*HEADER    RNA                                     30-MAR-07   2PCV              
*TITLE     SOLUTION STRUCTURE OF AN RRNA SUBSTRATE BOUND TO THE                  
*TITLE    2 PSEUDOURIDYLATION POCKET OF A BOX H/ACA SNORNA                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: U65 BOX H/ACA SNORNA;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RNA HAIRPIN CONTAINING THE PSEUDOURIDYLATION               
*COMPND   5 POCKET;                                                              
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: SYNTHESIZED BY IN VITRO TRANSCRIPTION USING           
*SOURCE   4 T7 RNA POLYMERASE FROM LINEARIZED PLASMID DNA. THIS                  
*SOURCE   5 SEQUENCE NATURALLY OCCURS IN HUMANS.                                 
*KEYWDS    BOX H/ACA SNORNA, PSEUDOURIDYLATION, RRNA                             
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    H.JIN, J.P.LORIA, P.B.MOORE                                           
*REVDAT   1   08-MAY-07 2PCV    0                                                

Distance restraints

assign (resid 1  and  name H1' ) (resid 1  and  name H8  ) 4.00 1.35 1.50
assign (resid 1  and  name H1' ) (resid 2  and  name H8  ) 4.00 1.35 1.50
assign (resid 1  and  name H2' ) (resid 1  and  name H8  ) 4.00 1.35 1.50
assign (resid 1  and  name H2' ) (resid 2  and  name H8  ) 2.90 0.90 0.90
assign (resid 1  and  name H3' ) (resid 1  and  name H8  ) 4.00 1.35 1.50
assign (resid 1  and  name H3' ) (resid 2  and  name H8  ) 4.00 1.35 1.50
assign (resid 2  and  name H1' ) (resid 2  and  name H8  ) 4.00 1.35 1.50
assign (resid 2  and  name H1' ) (resid 3  and  name H8  ) 4.00 1.35 1.50
assign (resid 2  and  name H2' ) (resid 2  and  name H8  ) 4.00 1.35 1.50
assign (resid 2  and  name H2' ) (resid 3  and  name H8  ) 2.90 0.90 0.90
assign (resid 2  and  name H3' ) (resid 2  and  name H8  ) 4.00 1.35 1.50
assign (resid 2  and  name H3' ) (resid 3  and  name H8  ) 4.00 1.35 1.50
assign (resid 3  and  name H1' ) (resid 3  and  name H8  ) 4.00 1.35 1.50
assign (resid 3  and  name H1' ) (resid 4  and  name H6  ) 4.00 1.35 1.50
assign (resid 3  and  name H2' ) (resid 3  and  name H8  ) 4.00 1.35 1.50
assign (resid 3  and  name H2' ) (resid 4  and  name H6  ) 2.90 0.90 0.90
assign (resid 3  and  name H3' ) (resid 3  and  name H8  ) 4.00 1.35 1.50
assign (resid 3  and  name H3' ) (resid 4  and  name H6  ) 4.00 1.35 1.50
assign (resid 4  and  name H1' ) (resid 4  and  name H6  ) 4.00 1.35 1.50
assign (resid 4  and  name H1' ) (resid 5  and  name H6  ) 4.00 1.35 1.50
assign (resid 4  and  name H2' ) (resid 4  and  name H6  ) 4.00 1.35 1.50
assign (resid 4  and  name H2' ) (resid 5  and  name H6  ) 2.90 0.90 0.90
assign (resid 4  and  name H3' ) (resid 4  and  name H6  ) 4.00 1.35 1.50
assign (resid 4  and  name H3' ) (resid 5  and  name H6  ) 4.00 1.35 1.50
assign (resid 5  and  name H1' ) (resid 5  and  name H6  ) 4.00 1.35 1.50
assign (resid 5  and  name H1' ) (resid 6  and  name H6  ) 4.00 1.35 1.50
assign (resid 5  and  name H2' ) (resid 5  and  name H6  ) 4.00 1.35 1.50
assign (resid 5  and  name H2' ) (resid 6  and  name H6  ) 2.90 0.90 0.90
assign (resid 5  and  name H3' ) (resid 5  and  name H6  ) 4.00 1.35 1.50
assign (resid 5  and  name H3' ) (resid 6  and  name H6  ) 4.00 1.35 1.50
assign (resid 6  and  name H1' ) (resid 6  and  name H6  ) 4.00 1.35 1.50
