  13   3.739  -8.447  14.580
  137   2HO*    G  13          2HO*        G  13   1.480  -8.505  14.917
  138    H1*    G  13           H1*        G  13   1.854  -6.544  13.843
  139    H8     G  13           H8         G  13   5.270  -5.135  13.366
  140    H1     G  13           H1         G  13   3.552  -9.273   8.743
  141   1H2     G  13          1H2         G  13   1.358  -9.958   9.272
  142   2H2     G  13          2H2         G  13   1.338 -10.497  10.937
  143   1H5*    G  14          1H5*        G  14   0.435  -9.358  16.658
  144   2H5*    G  14          2H5*        G  14   0.588 -10.086  18.272
  145    H4*    G  14           H4*        G  14   0.250 -12.009  17.034
  146    H3*    G  14           H3*        G  14   3.219 -11.491  16.719
  147    H2*    G  14           H2*        G  14   3.319 -13.442  15.368
  148   2HO*    G  14          2HO*        G  14   1.005 -14.493  15.206
  149    H1*    G  14           H1*        G  14   0.905 -12.964  14.049
  150    H8     G  14           H8         G  14   3.235 -10.004  14.697
  151    H1     G  14           H1         G  14   4.388 -13.167   9.220
  152   1H2     G  14          1H2         G  14   2.911 -14.833   9.019
  153   2H2     G  14          2H2         G  14   2.240 -15.541  10.472
  154   1H5*    C  15          1H5*        C  15   2.830 -15.274  17.093
  155   2H5*    C  15          2H5*        C  15   3.767 -16.025  18.405
  156    H4*    C  15           H4*        C  15   4.321 -17.302  16.499
  157    H3*    C  15           H3*        C  15   6.419 -15.168  16.978
  158    H2*    C  15           H2*        C  15   7.623 -16.017  15.134
  159   2HO*    C  15          2HO*        C  15   7.469 -18.241  15.789
  160    H1*    C  15           H1*        C  15   5.344 -16.771  13.650
  161   1H4     C  15          1H4         C  15   7.434 -11.607  10.665
  162   2H4     C  15          2H4         C  15   7.414 -10.656  12.141
  163    H5     C  15           H5         C  15   6.162 -11.486  14.100
  164    H6     C  15           H6         C  15   5.267 -13.468  15.177
  165   2H    ASP   2          2H        ASP   2   8.752 -11.986  -3.196
  166   1H    ASP   2          1H        ASP   2   8.675 -13.596  -2.661
  167   3H    ASP   2          3H        ASP   2  10.152 -12.764  -2.628
  168    HA   ASP   2           HA       ASP   2   9.436 -12.719  -0.403
  169   1HB   ASP   2          1HB       ASP   2   8.439 -10.167  -1.697
  170   2HB   ASP   2          2HB       ASP   2   9.152 -10.342  -0.096
  171    H    ALA   3           H        ALA   3   7.446 -11.108   0.689
  172    HA   ALA   3           HA       ALA   3   4.913 -12.497  -0.122
  173   1HB   ALA   3          1HB       ALA   3   6.011 -13.390   1.945
  174   2HB   ALA   3          2HB       ALA   3   5.880 -11.786   2.664
  175   3HB   ALA   3          3HB       ALA   3   4.424 -12.696   2.267
  176    H    GLN   4           H        GLN   4   6.323  -9.670   1.504
  177    HA   GLN   4           HA       GLN   4   3.846  -8.180   1.614
  178   1HB   GLN   4          1HB       GLN   4   6.322  -8.004   2.743
  179   2HB   GLN   4          2HB       GLN   4   6.486  -6.795   1.472
  180   1HG   GLN   4          1HG       GLN   4   3.950  -6.385   2.687
  181   2HG   GLN   4          2HG       GLN   4   5.114  -6.571   3.981
  182   1HE2  GLN   4          2HE2      GLN   4   4.920  -4.879   0.794
  183   2HE2  GLN   4          1HE2      GLN   4   5.689  -3.468   1.339
  184    H    THR   5           H        THR   5   6.730  -7.834  -0.460
  185    HA   THR   5           HA       THR   5   5.677  -5.936  -2.277
  186    HB   THR   5           HB       THR   5   7.520  -8.318  -2.708
  187    HG1  THR   5           HG1      THR   5   9.008  -7.067  -1.903
  188   1HG2  THR   5          1HG2      THR   5   6.833  -5.931  -4.412
  189   2HG2  THR   5          2HG2      THR   5   8.374  -6.770  -4.588
  190   3HG2  THR   5          3HG2      THR   5   6.862  -7.634  -4.867
  191    H    ARG   6           H        ARG   6   5.153  -9.383  -1.906
  192    HA   ARG   6           HA       ARG   6   3.715  -9.810  -4.393
  193   1HB   ARG   6          1HB       ARG   6   4.541 -11.244  -2.000
  194   2HB   ARG   6          2HB       ARG   6   2.871 -11.639  -2.431
  195   1HG   ARG   6          1HG       ARG   6   4.011 -11.750  -4.886
  196   2HG   ARG   6          2HG       ARG   6   5.399 -12.216  -3.900
  197   1HD   ARG   6          1HD       ARG   6   2.770 -13.514  -3.285
  198   2HD   ARG   6          2HD       ARG   6   3.651 -14.052  -4.729
  199    HE   ARG   6           HE       ARG   6   5.397 -13.791  -2.418
  200   1HH1  ARG   6          1HH1      ARG   6   3.103 -15.829  -4.040
  201   2HH1  ARG   6          2HH1      ARG   6   3.750 -17.288  -3.371
  202   1HH2  ARG   6          1HH2      ARG   6   6.228 -15.692  -1.555
  203   2HH2  ARG   6          2HH2      ARG   6   5.510 -17.212  -1.971
  204    H    ARG   7           H        ARG   7   2.777  -9.364  -0.970
  205    HA   ARG   7           HA       ARG   7  -0.034  -9.483  -1.452
  206   1HB   ARG   7          1HB       ARG   7   0.856  -9.697   0.769
  207   2HB   ARG   7          2HB       ARG   7   1.710  -8.158   0.643
  208   1HG   ARG   7          1HG       ARG   7  -0.618  -7.089   0.348
  209   2HG   ARG   7          2HG       ARG   7  -1.264  -8.626   0.917
  210   1HD   ARG   7          1HD       ARG   7  -0.390  -8.350   3.056
  211   2HD   ARG   7          2HD       ARG   7   0.911  -7.286   2.497
  212    HE   ARG   7           HE       ARG   7  -0.592  -5.473   2.632
  213   1HH1  ARG   7          1HH1      ARG   7  -2.276  -8.507   2.611
  214   2HH1  ARG   7          2HH1      ARG   7  -3.820  -7.786   2.902
  215   1HH2  ARG   7          1HH2      ARG   7  -2.607  -4.546   3.012
  216   2HH2  ARG   7          2HH2      ARG   7  -4.009  -5.556   3.129
  217    H    ARG   8           H        ARG   8   2.342  -6.926  -1.725
  218    HA   ARG   8           HA       ARG   8   0.693  -4.623  -1.877
  219   1HB   ARG   8          1HB       ARG   8   3.357  -5.276  -2.099
  220   2HB   ARG   8          2HB       ARG   8   2.976  -4.868  -3.766
  221   1HG   ARG   8          1HG       ARG   8   3.796  -2.943  -2.363
  222   2HG   ARG   8          2HG       ARG   8   2.250  -2.665  -3.153
  223   1HD   ARG   8          1HD       ARG   8   2.459  -2.007  -0.638
  224   2HD   ARG   8          2HD       ARG   8   1.044  -2.955  -1.117
  225    HE   ARG   8           HE       ARG   8   3.343  -4.600  -0.371
  226   1HH1  ARG   8          1HH1      ARG   8   0.516  -2.925   0.738
  227   2HH1  ARG   8          2HH1      ARG   8   0.344  -3.909   2.142
  228   1HH2  ARG   8          1HH2      ARG   8   3.102  -5.859   1.444
  229   2HH2  ARG   8          2HH2      ARG   8   1.799  -5.564   2.545
  230    H    GLU   9           H        GLU   9   1.591  -6.981  -4.377
  231    HA   GLU   9           HA       GLU   9   0.298  -5.645  -6.557
  232   1HB   GLU   9          1HB       GLU   9   0.682  -8.605  -5.953
  233   2HB   GLU   9          2HB       GLU   9   0.277  -7.952  -7.540
  234   1HG   GLU   9          1HG       GLU   9   2.507  -6.466  -6.701
  235   2HG   GLU   9          2HG       GLU   9   2.870  -8.129  -6.240
  236    H    ARG  10           H        ARG  10  -0.803  -7.559  -3.886
  237    HA   ARG  10           HA       ARG  10  -3.558  -7.819  -4.827
  238   1HB   ARG  10          1HB       ARG  10  -1.812  -8.828  -2.759
  239   2HB   ARG  10          2HB       ARG  10  -3.285  -8.208  -2.018
  240   1HG   ARG  10          1HG       ARG  10  -4.498  -9.949  -2.787
  241   2HG   ARG  10          2HG       ARG  10  -3.873  -9.742  -4.423
  242   1HD   ARG  10          1HD       ARG  10  -1.675 -10.805  -3.406
  243   2HD   ARG  10          2HD       ARG  10  -2.801 -11.451  -2.196
  244    HE   ARG  10           HE       ARG  10  -4.065 -11.911  -4.635
  245   1HH1  ARG  10          1HH1      ARG  10  -0.998 -12.700  -3.215
  246   2HH1  ARG  10          2HH1      ARG  10  -0.834 -14.175  -4.103
  247   1HH2  ARG  10          1HH2      ARG  10  -3.841 -13.830  -5.784
  248   2HH2  ARG  10          2HH2      ARG  10  -2.435 -14.814  -5.550
  249    H    ARG  11           H        ARG  11  -1.622  -5.403  -3.373
  250    HA   ARG  11           HA       ARG  11  -3.970  -4.046  -2.154
  251   1HB   ARG  11          1HB       ARG  11  -0.988  -3.483  -2.150
  252   2HB   ARG  11          2HB       ARG  11  -2.198  -2.539  -1.283
  253   1HG   ARG  11          1HG       ARG  11  -1.612  -5.486  -0.847
  254   2HG   ARG  11          2HG       ARG  11  -1.131  -4.182   0.224
  255   1HD   ARG  11          1HD       ARG  11  -3.192  -4.119   1.191
  256   2HD   ARG  11          2HD       ARG  11  -4.001  -4.106  -0.383
  257    HE   ARG  11           HE       ARG  11  -2.837  -6.691   0.083
  258   1HH1  ARG  11          1HH1      ARG  11  -5.460  -4.631   1.044
  259   2HH1  ARG  11          2HH1      ARG  11  -6.505  -5.950   1.444
  260   1HH2  ARG  11          1HH2      ARG  11  -4.203  -8.398   0.607
  261   2HH2  ARG  11          2HH2      ARG  11  -5.798  -8.075   1.199
  262    H    ALA  12           H        ALA  12  -2.622  -4.260  -5.184
  263    HA   ALA  12           HA       ALA  12  -2.214  -1.551  -6.017
  264   1HB   ALA  12          1HB       ALA  12  -1.896  -3.755  -7.299
  265   2HB   ALA  12          2HB       ALA  12  -3.637  -3.745  -7.576
  266   3HB   ALA  12          3HB       ALA  12  -2.635  -2.450  -8.227
  267    H    GLU  13           H        GLU  13  -5.103  -3.349  -5.198
  268    HA   GLU  13           HA       GLU  13  -6.988  -1.421  -6.307
  269   1HB   GLU  13          1HB       GLU  13  -7.232  -3.628  -4.228
  270   2HB   GLU  13          2HB       GLU  13  -8.595  -2.799  -4.979
  271   1HG   GLU  13          1HG       GLU  13  -7.242  -3.550  -7.200
  272   2HG   GLU  13          2HG       GLU  13  -6.778  -4.857  -6.110
  273    H    LYS  14           H        LYS  14  -5.326  -1.994  -3.234
  274    HA   LYS  14           HA       LYS  14  -6.836   0.057  -1.775
  275   1HB   LYS  14          1HB       LYS  14  -4.158  -1.306  -1.234
  276   2HB   LYS  14          2HB       LYS  14  -5.154  -0.468  -0.040
  277   1HG   LYS  14          1HG       LYS  14  -5.924  -2.976  -1.564
  278   2HG   LYS  14          2HG       LYS  14  -5.471  -2.894   0.138
  279   1HD   LYS  14          1HD       LYS  14  -7.698  -2.672   0.521
  280   2HD   LYS  14          2HD       LYS  14  -7.470  -1.006  -0.009
  281   1HE   LYS  14          1HE       LYS  14  -8.267  -1.458  -2.185
  282   2HE   LYS  14          2HE       LYS  14  -8.000  -3.204  -2.016
  283   1HZ   LYS  14          1HZ       LYS  14  -9.879  -1.654  -0.318
  284   2HZ   LYS  14          2HZ       LYS  14 -10.360  -2.504  -1.708
  285   3HZ   LYS  14          3HZ       LYS  14  -9.707  -3.343  -0.386
  286    H    GLN  15           H        GLN  15  -3.795  -0.302  -3.467
  287    HA   GLN  15           HA       GLN  15  -2.674   2.291  -2.933
  288   1HB   GLN  15          1HB       GLN  15  -2.183  -0.156  -4.454
  289   2HB   GLN  15          2HB       GLN  15  -1.682   1.259  -5.361
  290   1HG   GLN  15          1HG       GLN  15  -0.099   1.887  -3.767
  291   2HG   GLN  15          2HG       GLN  15  -0.937   1.036  -2.472
  292   1HE2  GLN  15          2HE2      GLN  15  -1.065  -1.480  -2.875
  293   2HE2  GLN  15          1HE2      GLN  15   0.354  -2.206  -3.463
  294    H    ALA  16           H        ALA  16  -4.348   0.919  -5.776
  295    HA   ALA  16           HA       ALA  16  -4.416   3.399  -7.249
  296   1HB   ALA  16          1HB       ALA  16  -4.733   0.997  -8.070
  297   2HB   ALA  16          2HB       ALA  16  -6.360   1.068  -7.394
  298   3HB   ALA  16          3HB       ALA  16  -5.901   2.160  -8.701
  299    H    GLN  17           H        GLN  17  -6.444   2.029  -4.713
  300    HA   GLN  17           HA       GLN  17  -8.650   3.918  -5.136
  301   1HB   GLN  17          1HB       GLN  17  -7.803   1.862  -3.102
  302   2HB   GLN  17          2HB       GLN  17  -9.085   2.998  -2.688
  303   1HG   GLN  17          1HG       GLN  17 -10.445   2.268  -4.517
  304   2HG   GLN  17          2HG       GLN  17  -9.121   1.337  -5.217
  305   1HE2  GLN  17          2HE2      GLN  17  -9.509  -0.854  -4.885
  306   2HE2  GLN  17          1HE2      GLN  17 -10.132  -1.530  -3.458
  307    H    TRP  18           H        TRP  18  -5.826   3.587  -3.080
  308    HA   TRP  18           HA       TRP  18  -6.281   6.000  -1.523
  309   1HB   TRP  18          1HB       TRP  18  -4.911   4.123  -0.722
  310   2HB   TRP  18          2HB       TRP  18  -3.864   4.263  -2.121
  311    HD1  TRP  18           HD1      TRP  18  -4.499   5.848   1.263
  312    HE1  TRP  18           HE1      TRP  18  -2.709   7.672   1.658
  313    HE3  TRP  18           HE3      TRP  18  -2.354   5.966  -3.305
  314    HZ2  TRP  18           HZ2      TRP  18  -0.626   8.987   0.200
  315    HZ3  TRP  18           HZ3      TRP  18  -0.501   7.473  -3.798
  316    HH2  TRP  18           HH2      TRP  18   0.384   8.965  -2.076
  317    H    LYS  19           H        LYS  19  -4.167   5.076  -4.196
  318    HA   LYS  19           HA       LYS  19  -2.872   7.569  -4.618
  319   1HB   LYS  19          1HB       LYS  19  -3.542   5.179  -6.352
  320   2HB   LYS  19          2HB       LYS  19  -2.620   6.543  -6.967
  321   1HG   LYS  19          1HG       LYS  19  -1.087   6.213  -4.933
  322   2HG   LYS  19          2HG       LYS  19  -1.860   4.641  -4.761
  323   1HD   LYS  19          1HD       LYS  19  -0.537   3.804  -6.374
  324   2HD   LYS  19          2HD       LYS  19  -1.164   4.994  -7.515
  325   1HE   LYS  19          1HE       LYS  19   0.692   6.316  -7.332
  326   2HE   LYS  19          2HE       LYS  19   0.802   6.070  -5.578
  327   1HZ   LYS  19          1HZ       LYS  19   1.339   3.850  -7.451
  328   2HZ   LYS  19          2HZ       LYS  19   2.561   4.964  -7.064
  329   3HZ   LYS  19          3HZ       LYS  19   1.843   4.030  -5.841
  330    H    ALA  20           H        ALA  20  -5.933   6.234  -5.737
  331    HA   ALA  20           HA       ALA  20  -6.543   8.200  -7.686
  332   1HB   ALA  20          1HB       ALA  20  -8.159   6.446  -5.848
  333   2HB   ALA  20          2HB       ALA  20  -8.936   7.503  -7.025
  334   3HB   ALA  20          3HB       ALA  20  -7.852   6.224  -7.571
  335    H    ALA  21           H        ALA  21  -6.742   8.210  -4.183
  336    HA   ALA  21           HA       ALA  21  -7.796  11.004  -4.294
  337   1HB   ALA  21          1HB       ALA  21  -8.189   8.790  -2.262
  338   2HB   ALA  21          2HB       ALA  21  -8.791  10.436  -2.056
  339   3HB   ALA  21          3HB       ALA  21  -9.410   9.426  -3.364
  340    H    ASN  22           H        ASN  22  -5.016   9.987  -4.306
  341    HA   ASN  22           HA       ASN  22  -3.996  11.755  -2.180
  342   1HB   ASN  22          1HB       ASN  22  -3.364   8.796  -2.317
  343   2HB   ASN  22          2HB       ASN  22  -2.496   9.954  -1.313
  344   1HD2  ASN  22          2HD2      ASN  22  -4.880   7.709  -1.111
  345   2HD2  ASN  22          1HD2      ASN  22  -5.803   8.358   0.157
  346    HA   PRO  23           HA       PRO  23  -1.453  11.264  -6.126
  347   1HB   PRO  23          1HB       PRO  23  -2.164  13.614  -7.346
  348   2HB   PRO  23          2HB       PRO  23  -3.009  12.082  -7.651
  349   1HG   PRO  23          1HG       PRO  23  -3.792  14.360  -5.910
  350   2HG   PRO  23          2HG       PRO  23  -4.798  13.319  -6.929
  351   1HD   PRO  23          1HD       PRO  23  -4.573  13.033  -4.220
  352   2HD   PRO  23          2HD       PRO  23  -4.975  11.697  -5.312
  353    H    LEU  24           H        LEU  24  -2.388  13.802  -3.921
  354    HA   LEU  24           HA       LEU  24  -0.180  15.585  -4.134
  355   1HB   LEU  24          1HB       LEU  24  -1.085  16.462  -2.154
  356   2HB   LEU  24          2HB       LEU  24  -2.455  15.512  -2.717
  357    HG   LEU  24           HG       LEU  24  -0.375  14.400  -0.806
  358   1HD1  LEU  24          1HD1      LEU  24  -1.830  16.513  -0.106
  359   2HD1  LEU  24          2HD1      LEU  24  -3.069  15.279   0.132
  360   3HD1  LEU  24          3HD1      LEU  24  -1.545  15.182   1.017
  361   1HD2  LEU  24          1HD2      LEU  24  -2.378  13.135  -2.256
  362   2HD2  LEU  24          2HD2      LEU  24  -1.652  12.507  -0.778
  363   3HD2  LEU  24          3HD2      LEU  24  -3.154  13.431  -0.705
  364    H    LEU  25           H        LEU  25  -0.544  12.462  -2.597
  365    HA   LEU  25           HA       LEU  25   2.269  12.536  -1.608
  366   1HB   LEU  25          1HB       LEU  25  -0.290  11.156  -0.942
  367   2HB   LEU  25          2HB       LEU  25   1.169  10.180  -0.766
  368    HG   LEU  25           HG       LEU  25   1.275  12.935   0.354
  369   1HD1  LEU  25          1HD1      LEU  25  -1.009  11.706   0.921
  370   2HD1  LEU  25          2HD1      LEU  25   0.012  10.804   2.040
  371   3HD1  LEU  25          3HD1      LEU  25  -0.112  12.559   2.177
  372   1HD2  LEU  25          1HD2      LEU  25   2.997  10.899   0.378
  373   2HD2  LEU  25          2HD2      LEU  25   2.856  11.986   1.760
  374   3HD2  LEU  25          3HD2      LEU  25   2.046  10.419   1.783
  375    H    VAL  26           H        VAL  26   1.458  12.450  -4.363
  376    HA   VAL  26           HA       VAL  26   2.820   9.989  -5.244
  377    HB   VAL  26           HB       VAL  26  -0.072  10.490  -5.173
  378   1HG1  VAL  26          1HG1      VAL  26   1.239   9.946  -7.848
  379   2HG1  VAL  26          2HG1      VAL  26  -0.419   9.460  -7.495
  380   3HG1  VAL  26          3HG1      VAL  26   0.028  11.167  -7.448
  381   1HG2  VAL  26          1HG2      VAL  26   1.711   8.137  -5.877
  382   2HG2  VAL  26          2HG2      VAL  26   0.951   8.471  -4.318
  383   3HG2  VAL  26          3HG2      VAL  26  -0.045   8.027  -5.707
  384    H    GLY  27           H        GLY  27   4.321  10.871  -6.630
  385   1HA   GLY  27          1HA       GLY  27   5.193  12.135  -8.427
  386   2HA   GLY  27          2HA       GLY  27   3.525  12.410  -8.944
  387    H    VAL  28           H        VAL  28   2.282  13.998  -7.489
  388    HA   VAL  28           HA       VAL  28   3.782  16.489  -7.269
  389    HB   VAL  28           HB       VAL  28   0.986  15.691  -6.404
  390   1HG1  VAL  28          1HG1      VAL  28   2.101  17.849  -5.463
  391   2HG1  VAL  28          2HG1      VAL  28   1.931  18.468  -7.107
  392   3HG1  VAL  28          3HG1      VAL  28   0.501  17.989  -6.193
  393   1HG2  VAL  28          1HG2      VAL  28   2.188  16.610  -9.000
  394   2HG2  VAL  28          2HG2      VAL  28   0.979  15.359  -8.717
  395   3HG2  VAL  28          3HG2      VAL  28   0.529  17.061  -8.611
  396    H    SER  29           H        SER  29   4.190  17.630  -5.271
  397    HA   SER  29           HA       SER  29   4.957  17.696  -3.027
  398   1HB   SER  29          1HB       SER  29   2.219  16.790  -3.240
  399   2HB   SER  29          2HB       SER  29   2.978  16.102  -1.808
  400    HG   SER  29           HG       SER  29   2.084  18.165  -1.395
  401    H    ALA  30           H        ALA  30   4.685  15.794  -0.993
  402    HA   ALA  30           HA       ALA  30   6.698  14.225  -0.586
  403   1HB   ALA  30          1HB       ALA  30   3.941  13.928  -0.124
  404   2HB   ALA  30          2HB       ALA  30   4.482  12.350  -0.695
  405   3HB   ALA  30          3HB       ALA  30   5.246  13.088   0.714
  406    H    LYS  31           H        LYS  31   7.857  14.063  -2.688
  407    HA   LYS  31           HA       LYS  31   6.935  11.790  -4.406
  408   1HB   LYS  31          1HB       LYS  31   7.410  14.237  -5.199
  409   2HB   LYS  31          2HB       LYS  31   9.106  13.770  -5.068
  410   1HG   LYS  31          1HG       LYS  31   8.290  11.653  -6.437
  411   2HG   LYS  31          2HG       LYS  31   6.997  12.745  -6.932
  412   1HD   LYS  31          1HD       LYS  31   8.397  14.060  -8.166
  413   2HD   LYS  31          2HD       LYS  31   9.732  13.882  -7.027
  414   1HE   LYS  31          1HE       LYS  31   9.519  11.322  -7.999
  415   2HE   LYS  31          2HE       LYS  31   9.103  12.287  -9.430
  416   1HZ   LYS  31          1HZ       LYS  31  11.452  12.759  -7.670
  417   2HZ   LYS  31          2HZ       LYS  31  11.513  12.014  -9.196
  418   3HZ   LYS  31          3HZ       LYS  31  11.054  13.645  -9.061
  419    HA   PRO  32           HA       PRO  32  10.456   9.901  -2.222
  420   1HB   PRO  32          1HB       PRO  32   9.679   7.319  -2.691
  421   2HB   PRO  32          2HB       PRO  32   9.025   8.297  -1.361
  422   1HG   PRO  32          1HG       PRO  32   7.829   7.665  -4.011
  423   2HG   PRO  32          2HG       PRO  32   7.055   7.788  -2.424
  424   1HD   PRO  32          1HD       PRO  32   6.942   9.751  -4.318
  425   2HD   PRO  32          2HD       PRO  32   6.819  10.058  -2.571
  426    H    VAL  33           H        VAL  33  12.143  10.325  -3.671
  427    HA   VAL  33           HA       VAL  33  12.193   9.547  -6.435
  428    HB   VAL  33           HB       VAL  33  14.581  10.164  -6.228
  429   1HG1  VAL  33          1HG1      VAL  33  12.330  11.777  -5.383
  430   2HG1  VAL  33          2HG1      VAL  33  13.795  12.293  -4.547
  431   3HG1  VAL  33          3HG1      VAL  33  13.752  12.256  -6.310
  432   1HG2  VAL  33          1HG2      VAL  33  13.975   9.629  -3.360
  433   2HG2  VAL  33          2HG2      VAL  33  15.464   9.356  -4.263
  434   3HG2  VAL  33          3HG2      VAL  33  15.059  10.977  -3.701
  435    H    ASN  34           H        ASN  34  13.351   7.792  -7.428
  436    HA   ASN  34           HA       ASN  34  13.216   5.261  -6.068
  437   1HB   ASN  34          1HB       ASN  34  13.864   6.369  -8.682
  438   2HB   ASN  34          2HB       ASN  34  14.946   5.038  -8.273
  439   1HD2  ASN  34          2HD2      ASN  34  11.564   5.887  -8.891
  440   2HD2  ASN  34          1HD2      ASN  34  10.997   4.290  -8.991
  441    H    ARG  35           H        ARG  35  15.287   3.804  -6.038
  442    HA   ARG  35           HA       ARG  35  17.602   5.387  -4.971
  443   1HB   ARG  35          1HB       ARG  35  16.532   2.726  -3.974
  444   2HB   ARG  35          2HB       ARG  35  17.800   3.696  -3.226
  445   1HG   ARG  35          1HG       ARG  35  14.942   4.637  -3.610
  446   2HG   ARG  35          2HG       ARG  35  15.567   3.953  -2.111
  447   1HD   ARG  35          1HD       ARG  35  17.154   6.184  -3.287
  448   2HD   ARG  35          2HD       ARG  35  15.583   6.610  -2.580
  449    HE   ARG  35           HE       ARG  35  16.753   4.857  -0.743
  450   1HH1  ARG  35          1HH1      ARG  35  17.550   7.894  -2.222
  451   2HH1  ARG  35          2HH1      ARG  35  18.466   8.449  -0.864
  452   1HH2  ARG  35          1HH2      ARG  35  17.947   5.588   1.017
  453   2HH2  ARG  35          2HH2      ARG  35  18.691   7.151   0.961
  454    HA   PRO  36           HA       PRO  36  19.525   2.893  -8.176
  455   1HB   PRO  36          1HB       PRO  36  22.004   4.036  -7.986
  456   2HB   PRO  36          2HB       PRO  36  20.652   4.799  -8.848
  457   1HG   PRO  36          1HG       PRO  36  21.724   5.362  -6.130
  458   2HG   PRO  36          2HG       PRO  36  21.108   6.480  -7.356
  459   1HD   PRO  36          1HD       PRO  36  19.668   5.679  -5.179
  460   2HD   PRO  36          2HD       PRO  36  18.933   6.194  -6.714
  Start of MODEL   25
    1   1H5*    G   1          1H5*        G   1  12.200 -16.053   2.248
    2   2H5*    G   1          2H5*        G   1  13.124 -17.565   2.096
    3    H4*    G   1           H4*        G   1  10.986 -18.829   2.010
    4    H3*    G   1           H3*        G   1   9.787 -16.068   2.405