assign (resid 6  and  name H1' ) (resid 7  and  name H8  ) 4.50 1.50 1.50
assign (resid 6  and  name H2' ) (resid 6  and  name H6  ) 2.90 0.90 0.90
assign (resid 6  and  name H2' ) (resid 7  and  name H8  ) 2.90 0.90 0.90
assign (resid 6  and  name H3' ) (resid 6  and  name H6  ) 4.00 1.35 1.50 
assign (resid 6  and  name H3' ) (resid 7  and  name H8  ) 4.00 1.35 1.50
assign (resid 7  and  name H1' ) (resid 7  and  name H8  ) 4.00 1.35 1.50
assign (resid 7  and  name H1' ) (resid 8  and  name H6  ) 4.50 1.50 1.50
assign (resid 7  and  name H2' ) (resid 7  and  name H8  ) 4.00 1.35 1.50
assign (resid 7  and  name H2' ) (resid 8  and  name H6  ) 4.00 1.35 1.50
assign (resid 7  and  name H3' ) (resid 7  and  name H8  ) 4.00 1.35 1.50
assign (resid 7  and  name H3' ) (resid 8  and  name H6  ) 4.00 1.35 1.50
assign (resid 8  and  name H1' ) (resid 8  and  name H6  ) 4.50 1.50 1.50
assign (resid 8  and  name H2' ) (resid 8  and  name H6  ) 2.90 0.90 0.90
assign (resid 8  and  name H2' ) (resid 9  and  name H6  ) 4.00 1.35 1.50
assign (resid 9  and  name H1' ) (resid 9  and  name H6  ) 4.50 1.50 1.50
assign (resid 9  and  name H1' ) (resid 10  and  name H8  ) 4.00 1.35 1.50
assign (resid 9  and  name H2' ) (resid 9  and  name H6  ) 4.00 1.35 1.50
assign (resid 9  and  name H2' ) (resid 10  and  name H8  ) 4.00 1.35 1.50
assign (resid 10  and  name H1' ) (resid 10  and  name H8  ) 4.00 1.35 1.50
assign (resid 10  and  name H1' ) (resid 11  and  name H6  ) 4.00 1.35 1.50
assign (resid 10  and  name H2' ) (resid 10  and  name H8  ) 4.00 1.35 1.50
assign (resid 10  and  name H2' ) (resid 11  and  name H6  ) 2.90 0.90 0.90
assign (resid 10  and  name H3' ) (resid 10  and  name H8  ) 4.00 1.35 1.50
assign (resid 11  and  name H1' ) (resid 11  and  name H6  ) 4.00 1.35 1.50
assign (resid 11  and  name H1' ) (resid 12  and  name H6  ) 4.00 1.35 1.50
assign (resid 11  and  name H2' ) (resid 11  and  name H6  ) 4.00 1.35 1.50
assign (resid 11  and  name H2' ) (resid 12  and  name H6  ) 2.90 0.90 0.90
assign (resid 11  and  name H3' ) (resid 11  and  name H6  ) 4.00 1.35 1.50
assign (resid 11  and  name H3' ) (resid 12  and  name H6  ) 4.00 1.35 1.50
assign (resid 11  and  name H4' ) (resid 12  and  name H6  ) 4.00 1.35 1.50
assign (resid 12  and  name H1' ) (resid 12  and  name H6  ) 4.00 1.35 1.50
assign (resid 12  and  name H1' ) (resid 13  and  name H8  ) 4.00 1.35 1.50
assign (resid 12  and  name H2' ) (resid 12  and  name H6  ) 4.00 1.35 1.50
assign (resid 12  and  name H2' ) (resid 13  and  name H8  ) 2.90 0.90 0.90
assign (resid 12  and  name H3' ) (resid 12  and  name H6  ) 4.00 1.35 1.50
assign (resid 12  and  name H3' ) (resid 13  and  name H8  ) 4.00 1.35 1.50
assign (resid 13  and  name H1' ) (resid 13  and  name H8  ) 4.00 1.35 1.50
assign (resid 13  and  name H1' ) (resid 14  and  name H6  ) 4.00 1.35 1.50
assign (resid 13  and  name H2' ) (resid 13  and  name H8  ) 4.00 1.35 1.50
assign (resid 13  and  name H2' ) (resid 14  and  name H6  ) 2.90 0.90 0.90
assign (resid 13  and  name H3' ) (resid 13  and  name H8  ) 4.00 1.35 1.50
assign (resid 13  and  name H3' ) (resid 14  and  name H6  ) 4.00 1.35 1.50
assign (resid 14  and  name H1' ) (resid 14  and  name H6  ) 4.00 1.35 1.50
assign (resid 14  and  name H1' ) (resid 15  and  name H8  ) 4.00 1.35 1.50
assign (resid 14  and  name H2' ) (resid 14  and  name H6  ) 4.00 1.35 1.50 
assign (resid 14  and  name H2' ) (resid 15  and  name H8  ) 2.90 0.90 0.90
assign (resid 14  and  name H3' ) (resid 14  and  name H6  ) 4.00 1.35 1.50
assign (resid 14  and  name H3' ) (resid 15  and  name H8  ) 4.00 1.35 1.50
assign (resid 15  and  name H1' ) (resid 15  and  name H8  ) 4.00 1.35 1.50
assign (resid 15  and  name H1' ) (resid 16  and  name H8  ) 4.00 1.35 1.50
assign (resid 15  and  name H2' ) (resid 15  and  name H8  ) 4.00 1.35 1.50 
assign (resid 15  and  name H2' ) (resid 16  and  name H8  ) 2.90 0.90 0.90
assign (resid 15  and  name H3' ) (resid 15  and  name H8  ) 4.00 1.35 1.50
assign (resid 15  and  name H3' ) (resid 16  and  name H8  ) 4.00 1.35 1.50
assign (resid 16  and  name H1' ) (resid 16  and  name H8  ) 4.00 1.35 1.50
assign (resid 16  and  name H1' ) (resid 17  and  name H8  ) 4.50 1.50 1.50
assign (resid 16  and  name H2' ) (resid 16  and  name H8  ) 4.00 1.35 1.50
assign (resid 16  and  name H2' ) (resid 17  and  name H8  ) 4.00 1.35 1.50
assign (resid 16  and  name H3' ) (resid 16  and  name H8  ) 2.90 0.90 0.90
assign (resid 16  and  name H3' ) (resid 17  and  name H8  ) 4.50 1.50 1.50
assign (resid 17  and  name H1' ) (resid 17  and  name H8  ) 4.00 1.35 1.50
assign (resid 17  and  name H1' ) (resid 18  and  name H8  ) 4.00 1.35 1.50
assign (resid 17  and  name H2' ) (resid 17  and  name H8  ) 4.00 1.35 1.50
assign (resid 17  and  name H2' ) (resid 18  and  name H8  ) 2.90 0.90 0.90
assign (resid 17  and  name H3' ) (resid 17  and  name H8  ) 4.00 1.35 1.50
assign (resid 17  and  name H3' ) (resid 18  and  name H8  ) 2.90 0.90 0.90
assign (resid 18  and  name H1' ) (resid 18  and  name H8  ) 4.00 1.35 1.50
assign (resid 18  and  name H1' ) (resid 19  and  name H8  ) 4.00 1.35 1.50
assign (resid 18  and  name H2' ) (resid 18  and  name H8  ) 4.00 1.35 1.50
assign (resid 18  and  name H2' ) (resid 19  and  name H8  ) 2.90 0.90 0.90
assign (resid 18  and  name H3' ) (resid 18  and  name H8  ) 4.00 1.35 1.50
assign (resid 18  and  name H3' ) (resid 19  and  name H8  ) 4.00 1.35 1.50
assign (resid 19  and  name H1' ) (resid 19  and  name H8  ) 4.00 1.35 1.50
assign (resid 19  and  name H1' ) (resid 20  and  name H6  ) 4.50 1.50 1.50
assign (resid 19  and  name H8  ) (resid 20  and  name H1' ) 4.50 1.50 1.50
assign (resid 19  and  name H2' ) (resid 19  and  name H8  ) 2.90 0.90 0.90
assign (resid 19  and  name H2' ) (resid 20  and  name H6  ) 4.00 1.35 1.50
assign (resid 19  and  name H3' ) (resid 19  and  name H8  ) 4.00 1.35 1.50
assign (resid 19  and  name H3' ) (resid 20  and  name H6  ) 4.00 1.35 1.50
assign (resid 20  and  name H1' ) (resid 20  and  name H6  ) 4.00 1.35 1.50
assign (resid 20  and  name H1' ) (resid 21  and  name H8  ) 4.00 1.35 1.50
assign (resid 20  and  name H2' ) (resid 20  and  name H6  ) 4.00 1.35 1.50
assign (resid 20  and  name H2' ) (resid 21  and  name H8  ) 2.90 0.90 0.90
assign (resid 20  and  name H3' ) (resid 20  and  name H6  ) 4.00 1.35 1.50
assign (resid 20  and  name H3' ) (resid 21  and  name H8  ) 4.00 1.35 1.50
assign (resid 20  and  name H5' ) (resid 20  and  name H6  ) 2.90 0.90 0.90
assign (resid 20  and  name H5'' ) (resid 20  and  name H6  ) 4.00 1.35 1.50
assign (resid 21  and  name H1' ) (resid 21  and  name H8  ) 4.00 1.35 1.50
assign (resid 21  and  name H1' ) (resid 22  and  name H6  ) 4.00 1.35 1.50
assign (resid 21  and  name H2' ) (resid 21  and  name H8  ) 4.00 1.35 1.50