    5    H2*    G   1           H2*        G   1   8.176 -16.979   3.881
    6   2HO*    G   1          2HO*        G   1   7.395 -18.911   3.585
    7    H1*    G   1           H1*        G   1   9.845 -18.856   5.067
    8    H8     G   1           H8         G   1  11.557 -15.505   4.709
    9    H1     G   1           H1         G   1   7.407 -15.818   9.601
   10   1H2     G   1          1H2         G   1   6.010 -17.569   9.249
   11   2H2     G   1          2H2         G   1   6.704 -18.971   8.466
   12   1H5*    C   2          1H5*        C   2   6.330 -18.628   2.254
   13   2H5*    C   2          2H5*        C   2   5.516 -18.057   0.779
   14    H4*    C   2           H4*        C   2   3.878 -18.163   2.558
   15    H3*    C   2           H3*        C   2   4.796 -15.333   1.932
   16    H2*    C   2           H2*        C   2   3.273 -14.533   3.541
   17   2HO*    C   2          2HO*        C   2   2.040 -17.080   3.323
   18    H1*    C   2           H1*        C   2   3.547 -16.719   5.301
   19   1H4     C   2          1H4         C   2   6.757 -12.105   8.185
   20   2H4     C   2          2H4         C   2   7.963 -12.060   6.921
   21    H5     C   2           H5         C   2   7.624 -13.221   4.793
   22    H6     C   2           H6         C   2   6.566 -15.226   3.830
   23   1H5*    C   3          1H5*        C   3   0.011 -13.037   1.695
   24   2H5*    C   3          2H5*        C   3   1.714 -12.787   2.144
   25    H4*    C   3           H4*        C   3  -0.162 -14.362   3.912
   26    H3*    C   3           H3*        C   3   0.172 -11.360   3.744
   27    H2*    C   3           H2*        C   3   0.187 -11.206   6.092
   28   2HO*    C   3          2HO*        C   3  -0.324 -13.818   6.721
   29    H1*    C   3           H1*        C   3   1.598 -13.564   6.575
   30   1H4     C   3          1H4         C   3   5.673  -8.649   6.971
   31   2H4     C   3          2H4         C   3   6.090  -8.890   5.291
   32    H5     C   3           H5         C   3   4.927 -10.479   3.883
   33    H6     C   3           H6         C   3   3.294 -12.281   3.832
   34   1H5*    C   4          1H5*        C   4  -3.019 -11.376   6.259
   35   2H5*    C   4          2H5*        C   4  -4.308 -10.321   5.637
   36    H4*    C   4           H4*        C   4  -3.662  -9.559   7.838
   37    H3*    C   4           H3*        C   4  -2.605  -7.765   5.619
   38    H2*    C   4           H2*        C   4  -1.737  -6.345   7.256
   39   2HO*    C   4          2HO*        C   4  -2.705  -7.506   9.518
   40    H1*    C   4           H1*        C   4  -1.092  -8.385   9.094
   41   1H4     C   4          1H4         C   4   4.056  -6.032   6.009
   42   2H4     C   4          2H4         C   4   4.411  -7.711   5.700
   43    H5     C   4           H5         C   4   2.069  -8.645   4.842
   44    H6     C   4           H6         C   4  -0.046  -9.244   5.774
   45   1H5*    U   5          1H5*        U   5  -4.970  -4.462   6.724
   46   2H5*    U   5          2H5*        U   5  -3.563  -5.512   6.884
   47    H4*    U   5           H4*        U   5  -4.097  -3.688   9.174
   48    H3*    U   5           H3*        U   5  -3.094  -2.730   6.461
   49    H2*    U   5           H2*        U   5  -1.514  -1.395   7.576
   50   2HO*    U   5          2HO*        U   5  -2.281  -1.770  10.165
   51    H1*    U   5           H1*        U   5  -1.103  -3.177   9.718
   52    H3     U   5           H3         U   5   2.753  -2.222   7.417
   53    H5     U   5           H5         U   5   1.020  -5.478   5.441
   54    H6     U   5           H6         U   5  -1.011  -4.979   6.631
   55   1H5*    G   6          1H5*        G   6  -2.485   0.021   7.540
   56   2H5*    G   6          2H5*        G   6  -2.998   1.507   8.356
   57    H4*    G   6           H4*        G   6  -2.309   2.852   6.610
   58    H3*    G   6           H3*        G   6  -2.808   0.464   4.804
   59    H2*    G   6           H2*        G   6  -1.222   1.279   3.299
   60   2HO*    G   6          2HO*        G   6  -1.190   3.763   4.672
   61    H1*    G   6           H1*        G   6   0.516   2.374   5.209
   62    H8     G   6           H8         G   6  -1.032  -1.159   5.345
   63    H1     G   6           H1         G   6   4.973  -0.851   3.067
   64   1H2     G   6          1H2         G   6   5.493   1.292   2.630
   65   2H2     G   6          2H2         G   6   4.702   2.535   3.578
   66   1H5*    A   7          1H5*        A   7  -4.675   1.639   0.592
   67   2H5*    A   7          2H5*        A   7  -3.638   0.204   0.692
   68    H4*    A   7           H4*        A   7  -2.859   1.585  -1.126
   69    H3*    A   7           H3*        A   7  -1.091   1.765   1.338
   70    H2*    A   7           H2*        A   7   0.347   3.199   0.106
   71   2HO*    A   7          2HO*        A   7   0.752   2.723  -1.883
   72    H1*    A   7           H1*        A   7  -1.684   4.392  -1.388
   73    H8     A   7           H8         A   7  -2.739   4.676   2.148
   74   1H6     A   7          1H6         A   7   0.966   9.497   2.681
   75   2H6     A   7          2H6         A   7   0.432   8.198   3.724
   76    H2     A   7           H2         A   7   2.185   7.235  -1.082
   77   1H5*    A   8          1H5*        A   8   0.962   0.543  -1.550
   78   2H5*    A   8          2H5*        A   8   2.303  -0.620  -1.624
   79    H4*    A   8           H4*        A   8   3.214   1.558  -2.047
   80    H3*    A   8           H3*        A   8   3.714   0.623   0.793
   81    H2*    A   8           H2*        A   8   4.994   2.583   1.175
   82   2HO*    A   8          2HO*        A   8   5.140   4.006  -0.889
   83    H1*    A   8           H1*        A   8   3.292   4.259  -0.303
   84    H8     A   8           H8         A   8   1.105   2.054   1.731
   85   1H6     A   8          1H6         A   8   1.617   4.225   6.181
   86   2H6     A   8          2H6         A   8   1.898   5.938   6.395
   87    H2     A   8           H2         A   8   5.159   6.776   3.339
   88   1H5*    A   9          2H5*        A   9   8.406  -0.913  -1.920
   89   2H5*    A   9          1H5*        A   9   7.382   0.036  -0.822
   90    H4*    A   9           H4*        A   9   9.439   1.011  -2.452
   91    H3*    A   9           H3*        A   9   7.120   2.368  -1.050
   92    H2*    A   9           H2*        A   9   7.812   4.417  -2.023
   93   2HO*    A   9          2HO*        A   9  10.034   4.251  -1.671
   94    H1*    A   9           H1*        A   9   8.477   3.293  -4.494
   95    H8     A   9           H8         A   9   6.032   4.699  -2.211
   96   1H6     A   9          1H6         A   9   1.468   3.666  -5.885
   97   2H6     A   9          2H6         A   9   2.227   5.228  -5.672
   98    H2     A   9           H2         A   9   5.189   1.631  -7.784
   99   1H5*    A  10          1H5*        A  10   9.898   1.399   4.027
  100   2H5*    A  10          2H5*        A  10   8.243   1.766   3.501
  101    H4*    A  10           H4*        A  10  10.178   4.033   3.524
  102    H3*    A  10           H3*        A  10   9.174   2.618   5.993
  103    H2*    A  10           H2*        A  10   8.639   4.657   7.026
  104   2HO*    A  10          2HO*        A  10  10.227   6.047   6.787
  105    H1*    A  10           H1*        A  10   7.729   5.973   4.747
  106    H8     A  10           H8         A  10   6.061   2.950   4.057
  107   1H6     A  10          1H6         A  10   2.619   2.728   7.545
  108   2H6     A  10          2H6         A  10   2.141   3.900   8.751
  109    H2     A  10           H2         A  10   5.741   6.526   9.380
  110   1H5*    A  11          1H5*        A  11  10.396   5.153   8.961
  111   2H5*    A  11          2H5*        A  11  11.008   3.863  10.020
  112    H4*    A  11           H4*        A  11   8.652   4.971  10.474
  113    H3*    A  11           H3*        A  11   9.311   2.018  10.589
  114    H2*    A  11           H2*        A  11   7.059   1.525  11.078
  115   2HO*    A  11          2HO*        A  11   5.692   3.642  11.318
  116    H1*    A  11           H1*        A  11   5.922   3.460   9.453
  117    H8     A  11           H8         A  11   8.723   1.774   7.590
  118   1H6     A  11          1H6         A  11   5.030  -2.888   6.427
  119   2H6     A  11          2H6         A  11   5.715  -1.717   5.326
  120    H2     A  11           H2         A  11   2.767  -0.018   9.200
  121   1H5*    G  12          1H5*        G  12   9.309  -0.893  13.528
  122   2H5*    G  12          2H5*        G  12   9.187  -0.039  11.980
  123    H4*    G  12           H4*        G  12   6.991   0.699  13.717
  124    H3*    G  12           H3*        G  12   7.447  -2.248  13.262
  125    H2*    G  12           H2*        G  12   5.147  -2.514  12.756
  126   2HO*    G  12          2HO*        G  12   4.127  -0.084  13.126
  127    H1*    G  12           H1*        G  12   4.854  -0.088  11.399
  128    H8     G  12           H8         G  12   7.853  -1.087   9.776
  129    H1     G  12           H1         G  12   3.127  -5.212   8.385
  130   1H2     G  12          1H2         G  12   1.434  -4.918   9.752
  131   2H2     G  12          2H2         G  12   1.561  -3.906  11.174
  132   1H5*    G  13          1H5*        G  13   6.402  -4.738  17.192
  133   2H5*    G  13          2H5*        G  13   7.223  -5.709  15.971
  134    H4*    G  13           H4*        G  13   4.419  -5.660  16.781
  135    H3*    G  13           H3*        G  13   6.230  -7.420  15.121
  136    H2*    G  13           H2*        G  13   4.422  -8.388  14.054
  137   2HO*    G  13          2HO*        G  13   2.797  -8.915  15.283
  138    H1*    G  13           H1*        G  13   2.834  -6.129  13.859
  139    H8     G  13           H8         G  13   6.091  -4.836  12.933
  140    H1     G  13           H1         G  13   3.938  -9.093   8.617
  141   1H2     G  13          1H2         G  13   2.052 -10.010   9.368
  142   2H2     G  13          2H2         G  13   1.800 -10.108  11.096
  143   1H5*    G  14          1H5*        G  14   1.341  -9.018  16.755
  144   2H5*    G  14          2H5*        G  14   1.664 -10.061  18.158
  145    H4*    G  14           H4*        G  14   0.559 -11.444  16.548
  146    H3*    G  14           H3*        G  14   3.555 -11.894  16.400
  147    H2*    G  14           H2*        G  14   3.121 -13.574  14.779
  148   2HO*    G  14          2HO*        G  14   0.386 -13.439  14.778
  149    H1*    G  14           H1*        G  14   1.080 -12.169  13.497
  150    H8     G  14           H8         G  14   4.137 -10.093  14.453
  151    H1     G  14           H1         G  14   4.635 -13.211   8.847
  152   1H2     G  14          1H2         G  14   2.679 -14.315   8.489
  153   2H2     G  14          2H2         G  14   1.935 -15.006   9.913
  154   1H5*    C  15          1H5*        C  15   1.426 -15.466  16.263
  155   2H5*    C  15          2H5*        C  15   2.085 -16.642  17.423
  156    H4*    C  15           H4*        C  15   1.860 -17.731  15.263
  157    H3*    C  15           H3*        C  15   4.728 -17.032  15.966
  158    H2*    C  15           H2*        C  15   5.412 -18.085  13.969
  159   2HO*    C  15          2HO*        C  15   3.850 -19.922  14.465
  160    H1*    C  15           H1*        C  15   3.127 -17.357  12.485
  161   1H4     C  15          1H4         C  15   7.763 -13.630  10.312
  162   2H4     C  15          2H4         C  15   8.030 -12.928  11.898
  163    H5     C  15           H5         C  15   6.313 -13.219  13.649
  164    H6     C  15           H6         C  15   4.573 -14.684  14.457
  165   2H    ASP   2          2H        ASP   2  10.540  -9.429  -0.523
  166   1H    ASP   2          1H        ASP   2  10.452 -10.940  -1.296
  167   3H    ASP   2          3H        ASP   2  11.837 -10.517  -0.408
  168    HA   ASP   2           HA       ASP   2  10.662 -11.967   1.010
  169   1HB   ASP   2          1HB       ASP   2   9.857  -9.135   1.727
  170   2HB   ASP   2          2HB       ASP   2  10.189 -10.458   2.840
  171    H    ALA   3           H        ALA   3   8.409 -11.321   2.529
  172    HA   ALA   3           HA       ALA   3   6.239 -12.055   0.642
  173   1HB   ALA   3          1HB       ALA   3   6.424 -11.903   3.668
  174   2HB   ALA   3          2HB       ALA   3   5.071 -12.590   2.770
  175   3HB   ALA   3          3HB       ALA   3   6.658 -13.355   2.695
  176    H    GLN   4           H        GLN   4   7.257  -9.374   2.675
  177    HA   GLN   4           HA       GLN   4   4.702  -8.003   2.697
  178   1HB   GLN   4          1HB       GLN   4   6.691  -7.728   4.279
  179   2HB   GLN   4          2HB       GLN   4   7.500  -6.857   2.979
  180   1HG   GLN   4          1HG       GLN   4   4.791  -5.865   3.440
  181   2HG   GLN   4          2HG       GLN   4   5.795  -5.743   4.881
  182   1HE2  GLN   4          2HE2      GLN   4   4.957  -4.048   2.126
  183   2HE2  GLN   4          1HE2      GLN   4   6.336  -3.069   1.977
  184    H    THR   5           H        THR   5   7.736  -7.288   0.950
  185    HA   THR   5           HA       THR   5   6.698  -5.354  -0.850
  186    HB   THR   5           HB       THR   5   8.787  -7.541  -1.208
  187    HG1  THR   5           HG1      THR   5   8.986  -4.792  -0.535
  188   1HG2  THR   5          1HG2      THR   5   8.165  -5.087  -2.863
  189   2HG2  THR   5          2HG2      THR   5   9.691  -5.966  -2.972
  190   3HG2  THR   5          3HG2      THR   5   8.178  -6.767  -3.397
  191    H    ARG   6           H        ARG   6   6.445  -8.830  -0.717
  192    HA   ARG   6           HA       ARG   6   5.281  -9.263  -3.339
  193   1HB   ARG   6          1HB       ARG   6   6.000 -10.720  -0.921
  194   2HB   ARG   6          2HB       ARG   6   4.424 -11.238  -1.532
  195   1HG   ARG   6          1HG       ARG   6   6.389 -10.909  -3.680
  196   2HG   ARG   6          2HG       ARG   6   6.911 -12.092  -2.480
  197   1HD   ARG   6          1HD       ARG   6   4.149 -12.115  -3.744
  198   2HD   ARG   6          2HD       ARG   6   5.510 -13.091  -4.331
  199    HE   ARG   6           HE       ARG   6   5.268 -13.436  -1.498
  200   1HH1  ARG   6          1HH1      ARG   6   3.687 -14.219  -4.489
  201   2HH1  ARG   6          2HH1      ARG   6   2.990 -15.679  -3.875
  202   1HH2  ARG   6          1HH2      ARG   6   4.354 -15.338  -0.711
  203   2HH2  ARG   6          2HH2      ARG   6   3.365 -16.310  -1.748
  204    H    ARG   7           H        ARG   7   4.018  -9.014  -0.003
  205    HA   ARG   7           HA       ARG   7   1.288  -9.373  -0.677
  206   1HB   ARG   7          1HB       ARG   7   2.020  -9.480   1.609
  207   2HB   ARG   7          2HB       ARG   7   2.718  -7.863   1.529
  208   1HG   ARG   7          1HG       ARG   7   0.359  -6.992   1.090
  209   2HG   ARG   7          2HG       ARG   7  -0.221  -8.605   1.501
  210   1HD   ARG   7          1HD       ARG   7   0.378  -8.392   3.740
  211   2HD   ARG   7          2HD       ARG   7   1.640  -7.201   3.398
  212    HE   ARG   7           HE       ARG   7  -0.025  -5.505   3.382
  213   1HH1  ARG   7          1HH1      ARG   7  -1.421  -8.673   3.306
  214   2HH1  ARG   7          2HH1      ARG   7  -3.034  -8.099   3.545
  215   1HH2  ARG   7          1HH2      ARG   7  -2.125  -4.764   3.694
  216   2HH2  ARG   7          2HH2      ARG   7  -3.432  -5.899   3.764
  217    H    ARG   8           H        ARG   8   3.389  -6.555  -0.782
  218    HA   ARG   8           HA       ARG   8   1.508  -4.466  -1.117
  219   1HB   ARG   8          1HB       ARG   8   4.248  -4.806  -1.160
  220   2HB   ARG   8          2HB       ARG   8   3.923  -4.442  -2.848
  221   1HG   ARG   8          1HG       ARG   8   4.407  -2.410  -1.455
  222   2HG   ARG   8          2HG       ARG   8   2.846  -2.359  -2.265
  223   1HD   ARG   8          1HD       ARG   8   3.061  -1.737   0.322
  224   2HD   ARG   8          2HD       ARG   8   1.654  -2.630  -0.275
  225    HE   ARG   8           HE       ARG   8   3.890  -4.363   0.471
  226   1HH1  ARG   8          1HH1      ARG   8   1.052  -2.691   1.554
  227   2HH1  ARG   8          2HH1      ARG   8   0.800  -3.751   2.893
  228   1HH2  ARG   8          1HH2      ARG   8   3.550  -5.727   2.208
  229   2HH2  ARG   8          2HH2      ARG   8   2.204  -5.458   3.263
  230    H    GLU   9           H        GLU   9   2.854  -6.744  -3.468
  231    HA   GLU   9           HA       GLU   9   1.523  -5.650  -5.766
  232   1HB   GLU   9          1HB       GLU   9   2.257  -8.535  -5.131
  233   2HB   GLU   9          2HB       GLU   9   2.016  -7.860  -6.741
  234   1HG   GLU   9          1HG       GLU   9   3.890  -6.143  -5.750
  235   2HG   GLU   9          2HG       GLU   9   4.348  -7.639  -4.934
  236    H    ARG  10           H        ARG  10   0.631  -7.843  -3.198
  237    HA   ARG  10           HA       ARG  10  -1.990  -8.523  -4.253
  238   1HB   ARG  10          1HB       ARG  10  -0.296  -9.014  -1.906
  239   2HB   ARG  10          2HB       ARG  10  -1.999  -8.845  -1.490
  240   1HG   ARG  10          1HG       ARG  10  -2.523 -10.841  -2.416
  241   2HG   ARG  10          2HG       ARG  10  -1.596 -10.490  -3.875
  242   1HD   ARG  10          1HD       ARG  10   0.366 -10.857  -1.912
  243   2HD   ARG  10          2HD       ARG  10  -0.834 -12.118  -1.575
  244    HE   ARG  10           HE       ARG  10   0.842 -11.976  -3.943
  245   1HH1  ARG  10          1HH1      ARG  10  -2.272 -12.897  -2.718
  246   2HH1  ARG  10          2HH1      ARG  10  -2.534 -14.085  -3.948
  247   1HH2  ARG  10          1HH2      ARG  10   0.491 -13.524  -5.537
  248   2HH2  ARG  10          2HH2      ARG  10  -0.980 -14.439  -5.536
  249    H    ARG  11           H        ARG  11  -0.550  -5.814  -2.671
  250    HA   ARG  11           HA       ARG  11  -3.154  -4.797  -1.680
  251   1HB   ARG  11          1HB       ARG  11  -0.309  -3.745  -1.607
  252   2HB   ARG  11          2HB       ARG  11  -1.692  -2.950  -0.856
  253   1HG   ARG  11          1HG       ARG  11  -0.616  -5.707  -0.175
  254   2HG   ARG  11          2HG       ARG  11  -0.505  -4.277   0.833
  255   1HD   ARG  11          1HD       ARG  11  -2.581  -4.657   1.676
  256   2HD   ARG  11          2HD       ARG  11  -3.269  -4.776   0.051
  257    HE   ARG  11           HE       ARG  11  -1.683  -7.113   0.644
  258   1HH1  ARG  11          1HH1      ARG  11  -4.735  -5.580   1.266
  259   2HH1  ARG  11          2HH1      ARG  11  -5.558  -7.073   1.559
  260   1HH2  ARG  11          1HH2      ARG  11  -2.761  -9.045   1.027
  261   2HH2  ARG  11          2HH2      ARG  11  -4.447  -9.028   1.425
  262    H    ALA  12           H        ALA  12  -1.725  -4.942  -4.658
  263    HA   ALA  12           HA       ALA  12  -1.747  -2.271  -5.663
  264   1HB   ALA  12          1HB       ALA  12  -1.023  -4.399  -6.833
  265   2HB   ALA  12          2HB       ALA  12  -2.726  -4.812  -7.029
  266   3HB   ALA  12          3HB       ALA  12  -2.069  -3.381  -7.822
  267    H    GLU  13           H        GLU  13  -4.319  -4.453  -4.733
  268    HA   GLU  13           HA       GLU  13  -6.484  -2.960  -5.983
  269   1HB   GLU  13          1HB       GLU  13  -6.395  -4.978  -3.707
  270   2HB   GLU  13          2HB       GLU  13  -7.855  -4.476  -4.560
  271   1HG   GLU  13          1HG       GLU  13  -6.861  -5.308  -6.687
  272   2HG   GLU  13          2HG       GLU  13  -5.463  -5.887  -5.779
  273    H    LYS  14           H        LYS  14  -4.801  -3.006  -2.866
  274    HA   LYS  14           HA       LYS  14  -6.623  -1.095  -1.593
  275   1HB   LYS  14          1HB       LYS  14  -3.834  -2.155  -0.990
  276   2HB   LYS  14          2HB       LYS  14  -4.744  -1.115   0.107
  277   1HG   LYS  14          1HG       LYS  14  -6.048  -3.605  -0.927
  278   2HG   LYS  14          2HG       LYS  14  -4.855  -3.742   0.366
  279   1HD   LYS  14          1HD       LYS  14  -6.486  -1.576   1.109
  280   2HD   LYS  14          2HD       LYS  14  -7.599  -2.804   0.505
  281   1HE   LYS  14          1HE       LYS  14  -5.423  -3.772   2.298
  282   2HE   LYS  14          2HE       LYS  14  -6.719  -2.822   3.052
  283   1HZ   LYS  14          1HZ       LYS  14  -7.266  -5.011   1.130
  284   2HZ   LYS  14          2HZ       LYS  14  -7.158  -5.286   2.801
  285   3HZ   LYS  14          3HZ       LYS  14  -8.355  -4.248   2.188
  286    H    GLN  15           H        GLN  15  -3.541  -1.129  -3.239
  287    HA   GLN  15           HA       GLN  15  -2.806   1.625  -2.943
  288   1HB   GLN  15          1HB       GLN  15  -2.006  -0.836  -4.304
  289   2HB   GLN  15          2HB       GLN  15  -1.710   0.573  -5.308
  290   1HG   GLN  15          1HG       GLN  15  -0.177   1.480  -3.815
  291   2HG   GLN  15          2HG       GLN  15  -0.925   0.687  -2.427
  292   1HE2  GLN  15          2HE2      GLN  15  -0.752  -1.815  -2.476
  293   2HE2  GLN  15          1HE2      GLN  15   0.716  -2.470  -3.030
  294    H    ALA  16           H        ALA  16  -4.289  -0.175  -5.652
  295    HA   ALA  16           HA       ALA  16  -4.703   2.137  -7.316
  296   1HB   ALA  16          1HB       ALA  16  -4.709  -0.261  -8.036
  297   2HB   ALA  16          2HB       ALA  16  -6.233  -0.490  -7.179
  298   3HB   ALA  16          3HB       ALA  16  -6.157   0.594  -8.567
  299    H    GLN  17           H        GLN  17  -6.529   0.754  -4.634
  300    HA   GLN  17           HA       GLN  17  -8.949   2.318  -5.189
  301   1HB   GLN  17          1HB       GLN  17  -7.876   0.462  -3.107
  302   2HB   GLN  17          2HB       GLN  17  -9.148   1.571  -2.596
  303   1HG   GLN  17          1HG       GLN  17  -9.654   0.242  -5.185
  304   2HG   GLN  17          2HG       GLN  17  -9.611  -0.847  -3.798
  305   1HE2  GLN  17          1HE2      GLN  17 -11.917  -1.195  -3.702
  306   2HE2  GLN  17          2HE2      GLN  17 -13.004   0.042  -3.288
  307    H    TRP  18           H        TRP  18  -6.088   2.518  -3.164
  308    HA   TRP  18           HA       TRP  18  -6.824   4.983  -1.805
  309   1HB   TRP  18          1HB       TRP  18  -5.213   3.386  -0.874
  310   2HB   TRP  18          2HB       TRP  18  -4.216   3.512  -2.310
  311    HD1  TRP  18           HD1      TRP  18  -4.991   5.330   0.920
  312    HE1  TRP  18           HE1      TRP  18  -3.437   7.386   1.108
  313    HE3  TRP  18           HE3      TRP  18  -2.904   5.262  -3.679
  314    HZ2  TRP  18           HZ2      TRP  18  -1.538   8.798  -0.509
  315    HZ3  TRP  18           HZ3      TRP  18  -1.243   6.925  -4.344
  316    HH2  TRP  18           HH2      TRP  18  -0.535   8.667  -2.783
  317    H    LYS  19           H        LYS  19  -4.618   4.110  -4.424
  318    HA   LYS  19           HA       LYS  19  -3.683   6.701  -5.114
  319   1HB   LYS  19          1HB       LYS  19  -4.065   4.094  -6.607
  320   2HB   LYS  19          2HB       LYS  19  -3.346   5.503  -7.371
  321   1HG   LYS  19          1HG       LYS  19  -1.712   5.566  -5.415
  322   2HG   LYS  19          2HG       LYS  19  -2.296   3.954  -5.009
  323   1HD   LYS  19          1HD       LYS  19  -1.579   4.360  -7.853
  324   2HD   LYS  19          2HD       LYS  19  -0.229   4.423  -6.719
  325   1HE   LYS  19          1HE       LYS  19  -0.788   2.225  -5.838
  326   2HE   LYS  19          2HE       LYS  19  -2.267   2.169  -6.818
  327   1HZ   LYS  19          1HZ       LYS  19   0.435   2.566  -7.976
  328   2HZ   LYS  19          2HZ       LYS  19  -0.290   1.039  -7.836
  329   3HZ   LYS  19          3HZ       LYS  19  -1.009   2.235  -8.806
  330    H    ALA  20           H        ALA  20  -6.549   4.864  -6.009
  331    HA   ALA  20           HA       ALA  20  -7.473   6.525  -8.110
  332   1HB   ALA  20          1HB       ALA  20  -8.736   4.702  -6.082
  333   2HB   ALA  20          2HB       ALA  20  -9.736   5.571  -7.245
  334   3HB   ALA  20          3HB       ALA  20  -8.515   4.432  -7.810
  335    H    ALA  21           H        ALA  21  -7.554   6.872  -4.624
  336    HA   ALA  21           HA       ALA  21  -8.995   9.466  -4.962
  337   1HB   ALA  21          1HB       ALA  21  -9.064   7.439  -2.710
  338   2HB   ALA  21          2HB       ALA  21  -9.890   8.998  -2.667
  339   3HB   ALA  21          3HB       ALA  21 -10.370   7.776  -3.846
  340    H    ASN  22           H        ASN  22  -6.108   8.809  -4.957
  341    HA   ASN  22           HA       ASN  22  -5.294  10.885  -3.026
  342   1HB   ASN  22          1HB       ASN  22  -4.279   8.033  -2.933
  343   2HB   ASN  22          2HB       ASN  22  -3.548   9.378  -2.062
  344   1HD2  ASN  22          1HD2      ASN  22  -5.623   6.880  -1.601
  345   2HD2  ASN  22          2HD2      ASN  22  -6.597   7.516  -0.364
  346    HA   PRO  23           HA       PRO  23  -2.748  10.376  -6.969
  347   1HB   PRO  23          1HB       PRO  23  -3.849  12.410  -8.441
  348   2HB   PRO  23          2HB       PRO  23  -4.425  10.735  -8.545
  349   1HG   PRO  23          1HG       PRO  23  -5.581  13.048  -7.087
  350   2HG   PRO  23          2HG       PRO  23  -6.394  11.725  -7.936
  351   1HD   PRO  23          1HD       PRO  23  -6.102  11.856  -5.216
  352   2HD   PRO  23          2HD       PRO  23  -6.313  10.343  -6.115
  353    H    LEU  24           H        LEU  24  -4.091  12.921  -5.017
  354    HA   LEU  24           HA       LEU  24  -2.280  15.059  -5.452
  355   1HB   LEU  24          1HB       LEU  24  -3.330  15.922  -3.540
  356   2HB   LEU  24          2HB       LEU  24  -4.483  14.669  -3.980
  357    HG   LEU  24           HG       LEU  24  -2.216  14.167  -2.026
  358   1HD1  LEU  24          1HD1      LEU  24  -4.856  15.487  -1.645
  359   2HD1  LEU  24          2HD1      LEU  24  -4.353  14.323  -0.419
  360   3HD1  LEU  24          3HD1      LEU  24  -3.340  15.723  -0.774
  361   1HD2  LEU  24          1HD2      LEU  24  -3.975  12.418  -3.291
  362   2HD2  LEU  24          2HD2      LEU  24  -3.106  12.076  -1.798
  363   3HD2  LEU  24          3HD2      LEU  24  -4.754  12.706  -1.741
  364    H    LEU  25           H        LEU  25  -2.040  12.135  -3.533
  365    HA   LEU  25           HA       LEU  25   0.699  12.813  -2.594
  366   1HB   LEU  25          1HB       LEU  25  -1.538  10.949  -1.888
  367   2HB   LEU  25          2HB       LEU  25   0.100  10.379  -1.563
  368    HG   LEU  25           HG       LEU  25  -0.563  13.159  -0.713
  369   1HD1  LEU  25          1HD1      LEU  25  -2.417  11.313  -0.075
  370   2HD1  LEU  25          2HD1      LEU  25  -1.248  10.985   1.204
  371   3HD1  LEU  25          3HD1      LEU  25  -1.943  12.598   1.038
  372   1HD2  LEU  25          1HD2      LEU  25   1.662  11.799  -0.469
  373   2HD2  LEU  25          2HD2      LEU  25   1.091  12.752   0.902
  374   3HD2  LEU  25          3HD2      LEU  25   0.829  11.008   0.869
  375    H    VAL  26           H        VAL  26   0.062  12.452  -5.317
  376    HA   VAL  26           HA       VAL  26   1.794  10.183  -6.044
  377    HB   VAL  26           HB       VAL  26  -1.165  10.389  -6.150
  378   1HG1  VAL  26          1HG1      VAL  26  -0.609  10.764  -8.557
  379   2HG1  VAL  26          2HG1      VAL  26   0.253   9.225  -8.563
  380   3HG1  VAL  26          3HG1      VAL  26  -1.483   9.262  -8.266
  381   1HG2  VAL  26          1HG2      VAL  26   0.940   8.249  -6.072
  382   2HG2  VAL  26          2HG2      VAL  26  -0.376   8.569  -4.941
  383   3HG2  VAL  26          3HG2      VAL  26  -0.715   7.819  -6.503
  384    H    GLY  27           H        GLY  27   1.733  10.298  -8.724
  385   1HA   GLY  27          1HA       GLY  27   3.119  12.390  -9.695
  386   2HA   GLY  27          2HA       GLY  27   1.857  11.663 -10.682
  387    H    VAL  28           H        VAL  28  -0.432  12.543  -9.301
  388    HA   VAL  28           HA       VAL  28  -0.740  15.218 -10.312
  389    HB   VAL  28           HB       VAL  28  -2.326  13.467  -8.423
  390   1HG1  VAL  28          1HG1      VAL  28  -2.976  16.181  -9.596
  391   2HG1  VAL  28          2HG1      VAL  28  -4.224  15.073  -9.023
  392   3HG1  VAL  28          3HG1      VAL  28  -3.017  15.699  -7.900
  393   1HG2  VAL  28          1HG2      VAL  28  -1.883  13.170 -11.084
  394   2HG2  VAL  28          2HG2      VAL  28  -3.385  12.681 -10.300
  395   3HG2  VAL  28          3HG2      VAL  28  -3.288  14.236 -11.127
  396    H    SER  29           H        SER  29  -1.163  17.169  -9.034
  397    HA   SER  29           HA       SER  29  -0.555  18.720  -7.351
  398   1HB   SER  29          1HB       SER  29  -2.124  17.064  -6.200
  399   2HB   SER  29          2HB       SER  29  -0.683  16.265  -5.580
  400    HG   SER  29           HG       SER  29  -1.540  18.937  -5.152
  401    H    ALA  30           H        ALA  30   1.010  18.364  -5.068
  402    HA   ALA  30           HA       ALA  30   3.264  18.254  -4.380
  403   1HB   ALA  30          1HB       ALA  30   2.548  15.826  -5.520
  404   2HB   ALA  30          2HB       ALA  30   4.019  16.248  -6.399
  405   3HB   ALA  30          3HB       ALA  30   4.047  16.125  -4.641
  406    H    LYS  31           H        LYS  31   2.625  20.239  -6.245
  407    HA   LYS  31           HA       LYS  31   5.195  21.003  -7.256
  408   1HB   LYS  31          1HB       LYS  31   4.709  20.697  -9.692
  409   2HB   LYS  31          2HB       LYS  31   4.788  19.161  -8.832
  410   1HG   LYS  31          1HG       LYS  31   2.695  18.677  -9.500
  411   2HG   LYS  31          2HG       LYS  31   2.098  20.109  -8.664
  412   1HD   LYS  31          1HD       LYS  31   1.490  20.752 -10.771
  413   2HD   LYS  31          2HD       LYS  31   3.174  21.267 -10.869
  414   1HE   LYS  31          1HE       LYS  31   3.389  19.862 -12.640
  415   2HE   LYS  31          2HE       LYS  31   3.210  18.515 -11.497
  416   1HZ   LYS  31          1HZ       LYS  31   0.936  20.015 -12.684
  417   2HZ   LYS  31          2HZ       LYS  31   1.499  18.524 -13.273
  418   3HZ   LYS  31          3HZ       LYS  31   0.844  18.625 -11.711
  419    HA   PRO  32           HA       PRO  32   1.771  24.145  -7.363
  420   1HB   PRO  32          1HB       PRO  32   2.203  25.382  -4.968
  421   2HB   PRO  32          2HB       PRO  32   1.153  23.964  -5.147
  422   1HG   PRO  32          1HG       PRO  32   3.814  24.176  -3.937
  423   2HG   PRO  32          2HG       PRO  32   2.556  22.959  -3.694
  424   1HD   PRO  32          1HD       PRO  32   4.909  22.751  -5.299
  425   2HD   PRO  32          2HD       PRO  32   3.620  21.549  -5.093
  426    H    VAL  33           H        VAL  33   2.882  25.366  -8.957
  427    HA   VAL  33           HA       VAL  33   4.305  27.724  -8.095
  428    HB   VAL  33           HB       VAL  33   6.026  25.984  -7.685
  429   1HG1  VAL  33          1HG1      VAL  33   5.735  25.482 -10.662
  430   2HG1  VAL  33          2HG1      VAL  33   6.998  24.796  -9.641
  431   3HG1  VAL  33          3HG1      VAL  33   5.311  24.357  -9.373
  432   1HG2  VAL  33          1HG2      VAL  33   6.400  28.391  -8.826
  433   2HG2  VAL  33          2HG2      VAL  33   7.737  27.291  -8.496
  434   3HG2  VAL  33          3HG2      VAL  33   7.044  27.375 -10.116
  435    H    ASN  34           H        ASN  34   2.125  26.955  -9.921
  436    HA   ASN  34           HA       ASN  34   3.273  27.657 -12.591
  437   1HB   ASN  34          1HB       ASN  34   1.745  25.610 -12.019
  438   2HB   ASN  34          2HB       ASN  34   0.441  26.799 -12.019
  439   1HD2  ASN  34          2HD2      ASN  34   1.197  24.557 -14.013
  440   2HD2  ASN  34          1HD2      ASN  34   1.236  25.348 -15.514
  441    H    ARG  35           H        ARG  35   3.284  29.854 -11.001
  442    HA   ARG  35           HA       ARG  35   1.304  31.594 -12.278
  443   1HB   ARG  35          1HB       ARG  35   0.669  32.360  -9.795
  444   2HB   ARG  35          2HB       ARG  35  -0.196  31.055 -10.600
  445   1HG   ARG  35          1HG       ARG  35   0.370  30.305  -8.374
  446   2HG   ARG  35          2HG       ARG  35   1.394  29.427  -9.504
  447   1HD   ARG  35          1HD       ARG  35   2.702  30.267  -7.559
  448   2HD   ARG  35          2HD       ARG  35   3.240  31.038  -9.063
  449    HE   ARG  35           HE       ARG  35   2.363  33.079  -8.264
  450   1HH1  ARG  35          1HH1      ARG  35   1.007  30.388  -6.538
  451   2HH1  ARG  35          2HH1      ARG  35   0.150  31.390  -5.417
  452   1HH2  ARG  35          1HH2      ARG  35   1.246  34.368  -6.802
  453   2HH2  ARG  35          2HH2      ARG  35   0.284  33.631  -5.565
  454    HA   PRO  36           HA       PRO  36   5.374  33.414 -10.813
  455   1HB   PRO  36          1HB       PRO  36   6.482  33.840 -13.277
  456   2HB   PRO  36          2HB       PRO  36   6.707  32.334 -12.367
  457   1HG   PRO  36          1HG       PRO  36   4.885  32.915 -14.642
  458   2HG   PRO  36          2HG       PRO  36   5.800  31.444 -14.273
  459   1HD   PRO  36          1HD       PRO  36   3.121  31.739 -13.790
  460   2HD   PRO  36          2HD       PRO  36   4.177  30.630 -12.888
  Start of MODEL   26
    1   1H5*    G   1          1H5*        G   1  11.509 -16.019   1.289
    2   2H5*    G   1          2H5*        G   1  12.610 -17.410   1.431
    3    H4*    G   1           H4*        G   1  10.483 -18.841   1.680
    4    H3*    G   1           H3*        G   1   9.353 -16.056   2.131
    5    H2*    G   1           H2*        G   1   7.996 -16.928   3.861
    6   2HO*    G   1          2HO*        G   1   8.629 -19.551   3.784
    7    H1*    G   1           H1*        G   1   9.920 -18.693   4.835
    8    H8     G   1           H8         G   1  11.499 -15.353   4.141
    9    H1     G   1           H1         G   1   7.887 -15.467   9.453
   10   1H2     G   1          1H2         G   1   7.101 -17.658   9.674
   11   2H2     G   1          2H2         G   1   6.464 -18.243   8.153
   12   1H5*    C   2          1H5*        C   2   5.372 -17.065   1.069
   13   2H5*    C   2          2H5*        C   2   6.653 -16.691   2.244
   14    H4*    C   2           H4*        C   2   4.341 -18.358   3.168
   15    H3*    C   2           H3*        C   2   4.224 -15.378   2.575
   16    H2*    C   2           H2*        C   2   3.065 -15.029   4.584
   17   2HO*    C   2          2HO*        C   2   2.233 -16.878   5.783
   18    H1*    C   2           H1*        C   2   4.378 -17.006   6.076
   19   1H4     C   2          1H4         C   2   6.881 -11.544   8.076
   20   2H4     C   2          2H4         C   2   7.946 -11.493   6.693
   21    H5     C   2           H5         C   2   7.528 -12.885   4.722
   22    H6     C   2           H6         C   2   6.609 -15.034   4.005
   23   1H5*    C   3          2H5*        C   3   1.346 -12.823   2.112
   24   2H5*    C   3          1H5*        C   3   2.517 -13.867   2.942
   25    H4*    C   3           H4*        C   3  -0.008 -14.440   4.096
   26    H3*    C   3           H3*        C   3   0.492 -11.497   3.628
   27    H2*    C   3           H2*        C   3  -0.087 -10.978   5.837
   28   2HO*    C   3          2HO*        C   3  -0.944 -12.688   7.231
   29    H1*    C   3           H1*        C   3   1.078 -13.204   7.023
   30   1H4     C   3          1H4         C   3   5.441  -8.583   7.559
   31   2H4     C   3          2H4         C   3   5.619  -8.511   5.819
   32    H5     C   3           H5         C   3   4.994 -10.598   4.611
   33    H6     C   3           H6         C   3   3.059 -12.043   4.268
   34   1H5*    C   4          1H5*        C   4  -3.639 -10.179   4.431
   35   2H5*    C   4          2H5*        C   4  -1.887 -10.416   4.577
   36    H4*    C   4           H4*        C   4  -3.628 -10.111   7.019
   37    H3*    C   4           H3*        C   4  -2.552  -7.889   5.244
   38    H2*    C   4           H2*        C   4  -1.912  -6.677   7.142
   39   2HO*    C   4          2HO*        C   4  -2.680  -7.181   9.224
   40    H1*    C   4           H1*        C   4  -1.158  -8.844   8.713
   41   1H4     C   4          1H4         C   4   4.435  -6.893   6.501
   42   2H4     C   4          2H4         C   4   3.824  -6.768   4.871
   43    H5     C   4           H5         C   4   2.045  -8.583   4.511
   44    H6     C   4           H6         C   4  -0.036  -9.331   5.352
   45   1H5*    U   5          1H5*        U   5  -4.716  -6.019   8.198
   46   2H5*    U   5          2H5*        U   5  -5.828  -4.808   7.519
   47    H4*    U   5           H4*        U   5  -4.477  -3.703   9.163
   48    H3*    U   5           H3*        U   5  -3.553  -3.082   6.338
   49    H2*    U   5           H2*        U   5  -1.944  -1.636   7.255
   50   2HO*    U   5          2HO*        U   5  -2.254  -1.415   9.775
   51    H1*    U   5           H1*        U   5  -1.513  -3.162   9.584
   52    H3     U   5           H3         U   5   2.398  -2.466   7.396
   53    H5     U   5           H5         U   5   0.570  -5.596   5.301
   54    H6     U   5           H6         U   5  -1.440  -5.108   6.519
   55   1H5*    G   6          1H5*        G   6  -2.710  -0.367   7.134
   56   2H5*    G   6          2H5*        G   6  -3.108   1.057   8.108
   57    H4*    G   6           H4*        G   6  -2.430   2.523   6.431
   58    H3*    G   6           H3*        G   6  -2.962   0.250   4.485
   59    H2*    G   6           H2*        G   6  -1.343   1.130   3.046
   60   2HO*    G   6          2HO*        G   6  -1.680   3.538   4.506
   61    H1*    G   6           H1*        G   6   0.384   2.084   5.045
   62    H8     G   6           H8         G   6  -1.215  -1.431   4.881
   63    H1     G   6           H1         G   6   4.816  -1.018   2.686
   64   1H2     G   6          1H2         G   6   5.360   1.174   2.439
   65   2H2     G   6          2H2         G   6   4.627   2.290   3.576
   66   1H5*    A   7          1H5*        A   7  -4.654   1.724   0.302
   67   2H5*    A   7          2H5*        A   7  -3.665   0.250   0.330
   68    H4*    A   7           H4*        A   7  -2.768   1.741  -1.341
   69    H3*    A   7           H3*        A   7  -1.104   1.683   1.199
   70    H2*    A   7           H2*        A   7   0.426   3.157   0.146
   71   2HO*    A   7          2HO*        A   7   0.517   3.443  -2.052
   72    H1*    A   7           H1*        A   7  -1.514   4.527  -1.331
   73    H8     A   7           H8         A   7  -2.739   4.555   2.149
   74   1H6     A   7          1H6         A   7   1.167   9.177   3.321
   75   2H6     A   7          2H6         A   7   0.183   7.970   4.118
   76    H2     A   7           H2         A   7   2.372   7.307  -0.602
   77   1H5*    A   8          1H5*        A   8   1.078   0.852  -1.720
   78   2H5*    A   8          2H5*        A   8   2.407  -0.318  -1.841
   79    H4*    A   8           H4*        A   8   3.336   1.882  -2.135
   80    H3*    A   8           H3*        A   8   3.829   0.722   0.623
   81    H2*    A   8           H2*        A   8   5.049   2.655   1.230
   82   2HO*    A   8          2HO*        A   8   5.427   4.278  -0.510
   83    H1*    A   8           H1*        A   8   3.401   4.460  -0.143
   84    H8     A   8           H8         A   8   1.182   2.036   1.624
   85   1H6     A   8          1H6         A   8   1.111   4.092   6.041
   86   2H6     A   8          2H6         A   8   2.046   5.370   6.784
   87    H2     A   8           H2         A   8   5.010   6.758   3.717
   88   1H5*    A   9          2H5*        A   9   8.476  -0.647  -2.218
   89   2H5*    A   9          1H5*        A   9   7.450   0.194  -1.037
   90    H4*    A   9           H4*        A   9   9.496   1.339  -2.529
   91    H3*    A   9           H3*        A   9   7.092   2.532  -1.123
   92    H2*    A   9           H2*        A   9   7.774   4.666  -1.906
   93   2HO*    A   9          2HO*        A   9   9.850   4.707  -3.148
   94    H1*    A   9           H1*        A   9   8.543   3.749  -4.431
   95    H8     A   9           H8         A   9   6.016   4.935  -2.124
   96   1H6     A   9          1H6         A   9   1.899   4.736  -4.930
   97   2H6     A   9          2H6         A   9   1.937   4.987  -6.662
   98    H2     A   9           H2         A   9   5.346   2.239  -7.907
   99   1H5*    A  10          1H5*        A  10   9.987   1.437   3.946
  100   2H5*    A  10          2H5*        A  10   8.263   1.689   3.598
  101    H4*    A  10           H4*        A  10  10.069   4.075   3.834
  102    H3*    A  10           H3*        A  10   9.020   2.388   6.108
  103    H2*    A  10           H2*        A  10   8.369   4.308   7.294
  104   2HO*    A  10          2HO*        A  10  10.512   5.363   6.405
  105    H1*    A  10           H1*        A  10   7.516   5.799   5.103
  106    H8     A  10           H8         A  10   6.035   2.695   4.157
  107   1H6     A  10          1H6         A  10   1.601   3.481   7.808
  108   2H6     A  10          2H6         A  10   2.553   2.062   8.182
  109    H2     A  10           H2         A  10   5.173   6.112   9.533
  110   1H5*    A  11          1H5*        A  11  10.242   4.598   8.990
  111   2H5*    A  11          2H5*        A  11  10.829   3.407  10.173
  112    H4*    A  11           H4*        A  11   8.509   4.521  10.569
  113    H3*    A  11           H3*        A  11   9.047   1.546  10.693
  114    H2*    A  11           H2*        A  11   6.769   1.136  11.145
  115   2HO*    A  11          2HO*        A  11   5.502   3.337  11.346
  116    H1*    A  11           H1*        A  11   5.728   3.105   9.506
  117    H8     A  11           H8         A  11   8.504   1.342   7.674
  118   1H6     A  11          1H6         A  11   4.663  -3.190   6.418
  119   2H6     A  11          2H6         A  11   5.470  -2.051   5.367
  120    H2     A  11           H2         A  11   2.470  -0.268   9.178
  121   1H5*    G  12          1H5*        G  12   8.998  -1.324  13.679
  122   2H5*    G  12          2H5*        G  12   8.876  -0.459  12.136
  123    H4*    G  12           H4*        G  12   6.685   0.219  13.935
  124    H3*    G  12           H3*        G  12   7.130  -2.689  13.257
  125    H2*    G  12           H2*        G  12   4.839  -2.917  12.726
  126   2HO*    G  12          2HO*        G  12   3.534  -0.836  13.187
  127    H1*    G  12           H1*        G  12   4.541  -0.397  11.532
  128    H8     G  12           H8         G  12   7.550  -1.245   9.875
  129    H1     G  12           H1         G  12   2.953  -5.425   8.254
  130   1H2     G  12          1H2         G  12   1.270  -5.297   9.650
  131   2H2     G  12          2H2         G  12   1.322  -4.295  11.082
  132   1H5*    G  13          1H5*        G  13   4.468  -3.123  16.424
  133   2H5*    G  13          2H5*        G  13   5.096  -4.030  17.817
  134    H4*    G  13           H4*        G  13   3.102  -5.144  17.179
  135    H3*    G  13           H3*        G  13   5.535  -6.506  16.046
  136    H2*    G  13           H2*        G  13   4.173  -8.075  14.984
  137   2HO*    G  13          2HO*        G  13   1.737  -7.797  15.544
  138    H1*    G  13           H1*        G  13   2.095  -6.353  14.319
  139    H8     G  13           H8         G  13   5.424  -4.756  13.575
  140    H1     G  13           H1         G  13   3.502  -8.973   9.120
  141   1H2     G  13          1H2         G  13   1.960 -10.348  10.067
  142   2H2     G  13          2H2         G  13   0.868  -9.583  11.200
  143   1H5*    G  14          1H5*        G  14   4.436 -10.202  18.357
  144   2H5*    G  14          2H5*        G  14   4.384  -9.147  16.934
  145    H4*    G  14           H4*        G  14   2.148 -11.102  17.354
  146    H3*    G  14           H3*        G  14   4.952 -11.804  16.456
  147    H2*    G  14           H2*        G  14   4.049 -13.205  14.786
  148   2HO*    G  14          2HO*        G  14   1.849 -13.787  14.770
  149    H1*    G  14           H1*        G  14   1.899 -11.562  14.137
  150    H8     G  14           H8         G  14   4.779  -9.271  14.445
  151    H1     G  14           H1         G  14   5.070 -12.909   9.137
  152   1H2     G  14          1H2         G  14   3.403 -14.383   9.170
  153   2H2     G  14          2H2         G  14   2.733 -14.879  10.709
  154   1H5*    C  15          1H5*        C  15   2.960 -15.086  16.815
  155   2H5*    C  15          2H5*        C  15   3.565 -16.434  17.812
  156    H4*    C  15           H4*        C  15   3.063 -17.389  15.689
  157    H3*    C  15           H3*        C  15   6.024 -16.794  15.951
  158    H2*    C  15           H2*        C  15   6.347 -17.727  13.811
  159   2HO*    C  15          2HO*        C  15   3.735 -18.714  13.587
  160    H1*    C  15           H1*        C  15   3.871 -16.876  12.765
  161   1H4     C  15          1H4         C  15   8.330 -13.266  10.074
  162   2H4     C  15          2H4         C  15   8.657 -12.451  11.591
  163    H5     C  15           H5         C  15   7.179 -12.778  13.526
  164    H6     C  15           H6         C  15   5.537 -14.229  14.523
  165   2H    ASP   2          2H        ASP   2   9.829 -13.528  -0.703
  166   1H    ASP   2          1H        ASP   2   9.611 -14.674   0.532
  167   3H    ASP   2          3H        ASP   2  11.008 -13.708   0.502
  168    HA   ASP   2           HA       ASP   2   9.659 -12.724   2.148
  169   1HB   ASP   2          1HB       ASP   2   9.136 -11.287  -0.468
  170   2HB   ASP   2          2HB       ASP   2   9.278 -10.558   1.129
  171    H    ALA   3           H        ALA   3   7.441 -11.084   1.689
  172    HA   ALA   3           HA       ALA   3   5.227 -12.702   0.631
  173   1HB   ALA   3          1HB       ALA   3   5.663 -12.218   3.590
  174   2HB   ALA   3          2HB       ALA   3   4.159 -12.831   2.905
  175   3HB   ALA   3          3HB       ALA   3   5.639 -13.777   2.767
  176    H    GLN   4           H        GLN   4   6.176  -9.922   2.637
  177    HA   GLN   4           HA       GLN   4   3.714  -8.462   2.255
  178   1HB   GLN   4          1HB       GLN   4   5.338  -8.048   4.077
  179   2HB   GLN   4          2HB       GLN   4   6.547  -7.566   2.892
  180   1HG   GLN   4          1HG       GLN   4   5.112  -5.702   2.167
  181   2HG   GLN   4          2HG       GLN   4   3.888  -6.181   3.344
  182   1HE2  GLN   4          2HE2      GLN   4   5.407  -3.618   3.288
  183   2HE2  GLN   4          1HE2      GLN   4   6.234  -3.536   4.765
  184    H    THR   5           H        THR   5   6.952  -8.003   0.855
  185    HA   THR   5           HA       THR   5   6.338  -6.066  -1.089
  186    HB   THR   5           HB       THR   5   8.140  -8.506  -1.309
  187    HG1  THR   5           HG1      THR   5   8.700  -5.854  -0.478
  188   1HG2  THR   5          1HG2      THR   5   8.066  -5.881  -2.807
  189   2HG2  THR   5          2HG2      THR   5   9.411  -7.020  -2.883
  190   3HG2  THR   5          3HG2      THR   5   7.819  -7.493  -3.476
  191    H    ARG   6           H        ARG   6   5.683  -9.515  -1.011
  192    HA   ARG   6           HA       ARG   6   4.665  -9.722  -3.740
  193   1HB   ARG   6          1HB       ARG   6   5.111 -11.359  -1.374
  194   2HB   ARG   6          2HB       ARG   6   3.519 -11.682  -2.072
  195   1HG   ARG   6          1HG       ARG   6   4.559 -12.992  -3.595
  196   2HG   ARG   6          2HG       ARG   6   5.252 -11.524  -4.281
  197   1HD   ARG   6          1HD       ARG   6   7.215 -12.664  -3.804
  198   2HD   ARG   6          2HD       ARG   6   6.972 -11.879  -2.231
  199    HE   ARG   6           HE       ARG   6   6.428 -13.990  -1.333
  200   1HH1  ARG   6          1HH1      ARG   6   6.093 -13.986  -4.787