assign (resid 21  and  name H2' ) (resid 22  and  name H6  ) 2.90 0.90 0.90
assign (resid 21  and  name H3' ) (resid 21  and  name H8  ) 4.00 1.35 1.50
assign (resid 21  and  name H3' ) (resid 22  and  name H6  ) 4.00 1.35 1.50
assign (resid 22  and  name H1' ) (resid 22  and  name H6  ) 4.00 1.35 1.50
assign (resid 22  and  name H1' ) (resid 23  and  name H8  ) 4.00 1.35 1.50
assign (resid 22  and  name H2' ) (resid 22  and  name H6  ) 4.00 1.35 1.50
assign (resid 22  and  name H2' ) (resid 23  and  name H8  ) 2.90 0.90 0.90
assign (resid 22  and  name H3' ) (resid 22  and  name H6  ) 4.00 1.35 1.50
assign (resid 22  and  name H3' ) (resid 23  and  name H8  ) 4.00 1.35 1.50
assign (resid 23  and  name H1' ) (resid 23  and  name H8  ) 4.00 1.35 1.50
assign (resid 23  and  name H1' ) (resid 24  and  name H8  ) 4.50 1.50 1.50
assign (resid 23  and  name H2' ) (resid 23  and  name H8  ) 2.90 0.90 0.90
assign (resid 23  and  name H2' ) (resid 24  and  name H8  ) 4.50 1.50 1.50
assign (resid 23  and  name H3' ) (resid 23  and  name H8  ) 4.00 1.35 1.50
assign (resid 23  and  name H3' ) (resid 24  and  name H8  ) 4.50 1.50 1.50
assign (resid 24  and  name H1' ) (resid 24  and  name H8  ) 4.50 1.50 1.50 
assign (resid 24  and  name H1' ) (resid 25  and  name H6  ) 4.50 1.50 1.50
assign (resid 24  and  name H2' ) (resid 24  and  name H8  ) 4.00 1.35 1.50
assign (resid 24  and  name H2' ) (resid 25  and  name H6  ) 2.90 0.90 0.90
assign (resid 24  and  name H3' ) (resid 24  and  name H8  ) 4.00 1.35 1.50
assign (resid 24  and  name H3' ) (resid 25  and  name H6  ) 4.00 1.35 1.50
assign (resid 25  and  name H1' ) (resid 25  and  name H6  ) 4.50 1.50 1.50
assign (resid 25  and  name H1' ) (resid 26  and  name H6  ) 4.50 1.50 1.50
assign (resid 25  and  name H2' ) (resid 25  and  name H6  ) 4.00 1.35 1.50
assign (resid 25  and  name H2' ) (resid 26  and  name H6  ) 2.90 0.90 0.90
assign (resid 25  and  name H3' ) (resid 25  and  name H6  ) 4.00 1.35 1.50
assign (resid 25  and  name H3' ) (resid 26  and  name H6  ) 4.00 1.35 1.50
assign (resid 26  and  name H1' ) (resid 26  and  name H6  ) 4.50 1.50 1.50
assign (resid 26  and  name H1' ) (resid 27  and  name H6  ) 4.50 1.50 1.50
assign (resid 26  and  name H2' ) (resid 26  and  name H6  ) 4.00 1.35 1.50
assign (resid 26  and  name H2' ) (resid 27  and  name H6  ) 2.90 0.90 0.90
assign (resid 26  and  name H3' ) (resid 26  and  name H6  ) 4.00 1.35 1.50
assign (resid 26  and  name H3' ) (resid 27  and  name H6  ) 4.00 1.35 1.50 
assign (resid 27  and  name H1' ) (resid 27  and  name H6  ) 4.50 1.50 1.50
assign (resid 27  and  name H1' ) (resid 28  and  name H8  ) 4.50 1.50 1.50
assign (resid 27  and  name H2' ) (resid 27  and  name H6  ) 4.00 1.35 1.50
assign (resid 27  and  name H2' ) (resid 28  and  name H8  ) 4.00 1.35 1.50
assign (resid 27  and  name H3' ) (resid 27  and  name H6  ) 4.00 1.35 1.50
assign (resid 27  and  name H3' ) (resid 28  and  name H8  ) 4.00 1.35 1.50
assign (resid 28  and  name H1' ) (resid 28  and  name H8  ) 4.50 1.50 1.50
assign (resid 28  and  name H1' ) (resid 29  and  name H8  ) 4.50 1.50 1.50
assign (resid 28  and  name H2' ) (resid 28  and  name H8  ) 4.50 1.50 1.50
assign (resid 28  and  name H2' ) (resid 29  and  name H8  ) 4.00 1.35 1.50
assign (resid 28  and  name H3' ) (resid 28  and  name H8  ) 4.00 1.35 1.50
assign (resid 28  and  name H3' ) (resid 29  and  name H8  ) 4.50 1.50 1.50