  201   2HH1  ARG   6          2HH1      ARG   6   5.737 -15.676  -4.873
  202   1HH2  ARG   6          1HH2      ARG   6   5.965 -16.190  -1.457
  203   2HH2  ARG   6          2HH2      ARG   6   5.665 -16.919  -2.999
  204    H    ARG   7           H        ARG   7   3.310  -9.441  -0.468
  205    HA   ARG   7           HA       ARG   7   0.577  -9.530  -1.194
  206   1HB   ARG   7          1HB       ARG   7   1.281  -9.732   1.097
  207   2HB   ARG   7          2HB       ARG   7   2.107  -8.174   1.044
  208   1HG   ARG   7          1HG       ARG   7  -0.212  -7.158   0.539
  209   2HG   ARG   7          2HG       ARG   7  -0.865  -8.713   1.052
  210   1HD   ARG   7          1HD       ARG   7  -0.300  -8.367   3.255
  211   2HD   ARG   7          2HD       ARG   7   1.140  -7.418   2.853
  212    HE   ARG   7           HE       ARG   7  -0.231  -5.502   2.863
  213   1HH1  ARG   7          1HH1      ARG   7  -2.125  -8.366   2.424
  214   2HH1  ARG   7          2HH1      ARG   7  -3.629  -7.516   2.468
  215   1HH2  ARG   7          1HH2      ARG   7  -2.159  -4.401   2.923
  216   2HH2  ARG   7          2HH2      ARG   7  -3.650  -5.261   2.751
  217    H    ARG   8           H        ARG   8   2.917  -6.890  -1.211
  218    HA   ARG   8           HA       ARG   8   1.187  -4.660  -1.524
  219   1HB   ARG   8          1HB       ARG   8   3.852  -5.076  -1.369
  220   2HB   ARG   8          2HB       ARG   8   3.719  -4.851  -3.111
  221   1HG   ARG   8          1HG       ARG   8   4.049  -2.660  -2.362
  222   2HG   ARG   8          2HG       ARG   8   2.292  -2.752  -2.477
  223   1HD   ARG   8          1HD       ARG   8   3.066  -1.739  -0.312
  224   2HD   ARG   8          2HD       ARG   8   2.133  -3.228  -0.067
  225    HE   ARG   8           HE       ARG   8   4.107  -4.279   0.698
  226   1HH1  ARG   8          1HH1      ARG   8   4.845  -1.425  -1.114
  227   2HH1  ARG   8          2HH1      ARG   8   6.540  -1.509  -0.783
  228   1HH2  ARG   8          1HH2      ARG   8   6.310  -4.386   1.126
  229   2HH2  ARG   8          2HH2      ARG   8   7.368  -3.176   0.479
  230    H    GLU   9           H        GLU   9   2.416  -6.988  -3.904
  231    HA   GLU   9           HA       GLU   9   1.302  -5.689  -6.214
  232   1HB   GLU   9          1HB       GLU   9   1.846  -8.608  -5.543
  233   2HB   GLU   9          2HB       GLU   9   1.467  -8.029  -7.165
  234   1HG   GLU   9          1HG       GLU   9   3.581  -6.430  -5.995
  235   2HG   GLU   9          2HG       GLU   9   4.012  -8.139  -5.958
  236    H    ARG  10           H        ARG  10   0.046  -7.720  -3.685
  237    HA   ARG  10           HA       ARG  10  -2.582  -8.113  -4.894
  238   1HB   ARG  10          1HB       ARG  10  -1.029  -8.974  -2.600
  239   2HB   ARG  10          2HB       ARG  10  -2.636  -8.464  -2.086
  240   1HG   ARG  10          1HG       ARG  10  -3.706 -10.037  -3.500
  241   2HG   ARG  10          2HG       ARG  10  -2.237 -10.312  -4.437
  242   1HD   ARG  10          1HD       ARG  10  -1.267 -11.648  -2.774
  243   2HD   ARG  10          2HD       ARG  10  -2.253 -10.928  -1.487
  244    HE   ARG  10           HE       ARG  10  -4.084 -12.093  -3.259
  245   1HH1  ARG  10          1HH1      ARG  10  -1.399 -13.120  -1.313
  246   2HH1  ARG  10          2HH1      ARG  10  -2.032 -14.712  -1.071
  247   1HH2  ARG  10          1HH2      ARG  10  -4.898 -14.161  -2.939
  248   2HH2  ARG  10          2HH2      ARG  10  -4.005 -15.301  -1.987
  249    H    ARG  11           H        ARG  11  -0.920  -5.605  -3.260
  250    HA   ARG  11           HA       ARG  11  -3.416  -4.367  -2.262
  251   1HB   ARG  11          1HB       ARG  11  -0.480  -3.624  -2.114
  252   2HB   ARG  11          2HB       ARG  11  -1.783  -2.689  -1.377
  253   1HG   ARG  11          1HG       ARG  11  -0.968  -5.539  -0.712
  254   2HG   ARG  11          2HG       ARG  11  -0.862  -4.144   0.343
  255   1HD   ARG  11          1HD       ARG  11  -3.008  -4.446   1.024
  256   2HD   ARG  11          2HD       ARG  11  -3.587  -4.472  -0.642
  257    HE   ARG  11           HE       ARG  11  -2.147  -6.902   0.074
  258   1HH1  ARG  11          1HH1      ARG  11  -5.204  -5.256   0.136
  259   2HH1  ARG  11          2HH1      ARG  11  -6.124  -6.718   0.205
  260   1HH2  ARG  11          1HH2      ARG  11  -3.356  -8.798   0.165
  261   2HH2  ARG  11          2HH2      ARG  11  -5.085  -8.714   0.221
  262    H    ALA  12           H        ALA  12  -1.892  -4.541  -5.216
  263    HA   ALA  12           HA       ALA  12  -1.718  -1.836  -6.122
  264   1HB   ALA  12          1HB       ALA  12  -1.073  -3.922  -7.371
  265   2HB   ALA  12          2HB       ALA  12  -2.783  -4.298  -7.574
  266   3HB   ALA  12          3HB       ALA  12  -2.099  -2.863  -8.336
  267    H    GLU  13           H        GLU  13  -4.457  -3.874  -5.347
  268    HA   GLU  13           HA       GLU  13  -6.472  -2.174  -6.600
  269   1HB   GLU  13          1HB       GLU  13  -6.488  -4.435  -4.575
  270   2HB   GLU  13          2HB       GLU  13  -7.966  -3.665  -5.152
  271   1HG   GLU  13          1HG       GLU  13  -7.578  -4.369  -7.397
  272   2HG   GLU  13          2HG       GLU  13  -5.911  -4.827  -7.041
  273    H    LYS  14           H        LYS  14  -4.910  -2.494  -3.434
  274    HA   LYS  14           HA       LYS  14  -6.702  -0.558  -2.132
  275   1HB   LYS  14          1HB       LYS  14  -4.029  -1.840  -1.435
  276   2HB   LYS  14          2HB       LYS  14  -4.951  -0.821  -0.327
  277   1HG   LYS  14          1HG       LYS  14  -6.134  -3.280  -1.624
  278   2HG   LYS  14          2HG       LYS  14  -5.298  -3.335  -0.070
  279   1HD   LYS  14          1HD       LYS  14  -7.021  -2.340   1.029
  280   2HD   LYS  14          2HD       LYS  14  -7.307  -1.188  -0.276
  281   1HE   LYS  14          1HE       LYS  14  -8.233  -3.303  -1.559
  282   2HE   LYS  14          2HE       LYS  14  -8.431  -3.954   0.080
  283   1HZ   LYS  14          1HZ       LYS  14  -9.468  -1.749   0.648
  284   2HZ   LYS  14          2HZ       LYS  14  -9.528  -1.427  -1.019
  285   3HZ   LYS  14          3HZ       LYS  14 -10.390  -2.741  -0.373
  286    H    GLN  15           H        GLN  15  -3.581  -0.701  -3.679
  287    HA   GLN  15           HA       GLN  15  -2.674   1.975  -3.137
  288   1HB   GLN  15          1HB       GLN  15  -1.943  -0.449  -4.589
  289   2HB   GLN  15          2HB       GLN  15  -1.527   0.981  -5.516
  290   1HG   GLN  15          1HG       GLN  15  -0.032   1.755  -3.904
  291   2HG   GLN  15          2HG       GLN  15  -0.861   0.907  -2.598
  292   1HE2  GLN  15          2HE2      GLN  15  -0.830  -1.629  -2.925
  293   2HE2  GLN  15          1HE2      GLN  15   0.657  -2.285  -3.421
  294    H    ALA  16           H        ALA  16  -4.128   0.441  -6.019
  295    HA   ALA  16           HA       ALA  16  -4.321   2.892  -7.535
  296   1HB   ALA  16          1HB       ALA  16  -5.873   0.276  -7.648
  297   2HB   ALA  16          2HB       ALA  16  -5.862   1.494  -8.924
  298   3HB   ALA  16          3HB       ALA  16  -4.379   0.631  -8.516
  299    H    GLN  17           H        GLN  17  -6.323   1.433  -5.036
  300    HA   GLN  17           HA       GLN  17  -8.644   3.145  -5.620
  301   1HB   GLN  17          1HB       GLN  17  -7.782   1.146  -3.542
  302   2HB   GLN  17          2HB       GLN  17  -9.140   2.208  -3.179
  303   1HG   GLN  17          1HG       GLN  17  -9.174   0.898  -5.848
  304   2HG   GLN  17          2HG       GLN  17  -9.441  -0.151  -4.457
  305   1HE2  GLN  17          2HE2      GLN  17 -11.086   0.953  -2.772
  306   2HE2  GLN  17          1HE2      GLN  17 -12.470   1.636  -3.479
  307    H    TRP  18           H        TRP  18  -5.862   3.059  -3.494
  308    HA   TRP  18           HA       TRP  18  -6.567   5.435  -1.954
  309   1HB   TRP  18          1HB       TRP  18  -5.098   3.681  -1.071
  310   2HB   TRP  18          2HB       TRP  18  -4.024   3.853  -2.443
  311    HD1  TRP  18           HD1      TRP  18  -4.876   5.493   0.866
  312    HE1  TRP  18           HE1      TRP  18  -3.204   7.423   1.276
  313    HE3  TRP  18           HE3      TRP  18  -2.549   5.593  -3.614
  314    HZ2  TRP  18           HZ2      TRP  18  -1.135   8.798  -0.128
  315    HZ3  TRP  18           HZ3      TRP  18  -0.752   7.183  -4.065
  316    HH2  TRP  18           HH2      TRP  18  -0.029   8.771  -2.357
  317    H    LYS  19           H        LYS  19  -4.308   4.630  -4.546
  318    HA   LYS  19           HA       LYS  19  -3.151   7.190  -4.960
  319   1HB   LYS  19          1HB       LYS  19  -3.657   4.764  -6.702
  320   2HB   LYS  19          2HB       LYS  19  -2.800   6.175  -7.303
  321   1HG   LYS  19          1HG       LYS  19  -1.320   5.905  -5.190
  322   2HG   LYS  19          2HG       LYS  19  -1.962   4.269  -5.143
  323   1HD   LYS  19          1HD       LYS  19  -0.810   5.398  -7.685
  324   2HD   LYS  19          2HD       LYS  19   0.235   4.680  -6.462
  325   1HE   LYS  19          1HE       LYS  19  -1.248   2.618  -6.545
  326   2HE   LYS  19          2HE       LYS  19  -2.021   3.333  -7.972
  327   1HZ   LYS  19          1HZ       LYS  19   0.913   2.989  -7.674
  328   2HZ   LYS  19          2HZ       LYS  19  -0.083   1.891  -8.503
  329   3HZ   LYS  19          3HZ       LYS  19   0.079   3.486  -9.065
  330    H    ALA  20           H        ALA  20  -6.101   5.665  -6.136
  331    HA   ALA  20           HA       ALA  20  -6.800   7.583  -8.102
  332   1HB   ALA  20          1HB       ALA  20  -8.316   5.718  -6.294
  333   2HB   ALA  20          2HB       ALA  20  -9.160   6.741  -7.455
  334   3HB   ALA  20          3HB       ALA  20  -7.994   5.543  -8.020
  335    H    ALA  21           H        ALA  21  -7.056   7.602  -4.601
  336    HA   ALA  21           HA       ALA  21  -8.310  10.311  -4.750
  337   1HB   ALA  21          1HB       ALA  21  -9.308   8.024  -3.611
  338   2HB   ALA  21          2HB       ALA  21  -8.498   8.774  -2.237
  339   3HB   ALA  21          3HB       ALA  21  -9.758   9.651  -3.103
  340    H    ASN  22           H        ASN  22  -5.463   9.448  -4.740
  341    HA   ASN  22           HA       ASN  22  -4.530  11.360  -2.699
  342   1HB   ASN  22          1HB       ASN  22  -3.731   8.434  -2.712
  343   2HB   ASN  22          2HB       ASN  22  -2.957   9.684  -1.738
  344   1HD2  ASN  22          2HD2      ASN  22  -5.249   7.312  -1.555
  345   2HD2  ASN  22          1HD2      ASN  22  -6.214   7.931  -0.302
  346    HA   PRO  23           HA       PRO  23  -2.049  10.815  -6.669
  347   1HB   PRO  23          1HB       PRO  23  -2.801  13.154  -7.888
  348   2HB   PRO  23          2HB       PRO  23  -3.648  11.616  -8.152
  349   1HG   PRO  23          1HG       PRO  23  -4.385  13.905  -6.404
  350   2HG   PRO  23          2HG       PRO  23  -5.418  12.856  -7.389
  351   1HD   PRO  23          1HD       PRO  23  -5.129  12.584  -4.690
  352   2HD   PRO  23          2HD       PRO  23  -5.534  11.234  -5.764
  353    H    LEU  24           H        LEU  24  -2.937  13.446  -4.547
  354    HA   LEU  24           HA       LEU  24  -0.753  15.218  -4.828
  355   1HB   LEU  24          1HB       LEU  24  -1.626  16.123  -2.851
  356   2HB   LEU  24          2HB       LEU  24  -2.988  15.131  -3.357
  357    HG   LEU  24           HG       LEU  24  -0.846  14.091  -1.477
  358   1HD1  LEU  24          1HD1      LEU  24  -3.244  15.797  -0.948
  359   2HD1  LEU  24          2HD1      LEU  24  -2.827  14.540   0.217
  360   3HD1  LEU  24          3HD1      LEU  24  -1.664  15.811  -0.165
  361   1HD2  LEU  24          1HD2      LEU  24  -2.874  12.773  -2.825
  362   2HD2  LEU  24          2HD2      LEU  24  -2.136  12.207  -1.328
  363   3HD2  LEU  24          3HD2      LEU  24  -3.633  13.139  -1.278
  364    H    LEU  25           H        LEU  25  -1.032  12.162  -3.125
  365    HA   LEU  25           HA       LEU  25   1.804  12.294  -2.219
  366   1HB   LEU  25          1HB       LEU  25  -0.719  10.818  -1.510
  367   2HB   LEU  25          2HB       LEU  25   0.827  10.038  -1.151
  368    HG   LEU  25           HG       LEU  25   0.383  12.898  -0.341
  369   1HD1  LEU  25          1HD1      LEU  25  -1.462  11.124   0.438
  370   2HD1  LEU  25          2HD1      LEU  25  -0.210  10.718   1.612
  371   3HD1  LEU  25          3HD1      LEU  25  -0.849  12.361   1.534
  372   1HD2  LEU  25          1HD2      LEU  25   2.215  10.634   0.308
  373   2HD2  LEU  25          2HD2      LEU  25   2.569  12.354   0.150
  374   3HD2  LEU  25          3HD2      LEU  25   1.815  11.740   1.622
  375    H    VAL  26           H        VAL  26   0.994  12.078  -4.939
  376    HA   VAL  26           HA       VAL  26   2.235   9.500  -5.715
  377    HB   VAL  26           HB       VAL  26  -0.583  10.331  -5.779
  378   1HG1  VAL  26          1HG1      VAL  26   0.047  10.884  -8.158
  379   2HG1  VAL  26          2HG1      VAL  26   0.480   9.186  -8.375
  380   3HG1  VAL  26          3HG1      VAL  26  -1.181   9.632  -7.995
  381   1HG2  VAL  26          1HG2      VAL  26   0.609   8.164  -4.971
  382   2HG2  VAL  26          2HG2      VAL  26  -0.965   8.030  -5.756
  383   3HG2  VAL  26          3HG2      VAL  26   0.507   7.670  -6.662
  384    H    GLY  27           H        GLY  27   2.155   9.760  -8.427
  385   1HA   GLY  27          1HA       GLY  27   4.062  11.387  -9.355
  386   2HA   GLY  27          2HA       GLY  27   2.594  11.186 -10.305
  387    H    VAL  28           H        VAL  28   0.776  12.639  -8.686
  388    HA   VAL  28           HA       VAL  28   1.296  15.339  -9.520
  389    HB   VAL  28           HB       VAL  28  -0.629  14.220  -7.464
  390   1HG1  VAL  28          1HG1      VAL  28  -0.046  16.851  -7.842
  391   2HG1  VAL  28          2HG1      VAL  28  -1.289  16.622  -9.073
  392   3HG1  VAL  28          3HG1      VAL  28  -1.647  16.267  -7.384
  393   1HG2  VAL  28          1HG2      VAL  28  -0.648  14.445 -10.459
  394   2HG2  VAL  28          2HG2      VAL  28  -1.191  13.111  -9.440
  395   3HG2  VAL  28          3HG2      VAL  28  -2.169  14.571  -9.576
  396    H    SER  29           H        SER  29   1.998  17.129  -8.332
  397    HA   SER  29           HA       SER  29   3.247  18.262  -6.696
  398   1HB   SER  29          1HB       SER  29   1.053  16.914  -5.535
  399   2HB   SER  29          2HB       SER  29   2.409  16.665  -4.440
  400    HG   SER  29           HG       SER  29   2.427  18.730  -3.989
  401    H    ALA  30           H        ALA  30   4.702  16.272  -7.985
  402    HA   ALA  30           HA       ALA  30   6.534  15.404  -5.797
  403   1HB   ALA  30          1HB       ALA  30   4.895  13.761  -7.605
  404   2HB   ALA  30          2HB       ALA  30   6.601  13.314  -7.618
  405   3HB   ALA  30          3HB       ALA  30   5.697  13.304  -6.103
  406    H    LYS  31           H        LYS  31   6.844  17.609  -7.464
  407    HA   LYS  31           HA       LYS  31   9.134  16.734  -9.195
  408   1HB   LYS  31          1HB       LYS  31   6.861  18.654  -9.769
  409   2HB   LYS  31          2HB       LYS  31   8.326  18.591 -10.749
  410   1HG   LYS  31          1HG       LYS  31   6.928  16.012 -10.201
  411   2HG   LYS  31          2HG       LYS  31   6.174  17.119 -11.350
  412   1HD   LYS  31          1HD       LYS  31   9.102  16.421 -11.548
  413   2HD   LYS  31          2HD       LYS  31   7.867  15.399 -12.283
  414   1HE   LYS  31          1HE       LYS  31   7.099  17.188 -13.697
  415   2HE   LYS  31          2HE       LYS  31   8.072  18.381 -12.814
  416   1HZ   LYS  31          1HZ       LYS  31   9.269  15.997 -14.104
  417   2HZ   LYS  31          2HZ       LYS  31   9.090  17.473 -14.927
  418   3HZ   LYS  31          3HZ       LYS  31  10.059  17.390 -13.537
  419    HA   PRO  32           HA       PRO  32  10.474  20.040  -6.280
  420   1HB   PRO  32          1HB       PRO  32  12.939  18.961  -5.787
  421   2HB   PRO  32          2HB       PRO  32  11.482  18.486  -4.892
  422   1HG   PRO  32          1HG       PRO  32  12.870  17.092  -7.122
  423   2HG   PRO  32          2HG       PRO  32  12.086  16.420  -5.685
  424   1HD   PRO  32          1HD       PRO  32  10.947  16.441  -8.171
  425   2HD   PRO  32          2HD       PRO  32  10.018  16.418  -6.657
  426    H    VAL  33           H        VAL  33  11.424  21.860  -7.145
  427    HA   VAL  33           HA       VAL  33  12.793  21.691  -9.745
  428    HB   VAL  33           HB       VAL  33  12.224  24.032  -7.892
  429   1HG1  VAL  33          1HG1      VAL  33  13.249  23.744 -10.690
  430   2HG1  VAL  33          2HG1      VAL  33  12.192  25.108 -10.325
  431   3HG1  VAL  33          3HG1      VAL  33  13.705  24.906  -9.444
  432   1HG2  VAL  33          1HG2      VAL  33  10.606  22.798 -10.142
  433   2HG2  VAL  33          2HG2      VAL  33  10.138  22.924  -8.447
  434   3HG2  VAL  33          3HG2      VAL  33  10.262  24.377  -9.438
  435    H    ASN  34           H        ASN  34  14.973  22.410 -10.095
  436    HA   ASN  34           HA       ASN  34  16.875  21.716  -8.032
  437   1HB   ASN  34          1HB       ASN  34  17.210  21.506 -10.493
  438   2HB   ASN  34          2HB       ASN  34  17.201  23.265 -10.626
  439   1HD2  ASN  34          2HD2      ASN  34  19.419  23.542 -11.235
  440   2HD2  ASN  34          1HD2      ASN  34  20.711  23.128 -10.216
  441    H    ARG  35           H        ARG  35  17.675  23.029  -6.430
  442    HA   ARG  35           HA       ARG  35  16.698  25.642  -5.893
  443   1HB   ARG  35          1HB       ARG  35  19.249  24.217  -5.067
  444   2HB   ARG  35          2HB       ARG  35  18.621  25.667  -4.282
  445   1HG   ARG  35          1HG       ARG  35  17.181  23.004  -4.503
  446   2HG   ARG  35          2HG       ARG  35  17.926  23.659  -3.043
  447   1HD   ARG  35          1HD       ARG  35  16.380  25.707  -3.385
  448   2HD   ARG  35          2HD       ARG  35  15.476  24.667  -4.503
  449    HE   ARG  35           HE       ARG  35  15.574  24.365  -1.605
  450   1HH1  ARG  35          1HH1      ARG  35  15.246  22.727  -4.650
  451   2HH1  ARG  35          2HH1      ARG  35  14.376  21.394  -3.971
  452   1HH2  ARG  35          1HH2      ARG  35  14.443  22.628  -0.735
  453   2HH2  ARG  35          2HH2      ARG  35  13.924  21.338  -1.766
  454    HA   PRO  36           HA       PRO  36  19.259  27.617  -9.038
  455   1HB   PRO  36          1HB       PRO  36  17.943  30.013  -9.001
  456   2HB   PRO  36          2HB       PRO  36  17.342  28.595  -9.884
  457   1HG   PRO  36          1HG       PRO  36  16.465  29.716  -7.282
  458   2HG   PRO  36          2HG       PRO  36  15.518  28.927  -8.551
  459   1HD   PRO  36          1HD       PRO  36  16.320  27.718  -6.205
  460   2HD   PRO  36          2HD       PRO  36  15.874  26.854  -7.691
  Start of MODEL   27
    1   1H5*    G   1          1H5*        G   1  12.892 -16.052   1.955
    2   2H5*    G   1          2H5*        G   1  12.712 -17.192   0.602
    3    H4*    G   1           H4*        G   1  11.115 -18.329   1.703
    4    H3*    G   1           H3*        G   1   9.845 -15.613   2.195
    5    H2*    G   1           H2*        G   1   8.454 -16.601   3.833
    6   2HO*    G   1          2HO*        G   1   7.695 -18.478   3.125
    7    H1*    G   1           H1*        G   1  10.413 -18.298   4.844
    8    H8     G   1           H8         G   1  11.886 -14.887   4.303
    9    H1     G   1           H1         G   1   8.021 -15.247   9.422
   10   1H2     G   1          1H2         G   1   6.818 -17.105   9.324
   11   2H2     G   1          2H2         G   1   7.261 -18.410   8.246
   12   1H5*    C   2          1H5*        C   2   6.030 -16.714   0.941
   13   2H5*    C   2          2H5*        C   2   7.183 -16.409   2.258
   14    H4*    C   2           H4*        C   2   4.859 -18.205   2.830
   15    H3*    C   2           H3*        C   2   4.665 -15.210   2.395
   16    H2*    C   2           H2*        C   2   3.315 -14.999   4.307
   17   2HO*    C   2          2HO*        C   2   2.473 -17.434   3.600
   18    H1*    C   2           H1*        C   2   4.592 -16.946   5.845
   19   1H4     C   2          1H4         C   2   6.879 -11.480   8.070
   20   2H4     C   2          2H4         C   2   7.977 -11.349   6.718
   21    H5     C   2           H5         C   2   7.700 -12.723   4.716
   22    H6     C   2           H6         C   2   6.872 -14.874   3.912
   23   1H5*    C   3          1H5*        C   3   0.269 -13.829   1.536
   24   2H5*    C   3          2H5*        C   3   1.329 -12.467   1.936
   25    H4*    C   3           H4*        C   3  -0.203 -14.295   3.771
   26    H3*    C   3           H3*        C   3   0.213 -11.317   3.457
   27    H2*    C   3           H2*        C   3  -0.064 -10.996   5.756
   28   2HO*    C   3          2HO*        C   3  -1.727 -12.094   6.490
   29    H1*    C   3           H1*        C   3   1.240 -13.312   6.576
   30   1H4     C   3          1H4         C   3   5.342  -8.451   7.165
   31   2H4     C   3          2H4         C   3   5.893  -8.729   5.528
   32    H5     C   3           H5         C   3   4.803 -10.312   4.040
   33    H6     C   3           H6         C   3   3.107 -12.038   3.855
   34   1H5*    C   4          1H5*        C   4  -4.180 -10.349   4.715
   35   2H5*    C   4          2H5*        C   4  -2.421 -10.172   4.576
   36    H4*    C   4           H4*        C   4  -4.024  -9.926   7.138
   37    H3*    C   4           H3*        C   4  -2.857  -7.860   5.252
   38    H2*    C   4           H2*        C   4  -2.223  -6.526   7.051
   39   2HO*    C   4          2HO*        C   4  -3.476  -6.342   8.707
   40    H1*    C   4           H1*        C   4  -1.530  -8.601   8.770
   41   1H4     C   4          1H4         C   4   3.624  -6.046   5.846
   42   2H4     C   4          2H4         C   4   3.995  -7.704   5.447
   43    H5     C   4           H5         C   4   1.676  -8.615   4.536
   44    H6     C   4           H6         C   4  -0.460  -9.217   5.385
   45   1H5*    U   5          1H5*        U   5  -5.435  -4.791   6.302
   46   2H5*    U   5          2H5*        U   5  -3.963  -5.754   6.460
   47    H4*    U   5           H4*        U   5  -4.684  -3.982   8.756
   48    H3*    U   5           H3*        U   5  -3.617  -2.996   6.082
   49    H2*    U   5           H2*        U   5  -2.150  -1.569   7.247
   50   2HO*    U   5          2HO*        U   5  -3.897  -1.967   9.450
   51    H1*    U   5           H1*        U   5  -1.729  -3.302   9.418
   52    H3     U   5           H3         U   5   2.243  -2.367   7.353
   53    H5     U   5           H5         U   5   0.615  -5.619   5.274
   54    H6     U   5           H6         U   5  -1.508  -5.061   6.288
   55   1H5*    G   6          1H5*        G   6  -1.984   0.280   7.998
   56   2H5*    G   6          2H5*        G   6  -3.313   1.461   8.029
   57    H4*    G   6           H4*        G   6  -2.042   2.741   6.681
   58    H3*    G   6           H3*        G   6  -2.687   0.479   4.766
   59    H2*    G   6           H2*        G   6  -1.124   1.311   3.233
   60   2HO*    G   6          2HO*        G   6  -1.616   3.717   4.541
   61    H1*    G   6           H1*        G   6   0.756   2.195   5.099
   62    H8     G   6           H8         G   6  -1.081  -1.212   5.137
   63    H1     G   6           H1         G   6   4.919  -1.289   2.829
   64   1H2     G   6          1H2         G   6   5.633   0.806   2.539
   65   2H2     G   6          2H2         G   6   4.894   2.095   3.470
   66   1H5*    A   7          1H5*        A   7  -4.535   2.020   0.631
   67   2H5*    A   7          2H5*        A   7  -3.616   0.504   0.712
   68    H4*    A   7           H4*        A   7  -2.770   1.852  -1.116