assign (resid 29  and  name H5' ) (resid 29  and  name H8  ) 4.50 1.50 1.50
assign (resid 30  and  name H1' ) (resid 30  and  name H6  ) 2.90 0.90 0.90
assign (resid 30  and  name H1' ) (resid 31  and  name H8  ) 4.50 1.50 1.50
assign (resid 30  and  name H2' ) (resid 30  and  name H6  ) 4.00 1.35 1.50
assign (resid 30  and  name H2' ) (resid 31  and  name H8  ) 4.50 1.50 1.50
assign (resid 30  and  name H3' ) (resid 30  and  name H6  ) 4.00 1.35 1.50
assign (resid 30  and  name H3' ) (resid 31  and  name H8  ) 4.00 1.35 1.50
assign (resid 31  and  name H1' ) (resid 31  and  name H8  ) 4.00 1.35 1.50
assign (resid 31  and  name H1' ) (resid 32  and  name H8  ) 4.00 1.35 1.50
assign (resid 31  and  name H2' ) (resid 31  and  name H8  ) 4.00 1.35 1.50
assign (resid 31  and  name H2' ) (resid 32  and  name H8  ) 2.90 0.90 0.90
assign (resid 31  and  name H3' ) (resid 31  and  name H8  ) 4.00 1.35 1.50
assign (resid 31  and  name H3' ) (resid 32  and  name H8  ) 4.00 1.35 1.50
assign (resid 31  and  name H4' ) (resid 31  and  name H8  ) 4.00 1.35 1.50
assign (resid 32  and  name H1' ) (resid 32  and  name H8  ) 4.00 1.35 1.50
assign (resid 32  and  name H1' ) (resid 33  and  name H6  ) 4.00 1.35 1.50
assign (resid 32  and  name H2' ) (resid 32  and  name H8  ) 4.00 1.35 1.50 
assign (resid 32  and  name H2' ) (resid 33  and  name H6  ) 2.90 0.90 0.90
assign (resid 32  and  name H3' ) (resid 32  and  name H8  ) 4.00 1.35 1.50
assign (resid 32  and  name H3' ) (resid 33  and  name H6  ) 4.00 1.35 1.50
assign (resid 33  and  name H1' ) (resid 33  and  name H6  ) 4.00 1.35 1.50 
assign (resid 33  and  name H1' ) (resid 34  and  name H6  ) 4.00 1.35 1.50
assign (resid 33  and  name H2' ) (resid 33  and  name H6  ) 4.00 1.35 1.50
assign (resid 33  and  name H2' ) (resid 34  and  name H6  ) 2.90 0.90 0.90
assign (resid 33  and  name H3' ) (resid 33  and  name H6  ) 4.00 1.35 1.50 
assign (resid 33  and  name H3' ) (resid 34  and  name H6  ) 4.00 1.35 1.50
assign (resid 33  and  name H4' ) (resid 33  and  name H6  ) 4.00 1.35 1.50
assign (resid 34  and  name H1' ) (resid 34  and  name H6  ) 4.00 1.35 1.50
assign (resid 34  and  name H1' ) (resid 35  and  name H6  ) 4.50 1.50 1.50
assign (resid 34  and  name H2' ) (resid 34  and  name H6  ) 4.00 1.35 1.50
assign (resid 34  and  name H2' ) (resid 35  and  name H6  ) 2.90 0.90 0.90
assign (resid 34  and  name H3' ) (resid 34  and  name H6  ) 4.00 1.35 1.50
assign (resid 34  and  name H3' ) (resid 35  and  name H6  ) 4.00 1.35 1.50
assign (resid 35  and  name H1' ) (resid 35  and  name H6  ) 4.00 1.35 1.50
assign (resid 35  and  name H2' ) (resid 35  and  name H6  ) 4.00 1.35 1.50
assign (resid 35  and  name H3' ) (resid 35  and  name H6  ) 4.00 1.35 1.50
assign (resid 3  and  name H1' ) (resid 4  and  name H5   ) 4.50 1.50 1.50
assign (resid 3  and  name H1' ) (resid 4  and  name H1'  ) 4.50 1.50 1.50
assign (resid 4  and  name H1' ) (resid 4  and  name H5   ) 4.50 1.50 1.50
assign (resid 4  and  name H5  ) (resid 5  and  name H5   ) 4.50 1.50 1.50
assign (resid 9  and  name H1' ) (resid 10  and  name H1'  ) 4.50 1.50 1.50
assign (resid 10  and  name H1' ) (resid 11  and  name H1'  ) 4.50 1.50 1.50
assign (resid 10  and  name H1' ) (resid 11  and  name H5   ) 4.50 1.50 1.50
assign (resid 11  and  name H1' ) (resid 12  and  name H5   ) 4.00 1.35 1.50
assign (resid 13  and  name H1' ) (resid 14  and  name H5   ) 4.50 1.50 1.50
assign (resid 14  and  name H1' ) (resid 14  and  name H5   ) 4.50 1.50 1.50
assign (resid 14  and  name H1' ) (resid 15  and  name H5   ) 4.50 1.50 1.50
assign (resid 15  and  name H1' ) (resid 16  and  name H1'  ) 4.50 1.50 1.50
assign (resid 17  and  name H1' ) (resid 18  and  name H1'  ) 4.50 1.50 1.50
assign (resid 21  and  name H1' ) (resid 22  and  name H1'  ) 4.50 1.50 1.50
assign (resid 21  and  name H1' ) (resid 22  and  name H5   ) 4.50 1.50 1.50
assign (resid 22  and  name H1' ) (resid 23  and  name H1'  ) 4.50 1.50 1.50
assign (resid 24  and  name H1' ) (resid 25  and  name H1'  ) 4.50 1.50 1.50
assign (resid 24  and  name H1' ) (resid 25  and  name H5   ) 4.50 1.50 1.50
assign (resid 25  and  name H1' ) (resid 25  and  name H5   ) 4.50 1.50 1.50
assign (resid 25  and  name H1' ) (resid 26  and  name H5   ) 4.50 1.50 1.50
assign (resid 25  and  name H5  ) (resid 26  and  name H5   ) 4.00 1.35 1.50
assign (resid 27  and  name H1' ) (resid 27  and  name H5   ) 4.50 1.50 1.50
assign (resid 32  and  name H1' ) (resid 33  and  name H1'  ) 4.50 1.50 1.50
assign (resid 32  and  name H1' ) (resid 33  and  name H5   ) 4.50 1.50 1.50
assign (resid 33  and  name H1' ) (resid 33  and  name H5   ) 4.50 1.50 1.50
assign (resid 33  and  name H5  ) (resid 34  and  name H5   ) 4.50 1.50 1.50
assign (resid 34  and  name H5  ) (resid 35  and  name H5   ) 4.00 1.35 1.50
assign (resid 35  and  name H1' ) (resid 35  and  name H5   ) 4.00 1.35 1.50
assign (resid 1  and  name H8  ) (resid 2  and  name H8   ) 4.50 1.50 1.50
assign (resid 2  and  name H8  ) (resid 3  and  name H8   ) 4.50 1.50 1.50
assign (resid 3  and  name H8  ) (resid 4  and  name H6   ) 4.50 1.50 1.50
assign (resid 4  and  name H6  ) (resid 5  and  name H6   ) 4.50 1.50 1.50
assign (resid 9  and  name H6  ) (resid 10  and  name H8   ) 4.50 1.50 1.50
assign (resid 10  and  name H8  ) (resid 11  and  name H6   ) 4.50 1.50 1.50
assign (resid 11  and  name H6  ) (resid 12  and  name H6   ) 4.50 1.50 1.50
assign (resid 13  and  name H8  ) (resid 14  and  name H6   ) 4.50 1.50 1.50
assign (resid 14  and  name H6  ) (resid 15  and  name H8   ) 4.50 1.50 1.50
assign (resid 15  and  name H8  ) (resid 16  and  name H8   ) 4.50 1.50 1.50
assign (resid 16  and  name H8  ) (resid 17  and  name H8   ) 4.50 1.50 1.50
assign (resid 17  and  name H8  ) (resid 18  and  name H8   ) 4.50 1.50 1.50
assign (resid 18  and  name H8  ) (resid 19  and  name H8   ) 4.50 1.50 1.50
assign (resid 20  and  name H6  ) (resid 21  and  name H8   ) 4.50 1.50 1.50
assign (resid 21  and  name H8  ) (resid 22  and  name H6   ) 4.50 1.50 1.50
assign (resid 22  and  name H6  ) (resid 23  and  name H8   ) 4.50 1.50 1.50
assign (resid 25  and  name H6  ) (resid 26  and  name H6   ) 4.50 1.50 1.50
assign (resid 27  and  name H6  ) (resid 28  and  name H8   ) 4.50 1.50 1.50
assign (resid 32  and  name H8  ) (resid 33  and  name H6   ) 4.50 1.50 1.50
assign (resid 33  and  name H6  ) (resid 34  and  name H6   ) 4.50 1.50 1.50
assign (resid 34  and  name H6  ) (resid 35  and  name H6   ) 4.50 1.50 1.50
assign (resid 23  and  name H2  ) (resid 24  and  name H8   ) 4.50 1.50 1.50
assign (resid 15  and  name H2  ) (resid 21  and  name H8   ) 4.50 1.50 1.50
assign (resid 1  and  name H2' ) (resid 2  and  name H1'  ) 4.00 1.35 1.50
assign (resid 2  and  name H2' ) (resid 3  and  name H1'  ) 4.50 1.50 1.50