   69    H3*    A   7           H3*        A   7  -0.927   1.813   1.300
   70    H2*    A   7           H2*        A   7   0.600   3.136   0.063
   71   2HO*    A   7          2HO*        A   7   0.137   3.449  -2.267
   72    H1*    A   7           H1*        A   7  -1.354   4.541  -1.355
   73    H8     A   7           H8         A   7  -2.305   4.887   2.195
   74   1H6     A   7          1H6         A   7   0.734   8.482   3.504
   75   2H6     A   7          2H6         A   7   2.324   8.928   2.929
   76    H2     A   7           H2         A   7   2.779   7.000  -1.108
   77   1H5*    A   8          1H5*        A   8   0.965   0.478  -1.667
   78   2H5*    A   8          2H5*        A   8   2.197  -0.797  -1.782
   79    H4*    A   8           H4*        A   8   3.311   1.280  -2.166
   80    H3*    A   8           H3*        A   8   3.703   0.262   0.666
   81    H2*    A   8           H2*        A   8   5.111   2.118   1.115
   82   2HO*    A   8          2HO*        A   8   5.828   3.490  -0.578
   83    H1*    A   8           H1*        A   8   3.605   3.954  -0.374
   84    H8     A   8           H8         A   8   1.230   1.861   1.599
   85   1H6     A   8          1H6         A   8   2.524   5.378   6.523
   86   2H6     A   8          2H6         A   8   1.288   4.392   5.773
   87    H2     A   8           H2         A   8   5.452   6.409   3.277
   88   1H5*    A   9          2H5*        A   9   8.308  -1.545  -1.910
   89   2H5*    A   9          1H5*        A   9   7.335  -0.497  -0.858
   90    H4*    A   9           H4*        A   9   9.569   0.243  -2.403
   91    H3*    A   9           H3*        A   9   7.416   1.827  -0.980
   92    H2*    A   9           H2*        A   9   8.304   3.812  -1.913
   93   2HO*    A   9          2HO*        A   9  10.558   3.008  -1.505
   94    H1*    A   9           H1*        A   9   8.896   2.695  -4.404
   95    H8     A   9           H8         A   9   6.557   4.293  -2.135
   96   1H6     A   9          1H6         A   9   2.071   3.916  -6.312
   97   2H6     A   9          2H6         A   9   2.816   5.103  -5.266
   98    H2     A   9           H2         A   9   5.544   1.423  -7.783
   99   1H5*    A  10          1H5*        A  10   9.837   0.811   4.134
  100   2H5*    A  10          2H5*        A  10   8.222   1.278   3.572
  101    H4*    A  10           H4*        A  10  10.299   3.421   3.772
  102    H3*    A  10           H3*        A  10   8.996   2.026   6.110
  103    H2*    A  10           H2*        A  10   8.538   4.074   7.160
  104   2HO*    A  10          2HO*        A  10  10.149   5.425   7.092
  105    H1*    A  10           H1*        A  10   7.906   5.506   4.854
  106    H8     A  10           H8         A  10   6.097   2.592   4.000
  107   1H6     A  10          1H6         A  10   2.529   2.531   8.313
  108   2H6     A  10          2H6         A  10   1.806   3.797   7.345
  109    H2     A  10           H2         A  10   5.614   6.171   9.310
  110   1H5*    A  11          1H5*        A  11  10.064   4.761   9.191
  111   2H5*    A  11          2H5*        A  11  10.652   3.469  10.261
  112    H4*    A  11           H4*        A  11   8.310   4.583  10.703
  113    H3*    A  11           H3*        A  11   8.905   1.615  10.761
  114    H2*    A  11           H2*        A  11   6.635   1.164  11.215
  115   2HO*    A  11          2HO*        A  11   5.422   3.456  11.441
  116    H1*    A  11           H1*        A  11   5.560   3.158   9.621
  117    H8     A  11           H8         A  11   8.352   1.442   7.774
  118   1H6     A  11          1H6         A  11   4.589  -3.075   6.390
  119   2H6     A  11          2H6         A  11   5.313  -1.884   5.335
  120    H2     A  11           H2         A  11   2.299  -0.223   9.171
  121   1H5*    G  12          1H5*        G  12   8.919  -1.371  13.540
  122   2H5*    G  12          2H5*        G  12   8.787  -0.442  12.036
  123    H4*    G  12           H4*        G  12   6.604   0.186  13.848
  124    H3*    G  12           H3*        G  12   7.045  -2.715  13.128
  125    H2*    G  12           H2*        G  12   4.734  -2.922  12.644
  126   2HO*    G  12          2HO*        G  12   4.156  -1.652  14.600
  127    H1*    G  12           H1*        G  12   4.447  -0.397  11.471
  128    H8     G  12           H8         G  12   7.441  -1.312   9.782
  129    H1     G  12           H1         G  12   2.724  -5.377   8.206
  130   1H2     G  12          1H2         G  12   1.116  -5.297   9.701
  131   2H2     G  12          2H2         G  12   1.077  -4.071  10.949
  132   1H5*    G  13          1H5*        G  13   4.277  -3.127  16.117
  133   2H5*    G  13          2H5*        G  13   4.781  -4.106  17.511
  134    H4*    G  13           H4*        G  13   2.762  -5.080  16.741
  135    H3*    G  13           H3*        G  13   5.175  -6.559  15.705
  136    H2*    G  13           H2*        G  13   3.789  -8.020  14.530
  137   2HO*    G  13          2HO*        G  13   1.519  -8.113  14.885
  138    H1*    G  13           H1*        G  13   1.846  -6.172  13.801
  139    H8     G  13           H8         G  13   5.230  -4.675  13.212
  140    H1     G  13           H1         G  13   3.478  -8.917   8.710
  141   1H2     G  13          1H2         G  13   1.378  -9.693   9.292
  142   2H2     G  13          2H2         G  13   1.266 -10.078  10.994
  143   1H5*    G  14          1H5*        G  14   3.738 -10.185  18.256
  144   2H5*    G  14          2H5*        G  14   3.959  -9.280  16.751
  145    H4*    G  14           H4*        G  14   1.661 -11.208  17.091
  146    H3*    G  14           H3*        G  14   4.526 -11.825  16.352
  147    H2*    G  14           H2*        G  14   3.780 -13.279  14.654
  148   2HO*    G  14          2HO*        G  14   1.258 -13.157  15.949
  149    H1*    G  14           H1*        G  14   1.600 -11.743  13.859
  150    H8     G  14           H8         G  14   4.399  -9.364  14.348
  151    H1     G  14           H1         G  14   5.036 -12.893   8.999
  152   1H2     G  14          1H2         G  14   3.743 -14.690   9.144
  153   2H2     G  14          2H2         G  14   2.351 -14.675  10.205
  154   1H5*    C  15          1H5*        C  15   2.645 -15.167  16.499
  155   2H5*    C  15          2H5*        C  15   3.255 -16.489  17.522
  156    H4*    C  15           H4*        C  15   2.938 -17.443  15.361
  157    H3*    C  15           H3*        C  15   5.844 -16.717  15.830
  158    H2*    C  15           H2*        C  15   6.356 -17.622  13.713
  159   2HO*    C  15          2HO*        C  15   4.071 -19.142  14.199
  160    H1*    C  15           H1*        C  15   3.919 -16.874  12.506
  161   1H4     C  15          1H4         C  15   8.357 -13.044  10.110
  162   2H4     C  15          2H4         C  15   8.575 -12.242  11.652
  163    H5     C  15           H5         C  15   7.013 -12.654  13.503
  164    H6     C  15           H6         C  15   5.372 -14.182  14.391
  165   2H    ASP   2          2H        ASP   2   9.571  -8.915   0.348
  166   1H    ASP   2          1H        ASP   2   9.448  -9.901  -1.031
  167   3H    ASP   2          3H        ASP   2  10.883  -9.886  -0.125
  168    HA   ASP   2           HA       ASP   2   9.834 -11.862   0.543
  169   1HB   ASP   2          1HB       ASP   2   8.956  -9.724   2.500
  170   2HB   ASP   2          2HB       ASP   2   9.432 -11.378   2.870
  171    H    ALA   3           H        ALA   3   7.651 -12.121   2.248
  172    HA   ALA   3           HA       ALA   3   5.466 -12.533   0.461
  173   1HB   ALA   3          1HB       ALA   3   5.881 -13.670   2.639
  174   2HB   ALA   3          2HB       ALA   3   5.486 -12.168   3.473
  175   3HB   ALA   3          3HB       ALA   3   4.249 -13.011   2.542
  176    H    GLN   4           H        GLN   4   6.400  -9.737   2.373
  177    HA   GLN   4           HA       GLN   4   3.838  -8.385   2.168
  178   1HB   GLN   4          1HB       GLN   4   5.704  -7.993   3.861
  179   2HB   GLN   4          2HB       GLN   4   6.600  -7.195   2.570
  180   1HG   GLN   4          1HG       GLN   4   4.620  -5.683   2.232
  181   2HG   GLN   4          2HG       GLN   4   3.902  -6.387   3.679
  182   1HE2  GLN   4          2HE2      GLN   4   5.373  -3.661   2.815
  183   2HE2  GLN   4          1HE2      GLN   4   6.285  -3.327   4.204
  184    H    THR   5           H        THR   5   6.973  -7.839   0.541
  185    HA   THR   5           HA       THR   5   6.173  -5.912  -1.346
  186    HB   THR   5           HB       THR   5   8.003  -8.323  -1.668
  187    HG1  THR   5           HG1      THR   5   8.809  -7.113  -0.066
  188   1HG2  THR   5          1HG2      THR   5   7.507  -5.878  -3.338
  189   2HG2  THR   5          2HG2      THR   5   9.109  -6.617  -3.317
  190   3HG2  THR   5          3HG2      THR   5   7.713  -7.553  -3.852
  191    H    ARG   6           H        ARG   6   5.598  -9.374  -1.227
  192    HA   ARG   6           HA       ARG   6   4.385  -9.609  -3.865
  193   1HB   ARG   6          1HB       ARG   6   5.010 -11.224  -1.522
  194   2HB   ARG   6          2HB       ARG   6   3.383 -11.576  -2.118
  195   1HG   ARG   6          1HG       ARG   6   4.489 -12.974  -3.553
  196   2HG   ARG   6          2HG       ARG   6   4.776 -11.492  -4.466
  197   1HD   ARG   6          1HD       ARG   6   6.937 -12.483  -4.233
  198   2HD   ARG   6          2HD       ARG   6   6.894 -11.230  -2.976
  199    HE   ARG   6           HE       ARG   6   5.795 -13.557  -1.820
  200   1HH1  ARG   6          1HH1      ARG   6   8.802 -12.498  -3.194
  201   2HH1  ARG   6          2HH1      ARG   6   9.758 -13.549  -2.208
  202   1HH2  ARG   6          1HH2      ARG   6   7.049 -14.920  -0.544
  203   2HH2  ARG   6          2HH2      ARG   6   8.773 -14.914  -0.715
  204    H    ARG   7           H        ARG   7   3.226  -9.368  -0.511
  205    HA   ARG   7           HA       ARG   7   0.456  -9.470  -1.087
  206   1HB   ARG   7          1HB       ARG   7   1.338  -9.707   1.150
  207   2HB   ARG   7          2HB       ARG   7   2.083  -8.111   1.081
  208   1HG   ARG   7          1HG       ARG   7  -0.305  -7.195   0.746
  209   2HG   ARG   7          2HG       ARG   7  -0.858  -8.787   1.264
  210   1HD   ARG   7          1HD       ARG   7  -0.121  -8.484   3.430
  211   2HD   ARG   7          2HD       ARG   7   1.197  -7.409   2.949
  212    HE   ARG   7           HE       ARG   7  -0.323  -5.593   3.063
  213   1HH1  ARG   7          1HH1      ARG   7  -1.982  -8.645   2.943
  214   2HH1  ARG   7          2HH1      ARG   7  -3.539  -7.941   3.210
  215   1HH2  ARG   7          1HH2      ARG   7  -2.360  -4.695   3.409
  216   2HH2  ARG   7          2HH2      ARG   7  -3.754  -5.721   3.472
  217    H    ARG   8           H        ARG   8   2.787  -6.836  -1.213
  218    HA   ARG   8           HA       ARG   8   1.071  -4.586  -1.398
  219   1HB   ARG   8          1HB       ARG   8   3.769  -5.146  -1.549
  220   2HB   ARG   8          2HB       ARG   8   3.421  -4.706  -3.214
  221   1HG   ARG   8          1HG       ARG   8   4.128  -2.771  -1.767
  222   2HG   ARG   8          2HG       ARG   8   2.567  -2.552  -2.548
  223   1HD   ARG   8          1HD       ARG   8   2.896  -2.037   0.064
  224   2HD   ARG   8          2HD       ARG   8   1.389  -2.733  -0.545
  225    HE   ARG   8           HE       ARG   8   3.390  -4.758   0.097
  226   1HH1  ARG   8          1HH1      ARG   8   0.853  -2.742   1.324
  227   2HH1  ARG   8          2HH1      ARG   8   0.499  -3.791   2.648
  228   1HH2  ARG   8          1HH2      ARG   8   2.915  -6.111   1.826
  229   2HH2  ARG   8          2HH2      ARG   8   1.656  -5.680   2.932
  230    H    GLU   9           H        GLU   9   2.140  -6.879  -3.879
  231    HA   GLU   9           HA       GLU   9   0.818  -5.583  -6.075
  232   1HB   GLU   9          1HB       GLU   9   1.361  -8.536  -5.575
  233   2HB   GLU   9          2HB       GLU   9   1.079  -7.794  -7.151
  234   1HG   GLU   9          1HG       GLU   9   3.122  -6.243  -6.168
  235   2HG   GLU   9          2HG       GLU   9   3.523  -7.826  -5.501
  236    H    ARG  10           H        ARG  10  -0.182  -7.740  -3.524
  237    HA   ARG  10           HA       ARG  10  -2.877  -8.186  -4.535
  238   1HB   ARG  10          1HB       ARG  10  -1.172  -8.888  -2.248
  239   2HB   ARG  10          2HB       ARG  10  -2.849  -8.602  -1.790
  240   1HG   ARG  10          1HG       ARG  10  -3.189 -10.753  -2.436
  241   2HG   ARG  10          2HG       ARG  10  -3.127 -10.112  -4.078
  242   1HD   ARG  10          1HD       ARG  10  -0.447 -10.391  -3.482
  243   2HD   ARG  10          2HD       ARG  10  -1.165 -11.792  -2.663
  244    HE   ARG  10           HE       ARG  10  -2.455 -11.765  -5.105
  245   1HH1  ARG  10          1HH1      ARG  10   0.869 -11.701  -4.103
  246   2HH1  ARG  10          2HH1      ARG  10   1.433 -12.522  -5.518
  247   1HH2  ARG  10          1HH2      ARG  10  -1.707 -12.832  -6.940
  248   2HH2  ARG  10          2HH2      ARG  10  -0.016 -13.159  -7.116
  249    H    ARG  11           H        ARG  11  -1.174  -5.658  -2.921
  250    HA   ARG  11           HA       ARG  11  -3.643  -4.457  -1.806
  251   1HB   ARG  11          1HB       ARG  11  -0.714  -3.665  -1.834
  252   2HB   ARG  11          2HB       ARG  11  -1.985  -2.763  -1.010
  253   1HG   ARG  11          1HG       ARG  11  -1.184  -5.637  -0.440
  254   2HG   ARG  11          2HG       ARG  11  -0.844  -4.259   0.591
  255   1HD   ARG  11          1HD       ARG  11  -2.899  -4.402   1.539
  256   2HD   ARG  11          2HD       ARG  11  -3.685  -4.394  -0.046
  257    HE   ARG  11           HE       ARG  11  -2.376  -6.922   0.395
  258   1HH1  ARG  11          1HH1      ARG  11  -5.154  -5.043   1.290
  259   2HH1  ARG  11          2HH1      ARG  11  -6.133  -6.430   1.623
  260   1HH2  ARG  11          1HH2      ARG  11  -3.658  -8.718   0.832
  261   2HH2  ARG  11          2HH2      ARG  11  -5.291  -8.501   1.365
  262    H    ALA  12           H        ALA  12  -2.338  -4.639  -4.845
  263    HA   ALA  12           HA       ALA  12  -2.173  -1.957  -5.795
  264   1HB   ALA  12          1HB       ALA  12  -3.355  -4.448  -7.100
  265   2HB   ALA  12          2HB       ALA  12  -2.803  -3.014  -7.964
  266   3HB   ALA  12          3HB       ALA  12  -1.645  -4.017  -7.090
  267    H    GLU  13           H        GLU  13  -4.898  -3.915  -4.795
  268    HA   GLU  13           HA       GLU  13  -6.960  -2.192  -5.927
  269   1HB   GLU  13          1HB       GLU  13  -6.812  -4.442  -3.908
  270   2HB   GLU  13          2HB       GLU  13  -8.327  -3.588  -4.208
  271   1HG   GLU  13          1HG       GLU  13  -8.120  -4.124  -6.629
  272   2HG   GLU  13          2HG       GLU  13  -6.658  -5.047  -6.277
  273    H    LYS  14           H        LYS  14  -5.170  -2.491  -2.887
  274    HA   LYS  14           HA       LYS  14  -6.754  -0.458  -1.491
  275   1HB   LYS  14          1HB       LYS  14  -4.023  -1.715  -0.988
  276   2HB   LYS  14          2HB       LYS  14  -4.929  -0.758   0.188
  277   1HG   LYS  14          1HG       LYS  14  -5.993  -3.291  -1.086
  278   2HG   LYS  14          2HG       LYS  14  -5.175  -3.251   0.476
  279   1HD   LYS  14          1HD       LYS  14  -6.869  -1.745   1.372
  280   2HD   LYS  14          2HD       LYS  14  -7.658  -1.648  -0.202
  281   1HE   LYS  14          1HE       LYS  14  -8.326  -3.952  -0.116
  282   2HE   LYS  14          2HE       LYS  14  -7.281  -4.266   1.283
  283   1HZ   LYS  14          1HZ       LYS  14  -8.556  -2.512   2.477
  284   2HZ   LYS  14          2HZ       LYS  14  -9.650  -2.479   1.180
  285   3HZ   LYS  14          3HZ       LYS  14  -9.472  -3.894   2.103
  286    H    GLN  15           H        GLN  15  -3.771  -0.734  -3.280
  287    HA   GLN  15           HA       GLN  15  -2.771   1.938  -2.919
  288   1HB   GLN  15          1HB       GLN  15  -2.225  -0.554  -4.362
  289   2HB   GLN  15          2HB       GLN  15  -1.817   0.854  -5.329
  290   1HG   GLN  15          1HG       GLN  15  -0.179   1.565  -3.847
  291   2HG   GLN  15          2HG       GLN  15  -0.968   0.802  -2.466
  292   1HE2  GLN  15          2HE2      GLN  15  -1.030  -1.705  -2.597
  293   2HE2  GLN  15          1HE2      GLN  15   0.359  -2.472  -3.208
  294    H    ALA  16           H        ALA  16  -4.478   0.329  -5.612
  295    HA   ALA  16           HA       ALA  16  -4.724   2.686  -7.240
  296   1HB   ALA  16          1HB       ALA  16  -4.980   0.247  -7.902
  297   2HB   ALA  16          2HB       ALA  16  -6.557   0.265  -7.110
  298   3HB   ALA  16          3HB       ALA  16  -6.260   1.297  -8.509
  299    H    GLN  17           H        GLN  17  -6.590   1.453  -4.516
  300    HA   GLN  17           HA       GLN  17  -8.861   3.253  -4.999
  301   1HB   GLN  17          1HB       GLN  17  -7.916   1.299  -2.925
  302   2HB   GLN  17          2HB       GLN  17  -9.140   2.475  -2.449
  303   1HG   GLN  17          1HG       GLN  17  -9.653   1.163  -5.044
  304   2HG   GLN  17          2HG       GLN  17  -9.699   0.079  -3.653
  305   1HE2  GLN  17          2HE2      GLN  17 -10.725   3.520  -4.061
  306   2HE2  GLN  17          1HE2      GLN  17 -12.305   3.266  -3.491
  307    H    TRP  18           H        TRP  18  -5.927   3.148  -3.084
  308    HA   TRP  18           HA       TRP  18  -6.400   5.651  -1.659
  309   1HB   TRP  18          1HB       TRP  18  -4.953   3.893  -0.762
  310   2HB   TRP  18          2HB       TRP  18  -3.978   3.909  -2.216
  311    HD1  TRP  18           HD1      TRP  18  -4.483   5.811   1.024
  312    HE1  TRP  18           HE1      TRP  18  -2.706   7.683   1.158
  313    HE3  TRP  18           HE3      TRP  18  -2.516   5.492  -3.615
  314    HZ2  TRP  18           HZ2      TRP  18  -0.697   8.865  -0.497
  315    HZ3  TRP  18           HZ3      TRP  18  -0.699   6.956  -4.317
  316    HH2  TRP  18           HH2      TRP  18   0.231   8.617  -2.791
  317    H    LYS  19           H        LYS  19  -4.377   4.576  -4.345
  318    HA   LYS  19           HA       LYS  19  -3.134   7.036  -5.006
  319   1HB   LYS  19          1HB       LYS  19  -3.894   4.540  -6.540
  320   2HB   LYS  19          2HB       LYS  19  -3.032   5.867  -7.307
  321   1HG   LYS  19          1HG       LYS  19  -1.362   5.674  -5.355
  322   2HG   LYS  19          2HG       LYS  19  -2.098   4.104  -5.053
  323   1HD   LYS  19          1HD       LYS  19  -1.141   4.863  -7.809
  324   2HD   LYS  19          2HD       LYS  19  -0.030   4.193  -6.614
  325   1HE   LYS  19          1HE       LYS  19  -2.176   2.466  -6.424
  326   2HE   LYS  19          2HE       LYS  19  -2.134   2.835  -8.159
  327   1HZ   LYS  19          1HZ       LYS  19   0.254   2.409  -8.147
  328   2HZ   LYS  19          2HZ       LYS  19   0.189   2.007  -6.497
  329   3HZ   LYS  19          3HZ       LYS  19  -0.606   1.037  -7.643
  330    H    ALA  20           H        ALA  20  -6.246   5.621  -5.869
  331    HA   ALA  20           HA       ALA  20  -6.967   7.507  -7.871
  332   1HB   ALA  20          1HB       ALA  20  -8.337   5.618  -6.017
  333   2HB   ALA  20          2HB       ALA  20  -9.331   6.801  -6.867
  334   3HB   ALA  20          3HB       ALA  20  -8.350   5.656  -7.780
  335    H    ALA  21           H        ALA  21  -7.007   7.635  -4.364
  336    HA   ALA  21           HA       ALA  21  -8.184  10.379  -4.517
  337   1HB   ALA  21          1HB       ALA  21  -8.283   8.272  -2.340
  338   2HB   ALA  21          2HB       ALA  21  -8.982   9.885  -2.195
  339   3HB   ALA  21          3HB       ALA  21  -9.621   8.749  -3.384
  340    H    ASN  22           H        ASN  22  -5.372   9.486  -4.720
  341    HA   ASN  22           HA       ASN  22  -4.242  11.420  -2.807
  342   1HB   ASN  22          1HB       ASN  22  -3.507   8.477  -2.807
  343   2HB   ASN  22          2HB       ASN  22  -2.606   9.732  -1.957
  344   1HD2  ASN  22          2HD2      ASN  22  -4.989   7.463  -1.505
  345   2HD2  ASN  22          1HD2      ASN  22  -5.786   8.148  -0.171
  346    HA   PRO  23           HA       PRO  23  -2.129  10.751  -6.970
  347   1HB   PRO  23          1HB       PRO  23  -2.960  13.074  -8.164
  348   2HB   PRO  23          2HB       PRO  23  -3.844  11.542  -8.318
  349   1HG   PRO  23          1HG       PRO  23  -4.391  13.874  -6.553
  350   2HG   PRO  23          2HG       PRO  23  -5.522  12.827  -7.427
  351   1HD   PRO  23          1HD       PRO  23  -5.008  12.581  -4.764
  352   2HD   PRO  23          2HD       PRO  23  -5.504  11.223  -5.780
  353    H    LEU  24           H        LEU  24  -2.664  13.307  -4.672
  354    HA   LEU  24           HA       LEU  24  -0.409  14.965  -5.377
  355   1HB   LEU  24          1HB       LEU  24  -0.643  15.628  -2.855
  356   2HB   LEU  24          2HB       LEU  24  -1.951  16.019  -3.950
  357    HG   LEU  24           HG       LEU  24  -2.497  14.997  -1.618
  358   1HD1  LEU  24          1HD1      LEU  24  -3.754  14.824  -4.180
  359   2HD1  LEU  24          2HD1      LEU  24  -4.117  13.360  -3.266
  360   3HD1  LEU  24          3HD1      LEU  24  -4.498  14.941  -2.587
  361   1HD2  LEU  24          1HD2      LEU  24  -0.879  13.040  -1.971
  362   2HD2  LEU  24          2HD2      LEU  24  -2.487  12.625  -1.390
  363   3HD2  LEU  24          3HD2      LEU  24  -2.078  12.382  -3.081
  364    H    LEU  25           H        LEU  25  -0.692  11.924  -3.881
  365    HA   LEU  25           HA       LEU  25   2.171  11.974  -3.045
  366   1HB   LEU  25          1HB       LEU  25  -0.346  10.638  -2.047
  367   2HB   LEU  25          2HB       LEU  25   1.219   9.883  -1.722
  368    HG   LEU  25           HG       LEU  25   0.877  12.802  -1.131
  369   1HD1  LEU  25          1HD1      LEU  25  -1.086  11.488  -0.152
  370   2HD1  LEU  25          2HD1      LEU  25   0.103  10.634   0.831
  371   3HD1  LEU  25          3HD1      LEU  25  -0.099  12.376   1.008
  372   1HD2  LEU  25          1HD2      LEU  25   3.018  11.248  -0.959
  373   2HD2  LEU  25          2HD2      LEU  25   2.695  12.461   0.280
  374   3HD2  LEU  25          3HD2      LEU  25   2.282  10.771   0.572
  375    H    VAL  26           H        VAL  26   0.864  11.664  -5.619
  376    HA   VAL  26           HA       VAL  26   2.011   9.066  -6.464
  377    HB   VAL  26           HB       VAL  26  -0.803   9.803  -6.137
  378   1HG1  VAL  26          1HG1      VAL  26   0.155   9.057  -8.913
  379   2HG1  VAL  26          2HG1      VAL  26  -1.495   8.766  -8.364
  380   3HG1  VAL  26          3HG1      VAL  26  -0.872  10.414  -8.442
  381   1HG2  VAL  26          1HG2      VAL  26   0.526   7.697  -5.492
  382   2HG2  VAL  26          2HG2      VAL  26  -1.080   7.449  -6.180
  383   3HG2  VAL  26          3HG2      VAL  26   0.358   7.217  -7.180
  384    H    GLY  27           H        GLY  27   3.431   9.738  -8.026
  385   1HA   GLY  27          1HA       GLY  27   4.218  10.822  -9.977
  386   2HA   GLY  27          2HA       GLY  27   2.546  11.283 -10.316
  387    H    VAL  28           H        VAL  28   1.684  12.993  -8.654
  388    HA   VAL  28           HA       VAL  28   3.409  15.338  -8.783
  389    HB   VAL  28           HB       VAL  28   0.726  14.750  -7.495
  390   1HG1  VAL  28          1HG1      VAL  28   2.424  16.959  -7.049
  391   2HG1  VAL  28          2HG1      VAL  28   1.201  17.527  -8.186
  392   3HG1  VAL  28          3HG1      VAL  28   0.713  16.836  -6.639
  393   1HG2  VAL  28          1HG2      VAL  28   1.260  14.724 -10.121
  394   2HG2  VAL  28          2HG2      VAL  28  -0.247  15.387  -9.487
  395   3HG2  VAL  28          3HG2      VAL  28   1.082  16.466  -9.912
  396    H    SER  29           H        SER  29   4.347  16.429  -7.002