assign (resid 3  and  name H2' ) (resid 4  and  name H1'  ) 4.00 1.35 1.50
assign (resid 4  and  name H2' ) (resid 5  and  name H1'  ) 4.00 1.35 1.50
assign (resid 5  and  name H2' ) (resid 6  and  name H1'  ) 4.00 1.35 1.50
assign (resid 6  and  name H2' ) (resid 7  and  name H1'  ) 4.00 1.35 1.50
assign (resid 8  and  name H2' ) (resid 9  and  name H1'  ) 4.50 1.50 1.50
assign (resid 10  and  name H2' ) (resid 11  and  name H1'  ) 4.00 1.35 1.50
assign (resid 11  and  name H2' ) (resid 12  and  name H1'  ) 4.00 1.50 1.50
assign (resid 12  and  name H2' ) (resid 13  and  name H1'  ) 4.50 1.50 1.50
assign (resid 13  and  name H2' ) (resid 14  and  name H1'  ) 4.00 1.35 1.50
assign (resid 14  and  name H2' ) (resid 15  and  name H1'  ) 4.50 1.50 1.50
assign (resid 15  and  name H2' ) (resid 16  and  name H1'  ) 4.00 1.35 1.50
assign (resid 16  and  name H2' ) (resid 17  and  name H1'  ) 4.00 1.35 1.50
assign (resid 17  and  name H2' ) (resid 18  and  name H1'  ) 4.00 1.35 1.50
assign (resid 18  and  name H2' ) (resid 19  and  name H1'  ) 4.00 1.35 1.50
assign (resid 19  and  name H2' ) (resid 20  and  name H1'  ) 4.00 1.35 1.50
assign (resid 20  and  name H2' ) (resid 21  and  name H1'  ) 4.00 1.35 1.50
assign (resid 21  and  name H2' ) (resid 22  and  name H1'  ) 4.00 1.35 1.50
assign (resid 22  and  name H2' ) (resid 23  and  name H1'  ) 4.00 1.35 1.50
assign (resid 23  and  name H2' ) (resid 24  and  name H1'  ) 4.50 1.50 1.50
assign (resid 24  and  name H2' ) (resid 25  and  name H1'  ) 4.00 1.35 1.50
assign (resid 25  and  name H2' ) (resid 26  and  name H1'  ) 4.50 1.50 1.50
assign (resid 26  and  name H2' ) (resid 27  and  name H1'  ) 4.50 1.50 1.50
assign (resid 28  and  name H2' ) (resid 29  and  name H1'  ) 4.50 1.50 1.50
assign (resid 30  and  name H2' ) (resid 31  and  name H1'  ) 4.50 1.50 1.50
assign (resid 31  and  name H2' ) (resid 32  and  name H1'  ) 4.00 1.35 1.50
assign (resid 32  and  name H2' ) (resid 33  and  name H1'  ) 4.00 1.35 1.50
assign (resid 33  and  name H2' ) (resid 34  and  name H1'  ) 4.00 1.35 1.50
assign (resid 34  and  name H2' ) (resid 35  and  name H1'  ) 4.50 1.50 1.50
assign (resid 3  and  name H2  ) (resid 4  and  name H1'  ) 4.00 1.35 1.50
assign (resid 3  and  name H2  ) (resid 34  and  name H1'  ) 4.00 1.35 1.50
assign (resid 3  and  name H2  ) (resid 3  and  name H1'  ) 4.50 1.50 1.50
assign (resid 10  and  name H2  ) (resid 11  and  name H1'  ) 4.00 1.35 1.50 
assign (resid 10  and  name H2  ) (resid 26  and  name H1'  ) 4.00 1.35 1.50
assign (resid 10  and  name H2  ) (resid 10  and  name H1'  ) 4.50 1.50 1.50
assign (resid 10  and  name H2  ) (resid 25  and  name H1'  ) 4.50 1.50 1.50
assign (resid 15  and  name H2  ) (resid 15  and  name H1'  ) 4.50 1.50 1.50
assign (resid 15  and  name H2  ) (resid 16  and  name H1'  ) 4.00 1.35 1.50
assign (resid 15  and  name H2  ) (resid 21  and  name H1'  ) 4.00 1.35 1.50
assign (resid 17  and  name H2  ) (resid 18  and  name H1'  ) 4.00 1.35 1.50
assign (resid 17  and  name H2  ) (resid 17  and  name H1'  ) 4.50 1.50 1.50
assign (resid 19  and  name H2  ) (resid 19  and  name H1'  ) 4.50 1.50 1.50
assign (resid 23  and  name H2  ) (resid 23  and  name H1'  ) 4.50 1.50 1.50
assign (resid 23  and  name H2  ) (resid 24  and  name H1'  ) 4.50 1.50 1.50
assign (resid 23  and  name H2  ) (resid 13  and  name H1'  ) 4.00 1.35 1.50