  397    HA   SER  29           HA       SER  29   5.499  16.531  -4.953
  398   1HB   SER  29          1HB       SER  29   2.751  16.137  -4.570
  399   2HB   SER  29          2HB       SER  29   3.513  14.996  -3.466
  400    HG   SER  29           HG       SER  29   4.669  16.692  -2.569
  401    H    ALA  30           H        ALA  30   6.277  14.406  -6.600
  402    HA   ALA  30           HA       ALA  30   6.893  12.262  -4.592
  403   1HB   ALA  30          1HB       ALA  30   5.224  11.870  -6.601
  404   2HB   ALA  30          2HB       ALA  30   6.705  11.766  -7.555
  405   3HB   ALA  30          3HB       ALA  30   6.432  10.641  -6.224
  406    H    LYS  31           H        LYS  31   8.612  14.361  -4.757
  407    HA   LYS  31           HA       LYS  31  11.058  13.136  -5.756
  408   1HB   LYS  31          1HB       LYS  31  11.469  15.072  -7.374
  409   2HB   LYS  31          2HB       LYS  31  10.223  13.928  -7.867
  410   1HG   LYS  31          1HG       LYS  31   8.880  15.739  -8.116
  411   2HG   LYS  31          2HG       LYS  31   8.797  15.770  -6.357
  412   1HD   LYS  31          1HD       LYS  31  10.319  17.501  -6.172
  413   2HD   LYS  31          2HD       LYS  31  11.150  17.070  -7.666
  414   1HE   LYS  31          1HE       LYS  31   9.867  18.504  -8.865
  415   2HE   LYS  31          2HE       LYS  31   8.377  17.826  -8.180
  416   1HZ   LYS  31          1HZ       LYS  31  10.180  19.581  -6.615
  417   2HZ   LYS  31          2HZ       LYS  31   8.908  20.207  -7.552
  418   3HZ   LYS  31          3HZ       LYS  31   8.575  19.150  -6.268
  419    HA   PRO  32           HA       PRO  32  11.466  16.500  -2.575
  420   1HB   PRO  32          1HB       PRO  32  11.526  15.001  -0.293
  421   2HB   PRO  32          2HB       PRO  32  10.021  15.613  -1.005
  422   1HG   PRO  32          1HG       PRO  32  11.069  12.881  -0.927
  423   2HG   PRO  32          2HG       PRO  32   9.416  13.449  -1.183
  424   1HD   PRO  32          1HD       PRO  32  11.297  12.549  -3.145
  425   2HD   PRO  32          2HD       PRO  32   9.638  13.124  -3.401
  426    H    VAL  33           H        VAL  33  13.610  17.087  -2.628
  427    HA   VAL  33           HA       VAL  33  15.957  16.972  -2.414
  428    HB   VAL  33           HB       VAL  33  15.222  14.633  -0.621
  429   1HG1  VAL  33          1HG1      VAL  33  17.668  15.024  -1.297
  430   2HG1  VAL  33          2HG1      VAL  33  17.563  16.527  -0.378
  431   3HG1  VAL  33          3HG1      VAL  33  17.324  14.979   0.433
  432   1HG2  VAL  33          1HG2      VAL  33  15.098  17.612  -0.270
  433   2HG2  VAL  33          2HG2      VAL  33  13.976  16.376   0.298
  434   3HG2  VAL  33          3HG2      VAL  33  15.521  16.605   1.115
  435    H    ASN  34           H        ASN  34  17.298  16.214  -3.994
  436    HA   ASN  34           HA       ASN  34  16.764  14.071  -5.739
  437   1HB   ASN  34          1HB       ASN  34  18.412  15.952  -5.995
  438   2HB   ASN  34          2HB       ASN  34  19.474  15.117  -4.861
  439   1HD2  ASN  34          2HD2      ASN  34  20.887  13.596  -5.760
  440   2HD2  ASN  34          1HD2      ASN  34  20.741  12.946  -7.320
  441    H    ARG  35           H        ARG  35  16.308  12.041  -4.854
  442    HA   ARG  35           HA       ARG  35  18.510  10.433  -3.889
  443   1HB   ARG  35          1HB       ARG  35  16.998  12.000  -1.999
  444   2HB   ARG  35          2HB       ARG  35  16.720  10.287  -1.684
  445   1HG   ARG  35          1HG       ARG  35  19.463  10.440  -2.185
  446   2HG   ARG  35          2HG       ARG  35  19.123  11.883  -1.229
  447   1HD   ARG  35          1HD       ARG  35  18.934  10.630   0.648
  448   2HD   ARG  35          2HD       ARG  35  17.693   9.620  -0.118
  449    HE   ARG  35           HE       ARG  35  20.341   9.015  -1.137
  450   1HH1  ARG  35          1HH1      ARG  35  18.130   8.500   1.486
  451   2HH1  ARG  35          2HH1      ARG  35  18.820   6.976   1.927
  452   1HH2  ARG  35          1HH2      ARG  35  21.233   7.033  -0.559
  453   2HH2  ARG  35          2HH2      ARG  35  20.570   6.147   0.775
  454    HA   PRO  36           HA       PRO  36  14.561   7.772  -3.788
  455   1HB   PRO  36          1HB       PRO  36  12.120   8.983  -4.037
  456   2HB   PRO  36          2HB       PRO  36  12.909   8.716  -2.470
  457   1HG   PRO  36          1HG       PRO  36  12.743  11.193  -4.107
  458   2HG   PRO  36          2HG       PRO  36  12.663  10.992  -2.350
  459   1HD   PRO  36          1HD       PRO  36  14.888  11.849  -3.674
  460   2HD   PRO  36          2HD       PRO  36  14.935  11.002  -2.113
  Start of MODEL   28
    1   1H5*    G   1          1H5*        G   1  11.564 -13.893   1.388
    2   2H5*    G   1          2H5*        G   1  12.980 -14.966   1.326
    3    H4*    G   1           H4*        G   1  11.343 -16.912   1.541
    4    H3*    G   1           H3*        G   1   9.478 -14.595   2.155
    5    H2*    G   1           H2*        G   1   8.499 -15.866   3.898
    6   2HO*    G   1          2HO*        G   1   8.621 -18.049   4.010
    7    H1*    G   1           H1*        G   1  10.852 -17.077   4.753
    8    H8     G   1           H8         G   1  11.525 -13.451   4.131
    9    H1     G   1           H1         G   1   8.173 -14.529   9.505
   10   1H2     G   1          1H2         G   1   7.318 -16.582   9.449
   11   2H2     G   1          2H2         G   1   8.019 -17.798   8.404
   12   1H5*    C   2          1H5*        C   2   6.992 -18.442   3.070
   13   2H5*    C   2          2H5*        C   2   5.969 -18.226   1.631
   14    H4*    C   2           H4*        C   2   4.534 -18.605   3.544
   15    H3*    C   2           H3*        C   2   4.608 -15.711   2.621
   16    H2*    C   2           H2*        C   2   3.064 -15.157   4.314
   17   2HO*    C   2          2HO*        C   2   1.898 -17.320   3.761
   18    H1*    C   2           H1*        C   2   4.045 -16.962   6.226
   19   1H4     C   2          1H4         C   2   6.339 -11.419   8.212
   20   2H4     C   2          2H4         C   2   7.334 -11.244   6.786
   21    H5     C   2           H5         C   2   7.006 -12.669   4.824
   22    H6     C   2           H6         C   2   6.348 -14.941   4.165
   23   1H5*    C   3          1H5*        C   3   0.247 -14.165   1.624
   24   2H5*    C   3          2H5*        C   3   1.413 -12.900   2.046
   25    H4*    C   3           H4*        C   3  -0.334 -14.547   3.874
   26    H3*    C   3           H3*        C   3   0.204 -11.607   3.419
   27    H2*    C   3           H2*        C   3  -0.166 -11.150   5.682
   28   2HO*    C   3          2HO*        C   3  -0.851 -13.176   6.986
   29    H1*    C   3           H1*        C   3   1.013 -13.459   6.686
   30   1H4     C   3          1H4         C   3   5.264  -8.725   7.223
   31   2H4     C   3          2H4         C   3   5.854  -9.077   5.614
   32    H5     C   3           H5         C   3   4.772 -10.690   4.157
   33    H6     C   3           H6         C   3   3.037 -12.379   3.983
   34   1H5*    C   4          1H5*        C   4  -4.170 -10.484   4.490
   35   2H5*    C   4          2H5*        C   4  -2.399 -10.420   4.494
   36    H4*    C   4           H4*        C   4  -4.128 -10.146   6.968
   37    H3*    C   4           H3*        C   4  -2.926  -8.059   5.128
   38    H2*    C   4           H2*        C   4  -2.334  -6.734   6.948
   39   2HO*    C   4          2HO*        C   4  -3.287  -6.774   8.870
   40    H1*    C   4           H1*        C   4  -1.668  -8.811   8.671
   41   1H4     C   4          1H4         C   4   3.508  -6.226   5.787
   42   2H4     C   4          2H4         C   4   3.916  -7.891   5.461
   43    H5     C   4           H5         C   4   1.613  -8.830   4.498
   44    H6     C   4           H6         C   4  -0.539  -9.421   5.309
   45   1H5*    U   5          1H5*        U   5  -5.525  -4.986   6.169
   46   2H5*    U   5          2H5*        U   5  -4.068  -5.970   6.326
   47    H4*    U   5           H4*        U   5  -4.785  -4.263   8.664
   48    H3*    U   5           H3*        U   5  -3.727  -3.180   6.024
   49    H2*    U   5           H2*        U   5  -2.260  -1.793   7.235
   50   2HO*    U   5          2HO*        U   5  -3.966  -2.297   9.452
   51    H1*    U   5           H1*        U   5  -1.829  -3.602   9.338
   52    H3     U   5           H3         U   5   2.113  -2.545   7.264
   53    H5     U   5           H5         U   5   0.553  -5.836   5.195
   54    H6     U   5           H6         U   5  -1.584  -5.318   6.206
   55   1H5*    G   6          1H5*        G   6  -2.076  -0.007   7.998
   56   2H5*    G   6          2H5*        G   6  -3.338   1.245   7.982
   57    H4*    G   6           H4*        G   6  -1.895   2.410   6.683
   58    H3*    G   6           H3*        G   6  -2.815   0.274   4.724
   59    H2*    G   6           H2*        G   6  -1.256   1.069   3.168
   60   2HO*    G   6          2HO*        G   6  -1.527   3.229   3.128
   61    H1*    G   6           H1*        G   6   0.718   1.776   5.036
   62    H8     G   6           H8         G   6  -1.237  -1.566   4.787
   63    H1     G   6           H1         G   6   4.747  -1.628   2.426
   64   1H2     G   6          1H2         G   6   5.532   0.483   2.336
   65   2H2     G   6          2H2         G   6   4.889   1.643   3.485
   66   1H5*    A   7          1H5*        A   7  -4.462   2.430   0.415
   67   2H5*    A   7          2H5*        A   7  -3.771   0.912   0.995
   68    H4*    A   7           H4*        A   7  -2.456   1.765  -0.882
   69    H3*    A   7           H3*        A   7  -1.075   2.203   1.784
   70    H2*    A   7           H2*        A   7   0.795   3.032   0.536
   71   2HO*    A   7          2HO*        A   7  -0.011   2.830  -1.963
   72    H1*    A   7           H1*        A   7  -0.773   4.376  -1.289
   73    H8     A   7           H8         A   7  -2.093   4.887   2.205
   74   1H6     A   7          1H6         A   7   1.413   9.403   2.848
   75   2H6     A   7          2H6         A   7   1.927   8.070   3.857
   76    H2     A   7           H2         A   7   3.180   6.911  -0.837
   77   1H5*    A   8          2H5*        A   8   2.324  -0.829  -1.700
   78   2H5*    A   8          1H5*        A   8   1.959  -0.497   0.002
   79    H4*    A   8           H4*        A   8   3.345   1.257  -2.023
   80    H3*    A   8           H3*        A   8   3.903   0.217   0.771
   81    H2*    A   8           H2*        A   8   5.213   2.132   1.225
   82   2HO*    A   8          2HO*        A   8   5.119   2.818  -1.527
   83    H1*    A   8           H1*        A   8   3.623   3.913  -0.256
   84    H8     A   8           H8         A   8   1.406   1.767   1.869
   85   1H6     A   8          1H6         A   8   1.384   4.627   5.891
   86   2H6     A   8          2H6         A   8   2.755   5.405   6.649
   87    H2     A   8           H2         A   8   5.398   6.630   3.197
   88   1H5*    A   9          2H5*        A   9   8.365  -1.530  -2.004
   89   2H5*    A   9          1H5*        A   9   7.415  -0.533  -0.882
   90    H4*    A   9           H4*        A   9   9.637   0.277  -2.388
   91    H3*    A   9           H3*        A   9   7.476   1.794  -0.902
   92    H2*    A   9           H2*        A   9   8.355   3.819  -1.752
   93   2HO*    A   9          2HO*        A   9  10.374   3.837  -2.875
   94    H1*    A   9           H1*        A   9   8.961   2.815  -4.287
   95    H8     A   9           H8         A   9   6.638   4.331  -1.973
   96   1H6     A   9          1H6         A   9   2.540   4.796  -6.446
   97   2H6     A   9          2H6         A   9   2.459   4.527  -4.719
   98    H2     A   9           H2         A   9   5.549   1.588  -7.670
   99   1H5*    A  10          1H5*        A  10   9.959   0.775   4.203
  100   2H5*    A  10          2H5*        A  10   8.295   1.054   3.647
  101    H4*    A  10           H4*        A  10  10.127   3.414   3.828
  102    H3*    A  10           H3*        A  10   8.954   1.920   6.175
  103    H2*    A  10           H2*        A  10   8.280   3.929   7.188
  104   2HO*    A  10          2HO*        A  10  10.055   5.193   5.372
  105    H1*    A  10           H1*        A  10   7.532   5.252   4.851
  106    H8     A  10           H8         A  10   6.089   2.053   4.146
  107   1H6     A  10          1H6         A  10   2.480   1.740   7.918
  108   2H6     A  10          2H6         A  10   1.512   3.183   7.710
  109    H2     A  10           H2         A  10   4.995   5.995   9.102
  110   1H5*    A  11          1H5*        A  11   9.702   4.714   8.952
  111   2H5*    A  11          2H5*        A  11  10.395   3.675  10.218
  112    H4*    A  11           H4*        A  11   8.014   4.535  10.609
  113    H3*    A  11           H3*        A  11   8.695   1.585  10.668
  114    H2*    A  11           H2*        A  11   6.437   1.077  11.128
  115   2HO*    A  11          2HO*        A  11   5.023   2.477  11.987
  116    H1*    A  11           H1*        A  11   5.314   3.041   9.530
  117    H8     A  11           H8         A  11   8.139   1.373   7.684
  118   1H6     A  11          1H6         A  11   4.493  -3.217   6.328
  119   2H6     A  11          2H6         A  11   5.093  -1.994   5.231
  120    H2     A  11           H2         A  11   2.120  -0.393   9.100
  121   1H5*    G  12          1H5*        G  12   8.754  -1.401  13.432
  122   2H5*    G  12          2H5*        G  12   8.601  -0.462  11.935
  123    H4*    G  12           H4*        G  12   6.404   0.117  13.740
  124    H3*    G  12           H3*        G  12   6.903  -2.777  13.031
  125    H2*    G  12           H2*        G  12   4.588  -3.029  12.575
  126   2HO*    G  12          2HO*        G  12   3.052  -1.650  13.300
  127    H1*    G  12           H1*        G  12   4.255  -0.524  11.378
  128    H8     G  12           H8         G  12   7.269  -1.432   9.701
  129    H1     G  12           H1         G  12   2.581  -5.537   8.145
  130   1H2     G  12          1H2         G  12   1.016  -5.523   9.721
  131   2H2     G  12          2H2         G  12   0.847  -4.125  10.759
  132   1H5*    G  13          1H5*        G  13   4.182  -3.138  16.107
  133   2H5*    G  13          2H5*        G  13   4.630  -4.209  17.451
  134    H4*    G  13           H4*        G  13   2.533  -4.988  16.584
  135    H3*    G  13           H3*        G  13   4.870  -6.648  15.626
  136    H2*    G  13           H2*        G  13   3.379  -7.992  14.412
  137   2HO*    G  13          2HO*        G  13   1.121  -7.908  14.736
  138    H1*    G  13           H1*        G  13   1.650  -5.968  13.618
  139    H8     G  13           H8         G  13   5.102  -4.694  13.083
  140    H1     G  13           H1         G  13   3.335  -9.060   8.714
  141   1H2     G  13          1H2         G  13   1.117  -9.669   9.270
  142   2H2     G  13          2H2         G  13   1.087 -10.117  10.962
  143   1H5*    G  14          1H5*        G  14   2.251  -9.093  17.634
  144   2H5*    G  14          2H5*        G  14   2.813 -10.148  18.951
  145    H4*    G  14           H4*        G  14   1.646 -11.621  17.524
  146    H3*    G  14           H3*        G  14   4.572 -11.682  16.727
  147    H2*    G  14           H2*        G  14   4.004 -13.332  15.118
  148   2HO*    G  14          2HO*        G  14   2.290 -14.593  15.266
  149    H1*    G  14           H1*        G  14   1.586 -12.147  14.380
  150    H8     G  14           H8         G  14   4.177  -9.452  14.677
  151    H1     G  14           H1         G  14   4.703 -12.951   9.300
  152   1H2     G  14          1H2         G  14   3.047 -14.530   9.342
  153   2H2     G  14          2H2         G  14   2.781 -15.250  10.915
  154   1H5*    C  15          1H5*        C  15   3.302 -15.353  16.888
  155   2H5*    C  15          2H5*        C  15   4.221 -16.487  17.906
  156    H4*    C  15           H4*        C  15   3.993 -17.559  15.786
  157    H3*    C  15           H3*        C  15   6.713 -16.253  16.081
  158    H2*    C  15           H2*        C  15   7.293 -17.112  13.962
  159   2HO*    C  15          2HO*        C  15   5.234 -18.966  14.495
  160    H1*    C  15           H1*        C  15   4.703 -16.899  12.868
  161   1H4     C  15          1H4         C  15   8.066 -12.267  10.161
  162   2H4     C  15          2H4         C  15   8.326 -11.476  11.705
  163    H5     C  15           H5         C  15   6.950 -12.126  13.644
  164    H6     C  15           H6         C  15   5.707 -13.934  14.645
  165   2H    ASP   2          2H        ASP   2   9.191 -10.129  -1.018
  166   1H    ASP   2          1H        ASP   2   9.024 -11.585  -1.878
  167   3H    ASP   2          3H        ASP   2  10.463 -11.256  -1.043
  168    HA   ASP   2           HA       ASP   2   9.332 -12.758   0.350
  169   1HB   ASP   2          1HB       ASP   2   8.590  -9.978   1.291
  170   2HB   ASP   2          2HB       ASP   2   9.014 -11.366   2.288
  171    H    ALA   3           H        ALA   3   7.168 -12.208   2.014
  172    HA   ALA   3           HA       ALA   3   4.911 -12.871   0.246
  173   1HB   ALA   3          1HB       ALA   3   5.529 -13.956   2.474
  174   2HB   ALA   3          2HB       ALA   3   4.962 -12.476   3.248
  175   3HB   ALA   3          3HB       ALA   3   3.842 -13.469   2.314
  176    H    GLN   4           H        GLN   4   5.943 -10.191   2.304
  177    HA   GLN   4           HA       GLN   4   3.456  -8.718   2.122
  178   1HB   GLN   4          1HB       GLN   4   5.325  -8.500   3.842
  179   2HB   GLN   4          2HB       GLN   4   6.270  -7.687   2.597
  180   1HG   GLN   4          1HG       GLN   4   4.559  -5.950   2.386
  181   2HG   GLN   4          2HG       GLN   4   3.546  -6.779   3.570
  182   1HE2  GLN   4          2HE2      GLN   4   4.953  -4.047   3.677
  183   2HE2  GLN   4          1HE2      GLN   4   5.840  -4.094   5.122
  184    H    THR   5           H        THR   5   6.631  -8.233   0.555
  185    HA   THR   5           HA       THR   5   5.910  -6.218  -1.284
  186    HB   THR   5           HB       THR   5   7.700  -8.654  -1.645
  187    HG1  THR   5           HG1      THR   5   8.264  -6.004  -0.806
  188   1HG2  THR   5          1HG2      THR   5   7.337  -6.113  -3.211
  189   2HG2  THR   5          2HG2      THR   5   8.893  -6.945  -3.202
  190   3HG2  THR   5          3HG2      THR   5   7.453  -7.771  -3.802
  191    H    ARG   6           H        ARG   6   5.282  -9.671  -1.267
  192    HA   ARG   6           HA       ARG   6   4.110  -9.852  -3.924
  193   1HB   ARG   6          1HB       ARG   6   4.685 -11.503  -1.607
  194   2HB   ARG   6          2HB       ARG   6   3.034 -11.795  -2.171
  195   1HG   ARG   6          1HG       ARG   6   3.791 -12.380  -4.366
  196   2HG   ARG   6          2HG       ARG   6   5.415 -11.769  -4.048
  197   1HD   ARG   6          1HD       ARG   6   5.385 -14.239  -3.905
  198   2HD   ARG   6          2HD       ARG   6   5.705 -13.542  -2.305
  199    HE   ARG   6           HE       ARG   6   3.588 -14.314  -1.602
  200   1HH1  ARG   6          1HH1      ARG   6   3.804 -14.237  -5.067
  201   2HH1  ARG   6          2HH1      ARG   6   2.264 -14.993  -5.295
  202   1HH2  ARG   6          1HH2      ARG   6   1.589 -15.296  -1.913
  203   2HH2  ARG   6          2HH2      ARG   6   1.017 -15.590  -3.521
  204    H    ARG   7           H        ARG   7   2.893  -9.639  -0.588
  205    HA   ARG   7           HA       ARG   7   0.132  -9.653  -1.182
  206   1HB   ARG   7          1HB       ARG   7   0.938  -9.904   1.068
  207   2HB   ARG   7          2HB       ARG   7   1.814  -8.376   0.990
  208   1HG   ARG   7          1HG       ARG   7  -0.536  -7.312   0.588
  209   2HG   ARG   7          2HG       ARG   7  -1.155  -8.830   1.234
  210   1HD   ARG   7          1HD       ARG   7  -0.222  -8.454   3.351
  211   2HD   ARG   7          2HD       ARG   7   0.994  -7.330   2.724
  212    HE   ARG   7           HE       ARG   7  -0.611  -5.613   2.899
  213   1HH1  ARG   7          1HH1      ARG   7  -2.140  -8.730   2.813
  214   2HH1  ARG   7          2HH1      ARG   7  -3.725  -8.089   3.072
  215   1HH2  ARG   7          1HH2      ARG   7  -2.680  -4.794   3.235
  216   2HH2  ARG   7          2HH2      ARG   7  -4.031  -5.875   3.310
  217    H    ARG   8           H        ARG   8   2.530  -7.081  -1.290
  218    HA   ARG   8           HA       ARG   8   0.872  -4.792  -1.493
  219   1HB   ARG   8          1HB       ARG   8   3.545  -5.388  -1.573
  220   2HB   ARG   8          2HB       ARG   8   3.255  -4.962  -3.257
  221   1HG   ARG   8          1HG       ARG   8   3.809  -2.909  -2.216
  222   2HG   ARG   8          2HG       ARG   8   2.052  -2.880  -2.344
  223   1HD   ARG   8          1HD       ARG   8   2.873  -2.180  -0.070
  224   2HD   ARG   8          2HD       ARG   8   1.837  -3.616  -0.007
  225    HE   ARG   8           HE       ARG   8   3.717  -4.851   0.688
  226   1HH1  ARG   8          1HH1      ARG   8   4.702  -1.959  -0.938
  227   2HH1  ARG   8          2HH1      ARG   8   6.385  -2.227  -0.645
  228   1HH2  ARG   8          1HH2      ARG   8   5.900  -5.194   1.068
  229   2HH2  ARG   8          2HH2      ARG   8   7.063  -4.050   0.486
  230    H    GLU   9           H        GLU   9   1.835  -7.162  -3.940
  231    HA   GLU   9           HA       GLU   9   0.648  -5.790  -6.175
  232   1HB   GLU   9          1HB       GLU   9   1.089  -8.743  -5.575
  233   2HB   GLU   9          2HB       GLU   9   0.680  -8.106  -7.167
  234   1HG   GLU   9          1HG       GLU   9   2.873  -6.571  -6.232
  235   2HG   GLU   9          2HG       GLU   9   3.265  -8.259  -5.902
  236    H    ARG  10           H        ARG  10  -0.520  -7.848  -3.614
  237    HA   ARG  10           HA       ARG  10  -3.233  -8.110  -4.647
  238   1HB   ARG  10          1HB       ARG  10  -1.574  -9.056  -2.464
  239   2HB   ARG  10          2HB       ARG  10  -3.120  -8.483  -1.840
  240   1HG   ARG  10          1HG       ARG  10  -4.341 -10.064  -3.024
  241   2HG   ARG  10          2HG       ARG  10  -3.109 -10.227  -4.276
  242   1HD   ARG  10          1HD       ARG  10  -1.644 -11.444  -2.728
  243   2HD   ARG  10          2HD       ARG  10  -2.821 -11.224  -1.418
  244    HE   ARG  10           HE       ARG  10  -4.160 -12.902  -2.406
  245   1HH1  ARG  10          1HH1      ARG  10  -1.816 -11.678  -4.658
  246   2HH1  ARG  10          2HH1      ARG  10  -2.205 -12.844  -5.876
  247   1HH2  ARG  10          1HH2      ARG  10  -4.656 -14.411  -3.996
  248   2HH2  ARG  10          2HH2      ARG  10  -3.806 -14.384  -5.505
  249    H    ARG  11           H        ARG  11  -1.370  -5.685  -3.089
  250    HA   ARG  11           HA       ARG  11  -3.767  -4.331  -1.966
  251   1HB   ARG  11          1HB       ARG  11  -0.794  -3.718  -1.927
  252   2HB   ARG  11          2HB       ARG  11  -2.030  -2.760  -1.114
  253   1HG   ARG  11          1HG       ARG  11  -1.419  -5.687  -0.581
  254   2HG   ARG  11          2HG       ARG  11  -0.999  -4.344   0.473
  255   1HD   ARG  11          1HD       ARG  11  -3.079  -4.335   1.386
  256   2HD   ARG  11          2HD       ARG  11  -3.839  -4.303  -0.211
  257    HE   ARG  11           HE       ARG  11  -2.692  -6.898   0.279
  258   1HH1  ARG  11          1HH1      ARG  11  -5.351  -4.833   1.128
  259   2HH1  ARG  11          2HH1      ARG  11  -6.420  -6.151   1.474
  260   1HH2  ARG  11          1HH2      ARG  11  -4.090  -8.606   0.731
  261   2HH2  ARG  11          2HH2      ARG  11  -5.710  -8.276   1.250
  262    H    ALA  12           H        ALA  12  -2.456  -4.589  -4.990
  263    HA   ALA  12           HA       ALA  12  -2.094  -1.907  -5.914
  264   1HB   ALA  12          1HB       ALA  12  -1.768  -4.121  -7.147
  265   2HB   ALA  12          2HB       ALA  12  -3.520  -4.189  -7.343
  266   3HB   ALA  12          3HB       ALA  12  -2.599  -2.881  -8.087
  267    H    GLU  13           H        GLU  13  -4.941  -3.697  -4.950
  268    HA   GLU  13           HA       GLU  13  -6.889  -1.848  -6.083
  269   1HB   GLU  13          1HB       GLU  13  -7.000  -3.971  -3.908
  270   2HB   GLU  13          2HB       GLU  13  -8.418  -3.171  -4.587
  271   1HG   GLU  13          1HG       GLU  13  -7.993  -4.087  -6.769
  272   2HG   GLU  13          2HG       GLU  13  -6.408  -4.683  -6.273
  273    H    LYS  14           H        LYS  14  -5.117  -2.249  -3.050
  274    HA   LYS  14           HA       LYS  14  -6.582  -0.140  -1.634
  275   1HB   LYS  14          1HB       LYS  14  -3.996  -1.675  -1.200
  276   2HB   LYS  14          2HB       LYS  14  -4.612  -0.493  -0.046
  277   1HG   LYS  14          1HG       LYS  14  -6.466  -2.642  -0.990
  278   2HG   LYS  14          2HG       LYS  14  -5.221  -3.069   0.187
  279   1HD   LYS  14          1HD       LYS  14  -6.382  -0.595   1.018
  280   2HD   LYS  14          2HD       LYS  14  -7.700  -1.706   0.646
  281   1HE   LYS  14          1HE       LYS  14  -5.418  -2.836   2.200
  282   2HE   LYS  14          2HE       LYS  14  -6.493  -1.708   3.052
  283   1HZ   LYS  14          1HZ       LYS  14  -7.381  -4.045   1.440
  284   2HZ   LYS  14          2HZ       LYS  14  -7.345  -3.985   3.138
  285   3HZ   LYS  14          3HZ       LYS  14  -8.394  -2.968   2.278
  286    H    GLN  15           H        GLN  15  -3.590  -0.568  -3.408
  287    HA   GLN  15           HA       GLN  15  -2.484   2.063  -3.044
  288   1HB   GLN  15          1HB       GLN  15  -1.999  -0.440  -4.449
  289   2HB   GLN  15          2HB       GLN  15  -1.618   0.920  -5.488
  290   1HG   GLN  15          1HG       GLN  15   0.121   1.620  -4.154
  291   2HG   GLN  15          2HG       GLN  15  -0.676   1.102  -2.692
  292   1HE2  GLN  15          2HE2      GLN  15  -1.079  -1.508  -2.815
  293   2HE2  GLN  15          1HE2      GLN  15   0.326  -2.388  -3.199
  294    H    ALA  16           H        ALA  16  -4.271   0.527  -5.724
  295    HA   ALA  16           HA       ALA  16  -4.411   2.894  -7.353
  296   1HB   ALA  16          1HB       ALA  16  -6.208   0.445  -7.169
  297   2HB   ALA  16          2HB       ALA  16  -6.183   1.579  -8.518
  298   3HB   ALA  16          3HB       ALA  16  -4.765   0.591  -8.171
  299    H    GLN  17           H        GLN  17  -6.308   1.765  -4.602
  300    HA   GLN  17           HA       GLN  17  -8.488   3.684  -5.100
  301   1HB   GLN  17          1HB       GLN  17  -7.680   1.654  -3.042
  302   2HB   GLN  17          2HB       GLN  17  -8.823   2.903  -2.554
  303   1HG   GLN  17          1HG       GLN  17  -9.329   1.517  -5.149
  304   2HG   GLN  17          2HG       GLN  17  -9.649   0.615  -3.668
  305   1HE2  GLN  17          2HE2      GLN  17 -12.002   0.768  -4.254
  306   2HE2  GLN  17          1HE2      GLN  17 -12.848   2.202  -3.927
  307    H    TRP  18           H        TRP  18  -5.575   3.384  -3.197
  308    HA   TRP  18           HA       TRP  18  -5.895   5.901  -1.750
  309   1HB   TRP  18          1HB       TRP  18  -4.583   4.021  -0.862
  310   2HB   TRP  18          2HB       TRP  18  -3.589   4.007  -2.307
  311    HD1  TRP  18           HD1      TRP  18  -4.065   5.929   0.923
  312    HE1  TRP  18           HE1      TRP  18  -2.164   7.667   1.124
  313    HE3  TRP  18           HE3      TRP  18  -1.979   5.428  -3.619
  314    HZ2  TRP  18           HZ2      TRP  18  -0.002   8.662  -0.462
  315    HZ3  TRP  18           HZ3      TRP  18  -0.019   6.710  -4.267
  316    HH2  TRP  18           HH2      TRP  18   0.988   8.318  -2.718
  317    H    LYS  19           H        LYS  19  -3.899   4.700  -4.405
  318    HA   LYS  19           HA       LYS  19  -2.471   7.052  -5.043
  319   1HB   LYS  19          1HB       LYS  19  -3.455   4.679  -6.654
  320   2HB   LYS  19          2HB       LYS  19  -2.419   5.918  -7.340
  321   1HG   LYS  19          1HG       LYS  19  -0.676   5.454  -5.717
  322   2HG   LYS  19          2HG       LYS  19  -1.716   4.298  -4.887
  323   1HD   LYS  19          1HD       LYS  19  -1.324   2.662  -6.405
  324   2HD   LYS  19          2HD       LYS  19  -1.429   3.775  -7.769
  325   1HE   LYS  19          1HE       LYS  19   0.857   4.560  -7.353
  326   2HE   LYS  19          2HE       LYS  19   0.967   3.523  -5.916
  327   1HZ   LYS  19          1HZ       LYS  19   0.265   2.473  -8.597
  328   2HZ   LYS  19          2HZ       LYS  19   1.868   2.535  -8.037
  329   3HZ   LYS  19          3HZ       LYS  19   0.714   1.593  -7.220
  330    H    ALA  20           H        ALA  20  -5.684   5.900  -5.933
  331    HA   ALA  20           HA       ALA  20  -6.250   7.861  -7.913
  332   1HB   ALA  20          1HB       ALA  20  -7.671   5.928  -6.213
  333   2HB   ALA  20          2HB       ALA  20  -8.654   7.300  -6.723
  334   3HB   ALA  20          3HB       ALA  20  -7.881   6.272  -7.930
  335    H    ALA  21           H        ALA  21  -6.255   7.952  -4.412
  336    HA   ALA  21           HA       ALA  21  -7.246  10.770  -4.517
  337   1HB   ALA  21          1HB       ALA  21  -7.574   8.522  -2.531
  338   2HB   ALA  21          2HB       ALA  21  -7.887  10.197  -2.075
  339   3HB   ALA  21          3HB       ALA  21  -8.837   9.437  -3.353
  340    H    ASN  22           H        ASN  22  -4.500   9.685  -4.756
  341    HA   ASN  22           HA       ASN  22  -3.238  11.502  -2.808
  342   1HB   ASN  22          1HB       ASN  22  -2.726   8.516  -2.874
  343   2HB   ASN  22          2HB       ASN  22  -1.712   9.678  -2.019
  344   1HD2  ASN  22          2HD2      ASN  22  -4.344   7.648  -1.624
  345   2HD2  ASN  22          1HD2      ASN  22  -5.031   8.359  -0.245
  346    HA   PRO  23           HA       PRO  23  -1.121  10.777  -6.967
  347   1HB   PRO  23          1HB       PRO  23  -1.799  13.167  -8.134
  348   2HB   PRO  23          2HB       PRO  23  -2.767  11.692  -8.335
  349   1HG   PRO  23          1HG       PRO  23  -3.212  14.014  -6.527
  350   2HG   PRO  23          2HG       PRO  23  -4.385  13.060  -7.451
  351   1HD   PRO  23          1HD       PRO  23  -3.958  12.719  -4.786
  352   2HD   PRO  23          2HD       PRO  23  -4.494  11.408  -5.850
  353    H    LEU  24           H        LEU  24  -1.665  13.387  -4.726
  354    HA   LEU  24           HA       LEU  24   0.653  14.990  -5.154
  355   1HB   LEU  24          1HB       LEU  24  -0.039  15.978  -3.138
  356   2HB   LEU  24          2HB       LEU  24  -1.517  15.142  -3.596
  357    HG   LEU  24           HG       LEU  24   0.572  13.889  -1.785
  358   1HD1  LEU  24          1HD1      LEU  24  -0.631  16.128  -1.045
  359   2HD1  LEU  24          2HD1      LEU  24  -1.980  15.036  -0.733
  360   3HD1  LEU  24          3HD1      LEU  24  -0.438  14.789   0.087
  361   1HD2  LEU  24          1HD2      LEU  24  -1.639  12.785  -3.079
  362   2HD2  LEU  24          2HD2      LEU  24  -0.846  12.106  -1.662
  363   3HD2  LEU  24          3HD2      LEU  24  -2.255  13.151  -1.473
  364    H    LEU  25           H        LEU  25   0.134  11.977  -3.431
  365    HA   LEU  25           HA       LEU  25   3.008  11.827  -2.666
  366   1HB   LEU  25          1HB       LEU  25   0.398  10.617  -1.806
  367   2HB   LEU  25          2HB       LEU  25   1.860   9.657  -1.564
  368    HG   LEU  25           HG       LEU  25   1.972  12.512  -0.720
  369   1HD1  LEU  25          1HD1      LEU  25   0.107  10.489   0.403
  370   2HD1  LEU  25          2HD1      LEU  25   1.061  11.401   1.573
  371   3HD1  LEU  25          3HD1      LEU  25   0.012  12.250   0.438
  372   1HD2  LEU  25          1HD2      LEU  25   3.759  10.578  -0.568
  373   2HD2  LEU  25          2HD2      LEU  25   3.575  11.706   0.775
  374   3HD2  LEU  25          3HD2      LEU  25   2.837  10.105   0.859
  375    H    VAL  26           H        VAL  26   1.961  11.673  -5.348
  376    HA   VAL  26           HA       VAL  26   3.017   9.033  -6.168
  377    HB   VAL  26           HB       VAL  26   0.230   9.935  -6.067
  378   1HG1  VAL  26          1HG1      VAL  26   1.394   9.130  -8.741
  379   2HG1  VAL  26          2HG1      VAL  26  -0.307   8.889  -8.345
  380   3HG1  VAL  26          3HG1      VAL  26   0.370  10.518  -8.363
  381   1HG2  VAL  26          1HG2      VAL  26   1.643   7.332  -6.709
  382   2HG2  VAL  26          2HG2      VAL  26   0.974   7.825  -5.153
  383   3HG2  VAL  26          3HG2      VAL  26  -0.105   7.478  -6.506
  384    H    GLY  27           H        GLY  27   4.595   9.664  -7.586
  385   1HA   GLY  27          1HA       GLY  27   5.547  10.685  -9.498
  386   2HA   GLY  27          2HA       GLY  27   3.946  11.321  -9.891
  387    H    VAL  28           H        VAL  28   3.227  12.974  -7.961
  388    HA   VAL  28           HA       VAL  28   4.720  15.338  -8.244
  389    HB   VAL  28           HB       VAL  28   2.906  14.371  -6.020
  390   1HG1  VAL  28          1HG1      VAL  28   4.579  16.614  -5.968
  391   2HG1  VAL  28          2HG1      VAL  28   3.024  17.256  -6.499
  392   3HG1  VAL  28          3HG1      VAL  28   3.138  16.371  -4.978
  393   1HG2  VAL  28          1HG2      VAL  28   2.229  14.673  -8.582
  394   2HG2  VAL  28          2HG2      VAL  28   1.143  15.181  -7.288
  395   3HG2  VAL  28          3HG2      VAL  28   2.149  16.371  -8.114
  396    H    SER  29           H        SER  29   6.418  16.243  -7.112
  397    HA   SER  29           HA       SER  29   8.415  16.210  -5.871
  398   1HB   SER  29          1HB       SER  29   6.300  15.239  -3.946
  399   2HB   SER  29          2HB       SER  29   7.908  15.754  -3.444
  400    HG   SER  29           HG       SER  29   6.124  17.337  -4.986
  401    H    ALA  30           H        ALA  30   8.260  13.911  -7.452
  402    HA   ALA  30           HA       ALA  30   9.735  11.970  -5.747
  403   1HB   ALA  30          1HB       ALA  30   7.081  11.629  -6.216
  404   2HB   ALA  30          2HB       ALA  30   7.743  10.838  -7.647
  405   3HB   ALA  30          3HB       ALA  30   8.202  10.278  -6.037
  406    H    LYS  31           H        LYS  31  10.922  13.660  -7.543
  407    HA   LYS  31           HA       LYS  31  11.636  11.807  -9.790
  408   1HB   LYS  31          1HB       LYS  31  10.936  14.750  -9.828
  409   2HB   LYS  31          2HB       LYS  31  11.802  13.977 -11.155
  410   1HG   LYS  31          1HG       LYS  31   9.668  12.248 -10.638
  411   2HG   LYS  31          2HG       LYS  31   8.965  13.858 -10.487
  412   1HD   LYS  31          1HD       LYS  31  10.422  14.247 -12.715
  413   2HD   LYS  31          2HD       LYS  31  10.130  12.516 -12.876
  414   1HE   LYS  31          1HE       LYS  31   7.691  12.903 -12.623
  415   2HE   LYS  31          2HE       LYS  31   7.994  14.648 -12.504
  416   1HZ   LYS  31          1HZ       LYS  31   9.037  13.023 -14.750
  417   2HZ   LYS  31          2HZ       LYS  31   7.503  13.745 -14.811
  418   3HZ   LYS  31          3HZ       LYS  31   8.891  14.713 -14.653
  419    HA   PRO  32           HA       PRO  32  15.760  12.706  -8.552
  420   1HB   PRO  32          1HB       PRO  32  17.085  12.287 -10.911
  421   2HB   PRO  32          2HB       PRO  32  16.429  10.965  -9.923
  422   1HG   PRO  32          1HG       PRO  32  15.322  12.218 -12.383
  423   2HG   PRO  32          2HG       PRO  32  15.319  10.521 -11.880
  424   1HD   PRO  32          1HD       PRO  32  13.152  12.166 -11.659
  425   2HD   PRO  32          2HD       PRO  32  13.440  10.766 -10.602
  426    H    VAL  33           H        VAL  33  17.787  13.914  -9.967
  427    HA   VAL  33           HA       VAL  33  16.909  16.708 -10.029
  428    HB   VAL  33           HB       VAL  33  19.024  15.989  -9.017
  429   1HG1  VAL  33          1HG1      VAL  33  19.357  14.733 -11.689
  430   2HG1  VAL  33          2HG1      VAL  33  20.807  15.450 -10.988
  431   3HG1  VAL  33          3HG1      VAL  33  19.933  14.193 -10.113
  432   1HG2  VAL  33          1HG2      VAL  33  18.669  18.191 -10.545
  433   2HG2  VAL  33          2HG2      VAL  33  20.180  17.848  -9.702
  434   3HG2  VAL  33          3HG2      VAL  33  20.013  17.448 -11.412
  435    H    ASN  34           H        ASN  34  16.489  14.410 -12.311
  436    HA   ASN  34           HA       ASN  34  17.625  15.613 -14.686
  437   1HB   ASN  34          1HB       ASN  34  16.452  13.241 -14.001
  438   2HB   ASN  34          2HB       ASN  34  15.131  14.019 -14.875
  439   1HD2  ASN  34          2HD2      ASN  34  15.723  14.877 -17.123
  440   2HD2  ASN  34          1HD2      ASN  34  16.901  14.038 -18.011
  441    H    ARG  35           H        ARG  35  16.830  17.858 -13.821
  442    HA   ARG  35           HA       ARG  35  13.990  18.463 -14.227
  443   1HB   ARG  35          1HB       ARG  35  16.214  20.478 -13.917
  444   2HB   ARG  35          2HB       ARG  35  14.564  20.557 -13.310
  445   1HG   ARG  35          1HG       ARG  35  15.602  18.261 -12.107
  446   2HG   ARG  35          2HG       ARG  35  16.940  19.406 -12.059
  447   1HD   ARG  35          1HD       ARG  35  14.163  20.246 -11.215
  448   2HD   ARG  35          2HD       ARG  35  15.272  19.451 -10.079
  449    HE   ARG  35           HE       ARG  35  16.605  21.579 -11.518
  450   1HH1  ARG  35          1HH1      ARG  35  14.419  20.883  -8.912
  451   2HH1  ARG  35          2HH1      ARG  35  14.825  22.318  -8.032
  452   1HH2  ARG  35          1HH2      ARG  35  17.125  23.440 -10.365
  453   2HH2  ARG  35          2HH2      ARG  35  16.349  23.758  -8.849
  454    HA   PRO  36           HA       PRO  36  15.747  20.761 -18.017
  455   1HB   PRO  36          1HB       PRO  36  18.282  20.187 -18.860
  456   2HB   PRO  36          2HB       PRO  36  17.922  21.465 -17.684
  457   1HG   PRO  36          1HG       PRO  36  19.027  18.754 -17.248
  458   2HG   PRO  36          2HG       PRO  36  19.343  20.259 -16.375
  459   1HD   PRO  36          1HD       PRO  36  17.694  18.214 -15.502
  460   2HD   PRO  36          2HD       PRO  36  17.657  19.886 -14.907
  Start of MODEL   29
    1   1H5*    G   1          1H5*        G   1  11.968 -15.836   1.798
    2   2H5*    G   1          2H5*        G   1  13.128 -17.081   2.316
    3    H4*    G   1           H4*        G   1  11.040 -18.661   2.300
    4    H3*    G   1           H3*        G   1   9.778 -15.900   2.463
    5    H2*    G   1           H2*        G   1   8.227 -16.758   4.036
    6   2HO*    G   1          2HO*        G   1   7.496 -18.672   3.411
    7    H1*    G   1           H1*        G   1  10.061 -18.416   5.320
    8    H8     G   1           H8         G   1  11.319 -14.901   4.536
    9    H1     G   1           H1         G   1   7.687 -15.351   9.816
   10   1H2     G   1          1H2         G   1   6.983 -17.447  10.060
   11   2H2     G   1          2H2         G   1   6.950 -18.528   8.685
   12   1H5*    C   2          1H5*        C   2   6.073 -17.025   0.967
   13   2H5*    C   2          2H5*        C   2   7.146 -16.652   2.333
   14    H4*    C   2           H4*        C   2   4.740 -18.352   2.866
   15    H3*    C   2           H3*        C   2   4.675 -15.371   2.282
   16    H2*    C   2           H2*        C   2   3.191 -15.060   4.073
   17   2HO*    C   2          2HO*        C   2   2.827 -17.825   4.460
   18    H1*    C   2           H1*        C   2   4.289 -17.025   5.749
   19   1H4     C   2          1H4         C   2   6.370 -11.542   8.152
   20   2H4     C   2          2H4         C   2   7.592 -11.427   6.907
   21    H5     C   2           H5         C   2   7.357 -12.703   4.820
   22    H6     C   2           H6         C   2   6.702 -14.926   3.999
   23   1H5*    C   3          1H5*        C   3   0.302 -13.837   1.557
   24   2H5*    C   3          2H5*        C   3   1.462 -12.568   1.996
   25    H4*    C   3           H4*        C   3  -0.075 -14.431   3.808
   26    H3*    C   3           H3*        C   3   0.233 -11.437   3.512
   27    H2*    C   3           H2*        C   3  -0.011 -11.153   5.829
   28   2HO*    C   3          2HO*        C   3  -1.715 -12.349   6.412
   29    H1*    C   3           H1*        C   3   1.379 -13.439   6.603
   30   1H4     C   3          1H4         C   3   5.457  -8.563   7.149
   31   2H4     C   3          2H4         C   3   5.805  -8.646   5.438
   32    H5     C   3           H5         C   3   4.785 -10.316   4.002
   33    H6     C   3           H6         C   3   3.164 -12.113   3.861
   34   1H5*    C   4          1H5*        C   4  -3.241 -11.455   5.855
   35   2H5*    C   4          2H5*        C   4  -4.418 -10.377   5.070
   36    H4*    C   4           H4*        C   4  -3.988  -9.615   7.342
   37    H3*    C   4           H3*        C   4  -2.723  -7.856   5.203
   38    H2*    C   4           H2*        C   4  -2.005  -6.408   6.895
   39   2HO*    C   4          2HO*        C   4  -2.740  -6.804   9.123
   40    H1*    C   4           H1*        C   4  -1.431  -8.412   8.765
   41   1H4     C   4          1H4         C   4   4.286  -7.064   6.426
   42   2H4     C   4          2H4         C   4   3.689  -7.045   4.786
   43    H5     C   4           H5         C   4   1.809  -8.781   4.559
   44    H6     C   4           H6         C   4  -0.343  -9.326   5.461
   45   1H5*    U   5          1H5*        U   5  -5.038  -4.457   6.132
   46   2H5*    U   5          2H5*        U   5  -3.718  -5.603   6.349
   47    H4*    U   5           H4*        U   5  -4.247  -3.852   8.681
   48    H3*    U   5           H3*        U   5  -3.151  -2.774   6.051
   49    H2*    U   5           H2*        U   5  -1.569  -1.545   7.280
   50   2HO*    U   5          2HO*        U   5  -1.820  -1.395   9.633
   51    H1*    U   5           H1*        U   5  -1.261  -3.451   9.328
   52    H3     U   5           H3         U   5   2.671  -2.445   7.177
   53    H5     U   5           H5         U   5   0.930  -5.567   4.993
   54    H6     U   5           H6         U   5  -1.108  -5.123   6.182
   55   1H5*    G   6          1H5*        G   6  -2.560  -0.114   7.353
   56   2H5*    G   6          2H5*        G   6  -3.073   1.361   8.187
   57    H4*    G   6           H4*        G   6  -2.159   2.726   6.589
   58    H3*    G   6           H3*        G   6  -2.801   0.532   4.586
   59    H2*    G   6           H2*        G   6  -1.136   1.362   3.183
   60   2HO*    G   6          2HO*        G   6  -1.924   3.715   4.098
   61    H1*    G   6           H1*        G   6   0.606   2.203   5.229
   62    H8     G   6           H8         G   6  -1.062  -1.267   4.998
   63    H1     G   6           H1         G   6   4.921  -0.917   2.669
   64   1H2     G   6          1H2         G   6   5.510   1.243   2.464
   65   2H2     G   6          2H2         G   6   4.773   2.396   3.560
   66   1H5*    A   7          1H5*        A   7  -4.722   1.591   0.618
   67   2H5*    A   7          2H5*        A   7  -3.716   0.127   0.658
   68    H4*    A   7           H4*        A   7  -2.976   1.596  -1.139
   69    H3*    A   7           H3*        A   7  -1.088   1.541   1.241
   70    H2*    A   7           H2*        A   7   0.340   3.002   0.044
   71   2HO*    A   7          2HO*        A   7  -0.080   3.400  -2.233
   72    H1*    A   7           H1*        A   7  -1.702   4.369  -1.265
   73    H8     A   7           H8         A   7  -2.670   4.594   2.258
   74   1H6     A   7          1H6         A   7   1.979   7.900   3.679
   75   2H6     A   7          2H6         A   7   0.452   8.684   3.341
   76    H2     A   7           H2         A   7   2.523   6.718  -0.849
   77   1H5*    A   8          1H5*        A   8   0.942   0.945  -1.780
   78   2H5*    A   8          2H5*        A   8   2.306  -0.179  -1.934
   79    H4*    A   8           H4*        A   8   3.138   2.072  -2.215
   80    H3*    A   8           H3*        A   8   3.758   0.855   0.499
   81    H2*    A   8           H2*        A   8   4.975   2.791   1.090
   82   2HO*    A   8          2HO*        A   8   4.759   3.702  -1.594
   83    H1*    A   8           H1*        A   8   3.230   4.590  -0.167
   84    H8     A   8           H8         A   8   1.107   2.122   1.622
   85   1H6     A   8          1H6         A   8   1.752   5.478   6.615
   86   2H6     A   8          2H6         A   8   1.801   3.745   6.370
   87    H2     A   8           H2         A   8   5.110   6.695   3.718
   88   1H5*    A   9          2H5*        A   9   8.384  -0.241  -2.389
   89   2H5*    A   9          1H5*        A   9   7.331   0.550  -1.197
   90    H4*    A   9           H4*        A   9   9.444   1.724  -2.616
   91    H3*    A   9           H3*        A   9   7.119   2.874  -1.050
   92    H2*    A   9           H2*        A   9   7.810   5.043  -1.705
   93   2HO*    A   9          2HO*        A   9   9.859   5.413  -1.779
   94    H1*    A   9           H1*        A   9   8.515   4.311  -4.308
   95    H8     A   9           H8         A   9   6.052   5.390  -1.894
   96   1H6     A   9          1H6         A   9   2.269   6.372  -5.304
   97   2H6     A   9          2H6         A   9   1.508   4.840  -5.673
   98    H2     A   9           H2         A   9   5.237   3.065  -7.821
   99   1H5*    A  10          1H5*        A  10   9.810   1.263   3.899
  100   2H5*    A  10          2H5*        A  10   8.191   1.729   3.344
  101    H4*    A  10           H4*        A  10  10.181   3.925   3.558
  102    H3*    A  10           H3*        A  10   9.143   2.372   5.930
  103    H2*    A  10           H2*        A  10   8.657   4.353   7.093
  104   2HO*    A  10          2HO*        A  10  10.384   5.592   5.217
  105    H1*    A  10           H1*        A  10   7.783   5.837   4.904
  106    H8     A  10           H8         A  10   6.022   2.927   4.013
  107   1H6     A  10          1H6         A  10   2.030   3.815   8.519
  108   2H6     A  10          2H6         A  10   2.722   2.388   7.780
  109    H2     A  10           H2         A  10   5.833   6.123   9.579
  110   1H5*    A  11          1H5*        A  11  10.520   4.650   9.102
  111   2H5*    A  11          2H5*        A  11  11.053   3.232  10.035
  112    H4*    A  11           H4*        A  11   8.746   4.468  10.558
  113    H3*    A  11           H3*        A  11   9.304   1.494  10.572
  114    H2*    A  11           H2*        A  11   7.037   1.054  11.036
  115   2HO*    A  11          2HO*        A  11   6.892   3.786  11.765
  116    H1*    A  11           H1*        A  11   5.963   3.078   9.477
  117    H8     A  11           H8         A  11   8.733   1.389   7.576
  118   1H6     A  11          1H6         A  11   5.009  -3.148   6.225
  119   2H6     A  11          2H6         A  11   5.624  -1.928   5.132
  120    H2     A  11           H2         A  11   2.706  -0.308   9.037
  121   1H5*    G  12          1H5*        G  12   9.256  -1.530  13.387
  122   2H5*    G  12          2H5*        G  12   9.150  -0.624  11.868
  123    H4*    G  12           H4*        G  12   6.983   0.091  13.670
  124    H3*    G  12           H3*        G  12   7.343  -2.831  12.991
  125    H2*    G  12           H2*        G  12   5.028  -2.978  12.510
  126   2HO*    G  12          2HO*        G  12   3.700  -1.028  12.984
  127    H1*    G  12           H1*        G  12   4.812  -0.463  11.300
  128    H8     G  12           H8         G  12   7.783  -1.509   9.628
  129    H1     G  12           H1         G  12   2.926  -5.440   8.132
  130   1H2     G  12          1H2         G  12   1.268  -5.177   9.543
  131   2H2     G  12          2H2         G  12   1.362  -4.075  10.899
  132   1H5*    G  13          1H5*        G  13   4.698  -3.362  16.355
  133   2H5*    G  13          2H5*        G  13   5.402  -4.508  17.514
  134    H4*    G  13           H4*        G  13   3.248  -5.340  16.784
  135    H3*    G  13           H3*        G  13   5.596  -6.766  15.505
  136    H2*    G  13           H2*        G  13   4.111  -8.156  14.367
  137   2HO*    G  13          2HO*        G  13   2.240  -8.744  15.122
  138    H1*    G  13           H1*        G  13   2.188  -6.215  13.849
  139    H8     G  13           H8         G  13   5.509  -4.711  13.084
  140    H1     G  13           H1         G  13   3.604  -9.003   8.695
  141   1H2     G  13          1H2         G  13   1.527  -9.789   9.381
  142   2H2     G  13          2H2         G  13   1.550 -10.211  11.080
  143   1H5*    G  14          1H5*        G  14   0.919  -9.077  16.628
  144   2H5*    G  14          2H5*        G  14   1.137  -9.867  18.206
  145    H4*    G  14           H4*        G  14   0.597 -11.692  16.874
  146    H3*    G  14           H3*        G  14   3.606 -11.397  16.607
  147    H2*    G  14           H2*        G  14   3.573 -13.307  15.199
  148   2HO*    G  14          2HO*        G  14   0.839 -13.768  15.555
  149    H1*    G  14           H1*        G  14   1.204 -12.620  13.890
  150    H8     G  14           H8         G  14   3.738  -9.817  14.519
  151    H1     G  14           H1         G  14   4.626 -13.116   9.061
  152   1H2     G  14          1H2         G  14   3.000 -14.662   8.890
  153   2H2     G  14          2H2         G  14   2.393 -15.355  10.377
  154   1H5*    C  15          1H5*        C  15   2.214 -15.440  16.996
  155   2H5*    C  15          2H5*        C  15   3.254 -16.308  18.146
  156    H4*    C  15           H4*        C  15   2.991 -17.603  16.074
  157    H3*    C  15           H3*        C  15   5.749 -16.398  16.475
  158    H2*    C  15           H2*        C  15   6.442 -17.493  14.507
  159   2HO*    C  15          2HO*        C  15   5.766 -19.545  14.688
  160    H1*    C  15           H1*        C  15   3.962 -17.263  13.185
  161   1H4     C  15          1H4         C  15   7.767 -13.091  10.325
  162   2H4     C  15          2H4         C  15   8.027 -12.202  11.817
  163    H5     C  15           H5         C  15   6.514 -12.589  13.735
  164    H6     C  15           H6         C  15   5.115 -14.237  14.819
  165   2H    ASP   2          2H        ASP   2   9.703  -8.813   1.096
  166   1H    ASP   2          1H        ASP   2   9.806  -9.682  -0.360
  167   3H    ASP   2          3H        ASP   2  11.103  -9.699   0.736
  168    HA   ASP   2           HA       ASP   2  10.037 -11.761   1.068
  169   1HB   ASP   2          1HB       ASP   2   8.904  -9.816   3.099
  170   2HB   ASP   2          2HB       ASP   2   9.356 -11.497   3.372
  171    H    ALA   3           H        ALA   3   7.679 -12.193   2.490
  172    HA   ALA   3           HA       ALA   3   5.714 -12.530   0.468
  173   1HB   ALA   3          1HB       ALA   3   5.474 -12.298   3.483
  174   2HB   ALA   3          2HB       ALA   3   4.244 -12.995   2.428
  175   3HB   ALA   3          3HB       ALA   3   5.818 -13.775   2.581
  176    H    GLN   4           H        GLN   4   6.431  -9.784   2.515
  177    HA   GLN   4           HA       GLN   4   3.897  -8.430   2.195
  178   1HB   GLN   4          1HB       GLN   4   5.548  -7.979   3.990
  179   2HB   GLN   4          2HB       GLN   4   6.693  -7.402   2.785
  180   1HG   GLN   4          1HG       GLN   4   5.038  -5.656   2.109
  181   2HG   GLN   4          2HG       GLN   4   3.994  -6.180   3.431
  182   1HE2  GLN   4          2HE2      GLN   4   5.460  -3.554   3.057
  183   2HE2  GLN   4          1HE2      GLN   4   6.385  -3.372   4.464
  184    H    THR   5           H        THR   5   7.090  -7.811   0.743
  185    HA   THR   5           HA       THR   5   6.362  -5.868  -1.147
  186    HB   THR   5           HB       THR   5   8.238  -8.238  -1.495
  187    HG1  THR   5           HG1      THR   5   9.086  -7.225   0.165
  188   1HG2  THR   5          1HG2      THR   5   7.677  -5.769  -3.044
  189   2HG2  THR   5          2HG2      THR   5   9.375  -6.208  -2.846
  190   3HG2  THR   5          3HG2      THR   5   8.251  -7.342  -3.599
  191    H    ARG   6           H        ARG   6   5.904  -9.350  -1.172
  192    HA   ARG   6           HA       ARG   6   4.784  -9.538  -3.858
  193   1HB   ARG   6          1HB       ARG   6   5.412 -11.207  -1.561
  194   2HB   ARG   6          2HB       ARG   6   3.803 -11.590  -2.187
  195   1HG   ARG   6          1HG       ARG   6   5.210 -11.395  -4.517
  196   2HG   ARG   6          2HG       ARG   6   6.469 -11.994  -3.435
  197   1HD   ARG   6          1HD       ARG   6   3.739 -13.289  -3.481
  198   2HD   ARG   6          2HD       ARG   6   5.003 -13.769  -4.631
  199    HE   ARG   6           HE       ARG   6   6.017 -13.627  -1.914
  200   1HH1  ARG   6          1HH1      ARG   6   4.254 -15.565  -4.190
  201   2HH1  ARG   6          2HH1      ARG   6   4.673 -17.058  -3.424
  202   1HH2  ARG   6          1HH2      ARG   6   6.557 -15.572  -0.925
  203   2HH2  ARG   6          2HH2      ARG   6   5.972 -17.064  -1.583
  204    H    ARG   7           H        ARG   7   3.542  -9.434  -0.535
  205    HA   ARG   7           HA       ARG   7   0.787  -9.629  -1.127
  206   1HB   ARG   7          1HB       ARG   7   1.504  -9.878   1.109
  207   2HB   ARG   7          2HB       ARG   7   2.483  -8.420   1.042
  208   1HG   ARG   7          1HG       ARG   7   0.147  -7.227   0.693
  209   2HG   ARG   7          2HG       ARG   7  -0.473  -8.692   1.451
  210   1HD   ARG   7          1HD       ARG   7   0.156  -7.925   3.483
  211   2HD   ARG   7          2HD       ARG   7   1.833  -7.771   2.925
  212    HE   ARG   7           HE       ARG   7  -0.135  -5.605   3.016
  213   1HH1  ARG   7          1HH1      ARG   7   2.736  -6.840   1.524
  214   2HH1  ARG   7          2HH1      ARG   7   3.280  -5.287   1.018
  215   1HH2  ARG   7          1HH2      ARG   7   0.575  -3.592   2.358
  216   2HH2  ARG   7          2HH2      ARG   7   2.064  -3.450   1.486
  217    H    ARG   8           H        ARG   8   3.011  -6.898  -1.191
  218    HA   ARG   8           HA       ARG   8   1.230  -4.697  -1.394
  219   1HB   ARG   8          1HB       ARG   8   3.872  -4.978  -1.354
  220   2HB   ARG   8          2HB       ARG   8   3.701  -4.970  -3.106
  221   1HG   ARG   8          1HG       ARG   8   4.045  -2.702  -2.586
  222   2HG   ARG   8          2HG       ARG   8   2.295  -2.823  -2.753
  223   1HD   ARG   8          1HD       ARG   8   2.955  -1.553  -0.701
  224   2HD   ARG   8          2HD       ARG   8   2.066  -3.034  -0.303
  225    HE   ARG   8           HE       ARG   8   4.051  -3.906   0.633
  226   1HH1  ARG   8          1HH1      ARG   8   4.742  -1.255  -1.493
  227   2HH1  ARG   8          2HH1      ARG   8   6.428  -1.232  -1.106
  228   1HH2  ARG   8          1HH2      ARG   8   6.241  -3.868   1.130
  229   2HH2  ARG   8          2HH2      ARG   8   7.275  -2.703   0.371
  230    H    GLU   9           H        GLU   9   2.375  -6.965  -3.863
  231    HA   GLU   9           HA       GLU   9   1.071  -5.701  -6.086
  232   1HB   GLU   9          1HB       GLU   9   1.676  -8.629  -5.510
  233   2HB   GLU   9          2HB       GLU   9   1.306  -7.970  -7.104
  234   1HG   GLU   9          1HG       GLU   9   3.359  -6.332  -6.127
  235   2HG   GLU   9          2HG       GLU   9   3.830  -7.965  -5.653
  236    H    ARG  10           H        ARG  10   0.039  -7.867  -3.543
  237    HA   ARG  10           HA       ARG  10  -2.636  -8.294  -4.614
  238   1HB   ARG  10          1HB       ARG  10  -0.949  -9.207  -2.462
  239   2HB   ARG  10          2HB       ARG  10  -2.496  -8.688  -1.793
  240   1HG   ARG  10          1HG       ARG  10  -3.591 -10.452  -2.691
  241   2HG   ARG  10          2HG       ARG  10  -2.813 -10.234  -4.258
  242   1HD   ARG  10          1HD       ARG  10  -0.694 -11.219  -3.052
  243   2HD   ARG  10          2HD       ARG  10  -1.883 -11.863  -1.904
  244    HE   ARG  10           HE       ARG  10  -2.704 -12.304  -4.651
  245   1HH1  ARG  10          1HH1      ARG  10  -0.662 -13.448  -2.087
  246   2HH1  ARG  10          2HH1      ARG  10  -0.637 -15.076  -2.674
  247   1HH2  ARG  10          1HH2      ARG  10  -2.666 -14.422  -5.405
  248   2HH2  ARG  10          2HH2      ARG  10  -1.766 -15.626  -4.544
  249    H    ARG  11           H        ARG  11  -0.976  -5.751  -2.984
  250    HA   ARG  11           HA       ARG  11  -3.460  -4.617  -1.837
  251   1HB   ARG  11          1HB       ARG  11  -0.569  -3.699  -1.931
  252   2HB   ARG  11          2HB       ARG  11  -1.865  -2.843  -1.102
  253   1HG   ARG  11          1HG       ARG  11  -0.841  -5.629  -0.476
  254   2HG   ARG  11          2HG       ARG  11  -0.670  -4.195   0.525
  255   1HD   ARG  11          1HD       ARG  11  -2.682  -4.599   1.490
  256   2HD   ARG  11          2HD       ARG  11  -3.470  -4.609  -0.095
  257    HE   ARG  11           HE       ARG  11  -1.957  -7.032   0.270
  258   1HH1  ARG  11          1HH1      ARG  11  -4.870  -5.410   1.233
  259   2HH1  ARG  11          2HH1      ARG  11  -5.729  -6.881   1.533
  260   1HH2  ARG  11          1HH2      ARG  11  -3.084  -8.938   0.662
  261   2HH2  ARG  11          2HH2      ARG  11  -4.726  -8.868   1.212
  262    H    ALA  12           H        ALA  12  -2.119  -4.747  -4.893
  263    HA   ALA  12           HA       ALA  12  -2.112  -2.070  -5.850
  264   1HB   ALA  12          1HB       ALA  12  -3.157  -4.623  -7.147
  265   2HB   ALA  12          2HB       ALA  12  -2.691  -3.161  -8.017
  266   3HB   ALA  12          3HB       ALA  12  -1.475  -4.093  -7.143
  267    H    GLU  13           H        GLU  13  -4.738  -4.162  -4.856
  268    HA   GLU  13           HA       GLU  13  -6.875  -2.532  -5.992
  269   1HB   GLU  13          1HB       GLU  13  -6.778  -4.661  -3.822
  270   2HB   GLU  13          2HB       GLU  13  -8.262  -4.030  -4.537
  271   1HG   GLU  13          1HG       GLU  13  -8.075  -5.567  -6.171
  272   2HG   GLU  13          2HG       GLU  13  -6.600  -4.761  -6.707
  273    H    LYS  14           H        LYS  14  -5.080  -2.764  -2.954
  274    HA   LYS  14           HA       LYS  14  -6.769  -0.820  -1.547
  275   1HB   LYS  14          1HB       LYS  14  -3.979  -1.925  -1.007
  276   2HB   LYS  14          2HB       LYS  14  -4.996  -1.085   0.166
  277   1HG   LYS  14          1HG       LYS  14  -5.811  -3.650  -1.222
  278   2HG   LYS  14          2HG       LYS  14  -5.040  -3.600   0.366
  279   1HD   LYS  14          1HD       LYS  14  -6.875  -2.436   1.335
  280   2HD   LYS  14          2HD       LYS  14  -7.554  -2.035  -0.242
  281   1HE   LYS  14          1HE       LYS  14  -7.388  -4.832  -0.270
  282   2HE   LYS  14          2HE       LYS  14  -7.958  -4.434   1.362
  283   1HZ   LYS  14          1HZ       LYS  14  -9.056  -3.086  -1.032
  284   2HZ   LYS  14          2HZ       LYS  14  -9.700  -4.554  -0.481
  285   3HZ   LYS  14          3HZ       LYS  14  -9.726  -3.186   0.527
  286    H    GLN  15           H        GLN  15  -3.802  -0.949  -3.371
  287    HA   GLN  15           HA       GLN  15  -2.907   1.761  -2.935
  288   1HB   GLN  15          1HB       GLN  15  -2.220  -0.684  -4.393
  289   2HB   GLN  15          2HB       GLN  15  -1.880   0.749  -5.351
  290   1HG   GLN  15          1HG       GLN  15  -0.306   1.551  -3.844
  291   2HG   GLN  15          2HG       GLN  15  -1.055   0.721  -2.482
  292   1HE2  GLN  15          2HE2      GLN  15  -0.983  -1.798  -2.698
  293   2HE2  GLN  15          1HE2      GLN  15   0.471  -2.458  -3.275
  294    H    ALA  16           H        ALA  16  -4.519   0.116  -5.665
  295    HA   ALA  16           HA       ALA  16  -4.846   2.495  -7.256
  296   1HB   ALA  16          1HB       ALA  16  -4.972   0.111  -8.035
  297   2HB   ALA  16          2HB       ALA  16  -6.502  -0.058  -7.175
  298   3HB   ALA  16          3HB       ALA  16  -6.373   1.057  -8.536
  299    H    GLN  17           H        GLN  17  -6.662   1.126  -4.568
  300    HA   GLN  17           HA       GLN  17  -9.020   2.820  -5.037
  301   1HB   GLN  17          1HB       GLN  17  -7.999   0.913  -2.934
  302   2HB   GLN  17          2HB       GLN  17  -9.384   1.942  -2.576
  303   1HG   GLN  17          1HG       GLN  17  -9.251   0.230  -5.062
  304   2HG   GLN  17          2HG       GLN  17  -9.920  -0.367  -3.543
  305   1HE2  GLN  17          2HE2      GLN  17 -11.548   1.435  -2.534
  306   2HE2  GLN  17          1HE2      GLN  17 -12.677   2.041  -3.648
  307    H    TRP  18           H        TRP  18  -6.086   2.826  -3.114
  308    HA   TRP  18           HA       TRP  18  -6.725   5.261  -1.620
  309   1HB   TRP  18          1HB       TRP  18  -5.205   3.555  -0.733
  310   2HB   TRP  18          2HB       TRP  18  -4.205   3.656  -2.167
  311    HD1  TRP  18           HD1      TRP  18  -4.863   5.452   1.109
  312    HE1  TRP  18           HE1      TRP  18  -3.185   7.409   1.320
  313    HE3  TRP  18           HE3      TRP  18  -2.814   5.346  -3.504
  314    HZ2  TRP  18           HZ2      TRP  18  -1.224   8.738  -0.296
  315    HZ3  TRP  18           HZ3      TRP  18  -1.083   6.921  -4.166
  316    HH2  TRP  18           HH2      TRP  18  -0.263   8.597  -2.591
  317    H    LYS  19           H        LYS  19  -4.626   4.339  -4.299
  318    HA   LYS  19           HA       LYS  19  -3.497   6.880  -4.895
  319   1HB   LYS  19          1HB       LYS  19  -4.085   4.366  -6.479
  320   2HB   LYS  19          2HB       LYS  19  -3.273   5.748  -7.201
  321   1HG   LYS  19          1HG       LYS  19  -1.583   5.632  -5.336
  322   2HG   LYS  19          2HG       LYS  19  -2.318   4.106  -4.852
  323   1HD   LYS  19          1HD       LYS  19  -0.675   3.311  -6.270
  324   2HD   LYS  19          2HD       LYS  19  -1.984   3.539  -7.431
  325   1HE   LYS  19          1HE       LYS  19  -1.093   5.790  -7.988
  326   2HE   LYS  19          2HE       LYS  19   0.247   5.523  -6.855
  327   1HZ   LYS  19          1HZ       LYS  19   0.705   3.424  -8.087
  328   2HZ   LYS  19          2HZ       LYS  19  -0.424   3.914  -9.258
  329   3HZ   LYS  19          3HZ       LYS  19   0.983   4.829  -8.996
  330    H    ALA  20           H        ALA  20  -6.500   5.294  -5.827
  331    HA   ALA  20           HA       ALA  20  -7.323   7.102  -7.846
  332   1HB   ALA  20          1HB       ALA  20  -8.545   5.148  -5.977
  333   2HB   ALA  20          2HB       ALA  20  -9.644   6.302  -6.730
  334   3HB   ALA  20          3HB       ALA  20  -8.661   5.235  -7.734
  335    H    ALA  21           H        ALA  21  -7.241   7.380  -4.364
  336    HA   ALA  21           HA       ALA  21  -8.530  10.062  -4.592
  337   1HB   ALA  21          1HB       ALA  21  -9.653   7.935  -3.407
  338   2HB   ALA  21          2HB       ALA  21  -8.657   8.487  -2.061
  339   3HB   ALA  21          3HB       ALA  21  -9.864   9.565  -2.763
  340    H    ASN  22           H        ASN  22  -5.684   9.151  -4.591
  341    HA   ASN  22           HA       ASN  22  -4.712  11.145  -2.642
  342   1HB   ASN  22          1HB       ASN  22  -3.912   8.225  -2.574
  343   2HB   ASN  22          2HB       ASN  22  -3.130   9.507  -1.652
  344   1HD2  ASN  22          2HD2      ASN  22  -5.413   7.138  -1.363
  345   2HD2  ASN  22          1HD2      ASN  22  -6.360   7.795  -0.117
  346    HA   PRO  23           HA       PRO  23  -2.196  10.438  -6.584
  347   1HB   PRO  23          1HB       PRO  23  -3.166  12.507  -8.093
  348   2HB   PRO  23          2HB       PRO  23  -3.850  10.870  -8.162
  349   1HG   PRO  23          1HG       PRO  23  -4.853  13.283  -6.756
  350   2HG   PRO  23          2HG       PRO  23  -5.752  11.985  -7.558
  351   1HD   PRO  23          1HD       PRO  23  -5.409  12.186  -4.839
  352   2HD   PRO  23          2HD       PRO  23  -5.750  10.671  -5.687
  353    H    LEU  24           H        LEU  24  -3.384  13.160  -4.758
  354    HA   LEU  24           HA       LEU  24  -1.448  15.156  -5.246
  355   1HB   LEU  24          1HB       LEU  24  -2.377  16.086  -3.287
  356   2HB   LEU  24          2HB       LEU  24  -3.628  14.926  -3.716
  357    HG   LEU  24           HG       LEU  24  -1.364  14.273  -1.794
  358   1HD1  LEU  24          1HD1      LEU  24  -3.027  16.201  -1.178
  359   2HD1  LEU  24          2HD1      LEU  24  -4.167  14.881  -0.919
  360   3HD1  LEU  24          3HD1      LEU  24  -2.670  14.947   0.010
  361   1HD2  LEU  24          1HD2      LEU  24  -3.279  12.629  -3.056
  362   2HD2  LEU  24          2HD2      LEU  24  -2.296  12.192  -1.659
  363   3HD2  LEU  24          3HD2      LEU  24  -3.906  12.878  -1.432
  364    H    LEU  25           H        LEU  25  -1.311  12.217  -3.388
  365    HA   LEU  25           HA       LEU  25   1.495  12.769  -2.567
  366   1HB   LEU  25          1HB       LEU  25  -0.343  12.239  -0.894
  367   2HB   LEU  25          2HB       LEU  25  -0.527  10.675  -1.677
  368    HG   LEU  25           HG       LEU  25   1.103  11.153   0.472
  369   1HD1  LEU  25          1HD1      LEU  25   0.976   9.109  -1.680
  370   2HD1  LEU  25          2HD1      LEU  25   2.330   9.019  -0.557
  371   3HD1  LEU  25          3HD1      LEU  25   0.674   8.943   0.044
  372   1HD2  LEU  25          1HD2      LEU  25   2.629  12.543  -0.956
  373   2HD2  LEU  25          2HD2      LEU  25   3.421  11.122  -0.276
  374   3HD2  LEU  25          3HD2      LEU  25   2.914  11.125  -1.965
  375    H    VAL  26           H        VAL  26   0.581  12.127  -5.205
  376    HA   VAL  26           HA       VAL  26   2.175   9.704  -5.770
  377    HB   VAL  26           HB       VAL  26  -0.744   9.903  -5.603
  378   1HG1  VAL  26          1HG1      VAL  26   0.451   9.147  -8.286
  379   2HG1  VAL  26          2HG1      VAL  26  -1.168   8.669  -7.773
  380   3HG1  VAL  26          3HG1      VAL  26  -0.768  10.380  -7.952
  381   1HG2  VAL  26          1HG2      VAL  26   1.272   7.696  -6.112
  382   2HG2  VAL  26          2HG2      VAL  26   0.413   8.058  -4.613
  383   3HG2  VAL  26          3HG2      VAL  26  -0.462   7.390  -5.993
  384    H    GLY  27           H        GLY  27   3.448  10.352  -7.519
  385   1HA   GLY  27          1HA       GLY  27   3.953  11.337  -9.625
  386   2HA   GLY  27          2HA       GLY  27   2.251  11.795  -9.771
  387    H    VAL  28           H        VAL  28   1.730  13.338  -7.649
  388    HA   VAL  28           HA       VAL  28   2.763  15.904  -8.145
  389    HB   VAL  28           HB       VAL  28   1.474  14.465  -5.844
  390   1HG1  VAL  28          1HG1      VAL  28   3.006  16.104  -4.785
  391   2HG1  VAL  28          2HG1      VAL  28   2.311  17.382  -5.785
  392   3HG1  VAL  28          3HG1      VAL  28   1.317  16.569  -4.578
  393   1HG2  VAL  28          1HG2      VAL  28   0.734  16.598  -7.836
  394   2HG2  VAL  28          2HG2      VAL  28  -0.060  15.053  -7.525
  395   3HG2  VAL  28          3HG2      VAL  28  -0.215  16.373  -6.366
  396    H    SER  29           H        SER  29   4.160  17.136  -6.347
  397    HA   SER  29           HA       SER  29   6.725  15.814  -6.170
  398   1HB   SER  29          1HB       SER  29   5.730  18.393  -6.078
  399   2HB   SER  29          2HB       SER  29   6.241  18.120  -4.414
  400    HG   SER  29           HG       SER  29   8.262  18.023  -5.048
  401    H    ALA  30           H        ALA  30   5.071  14.031  -4.950
  402    HA   ALA  30           HA       ALA  30   4.377  13.062  -2.874
  403   1HB   ALA  30          1HB       ALA  30   7.331  13.467  -3.112
  404   2HB   ALA  30          2HB       ALA  30   6.704  12.744  -1.631
  405   3HB   ALA  30          3HB       ALA  30   6.393  11.973  -3.187
  406    H    LYS  31           H        LYS  31   3.426  15.494  -2.485
  407    HA   LYS  31           HA       LYS  31   4.293  16.197   0.279
  408   1HB   LYS  31          1HB       LYS  31   4.196  18.614  -0.429
  409   2HB   LYS  31          2HB       LYS  31   5.485  17.701  -1.213
  410   1HG   LYS  31          1HG       LYS  31   4.645  18.341  -3.203
  411   2HG   LYS  31          2HG       LYS  31   3.214  17.371  -2.860
  412   1HD   LYS  31          1HD       LYS  31   2.576  19.522  -1.403
  413   2HD   LYS  31          2HD       LYS  31   3.621  20.313  -2.585
  414   1HE   LYS  31          1HE       LYS  31   2.275  19.270  -4.422
  415   2HE   LYS  31          2HE       LYS  31   1.172  18.619  -3.193
  416   1HZ   LYS  31          1HZ       LYS  31   0.924  20.902  -2.329
  417   2HZ   LYS  31          2HZ       LYS  31   1.845  21.479  -3.635
  418   3HZ   LYS  31          3HZ       LYS  31   0.345  20.740  -3.919
  419    HA   PRO  32           HA       PRO  32  -0.201  15.964   0.385
  420   1HB   PRO  32          1HB       PRO  32  -0.426  16.192   3.105
  421   2HB   PRO  32          2HB       PRO  32   0.000  14.671   2.295
  422   1HG   PRO  32          1HG       PRO  32   1.766  16.650   3.653
  423   2HG   PRO  32          2HG       PRO  32   1.832  14.880   3.671
  424   1HD   PRO  32          1HD       PRO  32   3.477  16.405   2.140
  425   2HD   PRO  32          2HD       PRO  32   2.961  14.768   1.677
  426    H    VAL  33           H        VAL  33  -1.827  17.574   0.656
  427    HA   VAL  33           HA       VAL  33  -1.061  20.171   1.877
  428    HB   VAL  33           HB       VAL  33  -0.293  20.213  -0.473
  429   1HG1  VAL  33          1HG1      VAL  33  -3.181  19.489  -1.020
  430   2HG1  VAL  33          2HG1      VAL  33  -2.116  20.164  -2.252
  431   3HG1  VAL  33          3HG1      VAL  33  -1.734  18.609  -1.513
  432   1HG2  VAL  33          1HG2      VAL  33  -1.264  22.262   0.624
  433   2HG2  VAL  33          2HG2      VAL  33  -1.410  22.261  -1.133
  434   3HG2  VAL  33          3HG2      VAL  33  -2.809  21.872  -0.132
  435    H    ASN  34           H        ASN  34  -2.919  21.475   2.382
  436    HA   ASN  34           HA       ASN  34  -5.397  19.962   2.779
  437   1HB   ASN  34          1HB       ASN  34  -4.148  22.529   3.578
  438   2HB   ASN  34          2HB       ASN  34  -5.911  22.551   3.493
  439   1HD2  ASN  34          2HD2      ASN  34  -4.073  22.546   5.923
  440   2HD2  ASN  34          1HD2      ASN  34  -4.591  21.222   6.851
  441    H    ARG  35           H        ARG  35  -6.250  19.594   0.660
  442    HA   ARG  35           HA       ARG  35  -6.711  21.918  -1.121
  443   1HB   ARG  35          1HB       ARG  35  -7.309  18.950  -1.364
  444   2HB   ARG  35          2HB       ARG  35  -7.450  20.128  -2.670
  445   1HG   ARG  35          1HG       ARG  35  -4.876  20.534  -1.644
  446   2HG   ARG  35          2HG       ARG  35  -5.075  18.781  -1.657
  447   1HD   ARG  35          1HD       ARG  35  -4.176  19.511  -3.823
  448   2HD   ARG  35          2HD       ARG  35  -5.843  18.948  -4.053
  449    HE   ARG  35           HE       ARG  35  -6.076  21.665  -3.435
  450   1HH1  ARG  35          1HH1      ARG  35  -4.493  19.732  -5.844
  451   2HH1  ARG  35          2HH1      ARG  35  -4.594  20.956  -7.063
  452   1HH2  ARG  35          2HH2      ARG  35  -6.203  23.251  -5.028
  453   2HH2  ARG  35          1HH2      ARG  35  -5.557  22.938  -6.604
  454    HA   PRO  36           HA       PRO  36 -10.773  22.092   0.864
  455   1HB   PRO  36          1HB       PRO  36 -11.436  24.568  -0.090
  456   2HB   PRO  36          2HB       PRO  36 -10.386  24.328   1.320
  457   1HG   PRO  36          1HG       PRO  36  -9.668  25.013  -1.478
  458   2HG   PRO  36          2HG       PRO  36  -8.936  25.548   0.042
  459   1HD   PRO  36          1HD       PRO  36  -7.879  23.608  -1.593
  460   2HD   PRO  36          2HD       PRO  36  -7.543  23.751   0.144