assign (resid 24  and  name H2  ) (resid 25  and  name H1'  ) 4.00 1.35 1.50
assign (resid 24  and  name H2  ) (resid 12  and  name H1'  ) 4.00 1.35 1.50
assign (resid 28  and  name H2  ) (resid 28  and  name H1'  ) 4.00 1.35 1.50
assign (resid 3  and  name H8 ) (resid 4  and  name H5  ) 4.50 1.50 1.50
assign (resid 4  and  name H6 ) (resid 5  and  name H5  ) 4.50 1.50 1.50
assign (resid 5  and  name H6 ) (resid 6  and  name H5  ) 4.50 1.50 1.50
assign (resid 8  and  name H6 ) (resid 9  and  name H5  ) 4.50 1.50 1.50
assign (resid 10  and  name H8 ) (resid 11  and  name H5  ) 4.50 1.50 1.50
assign (resid 11  and  name H6 ) (resid 12  and  name H5  ) 4.50 1.50 1.50
assign (resid 13  and  name H8 ) (resid 14  and  name H5  ) 4.50 1.50 1.50
assign (resid 19  and  name H8 ) (resid 20  and  name H5  ) 4.50 1.50 1.50
assign (resid 21  and  name H8 ) (resid 22  and  name H5  ) 4.00 1.35 1.50
assign (resid 24  and  name H8 ) (resid 25  and  name H5  ) 4.00 1.35 1.50
assign (resid 25  and  name H6 ) (resid 26  and  name H5  ) 4.50 1.50 1.50
assign (resid 32  and  name H8 ) (resid 33  and  name H5  ) 4.50 1.50 1.50
assign (resid 33  and  name H6 ) (resid 34  and  name H5  ) 4.50 1.50 1.50
assign (resid 34  and  name H6 ) (resid 35  and  name H5  ) 4.50 1.50 1.50
assign (resid 4  and  name H5  ) (resid 4  and  name H6  ) 2.90 0.90 0.90
assign (resid 5  and  name H5  ) (resid 5  and  name H6  ) 2.90 0.90 0.90
assign (resid 6  and  name H5  ) (resid 6  and  name H6  ) 2.90 0.90 0.90
assign (resid 8  and  name H5  ) (resid 8  and  name H6  ) 2.90 0.90 0.90
assign (resid 9  and  name H5  ) (resid 9  and  name H6  ) 2.90 0.90 0.90
assign (resid 11  and  name H5  ) (resid 11  and  name H6  ) 2.90 0.90 0.90
assign (resid 12  and  name H5  ) (resid 12  and  name H6  ) 2.90 0.90 0.90
assign (resid 14  and  name H5  ) (resid 14  and  name H6  ) 2.90 0.90 0.90
assign (resid 20  and  name H5  ) (resid 20  and  name H6  ) 2.90 0.90 0.90
assign (resid 22  and  name H5  ) (resid 22  and  name H6  ) 2.90 0.90 0.90
assign (resid 25  and  name H5  ) (resid 25  and  name H6  ) 2.90 0.90 0.90
assign (resid 26  and  name H5  ) (resid 26  and  name H6  ) 2.90 0.90 0.90
assign (resid 27  and  name H5  ) (resid 27  and  name H6  ) 2.90 0.90 0.90
assign (resid 30  and  name H5  ) (resid 30  and  name H6  ) 2.40 0.40 0.40
assign (resid 33  and  name H5  ) (resid 33  and  name H6  ) 2.90 0.90 0.90
assign (resid 34  and  name H5  ) (resid 34  and  name H6  ) 2.90 0.90 0.90
assign (resid 35  and  name H5  ) (resid 35  and  name H6  ) 2.90 0.90 0.90
assign (resid 33  and  name H5  ) (resid 32  and  name H2'  ) 4.00 1.35 1.50
assign (resid 33  and  name H5  ) (resid 32  and  name H3'  ) 4.00 1.35 1.50
assign (resid 18  and  name H1' ) (resid 18  and  name H2'  ) 2.90 0.90 0.90
assign (resid 18  and  name H1' ) (resid 18  and  name H3'  ) 4.00 1.35 1.50
assign (resid 18  and  name H1' ) (resid 18  and  name H4'  ) 4.00 1.35 1.50
assign (resid 18  and  name H1' ) (resid 17  and  name H5'  ) 4.00 1.35 1.50
assign (resid 25  and  name H5  ) (resid 24  and  name H2'  ) 4.00 1.35 1.50
assign (resid 25  and  name H5  ) (resid 24  and  name H2'  ) 4.00 1.35 1.50
assign (resid 14  and  name H5  ) (resid 13  and  name H2'  ) 4.00 1.35 1.50
assign (resid 14  and  name H5  ) (resid 13  and  name H3'  ) 4.00 1.35 1.50
assign (resid 26  and  name H1' ) (resid 26  and  name H2'  ) 2.90 0.90 0.90
assign (resid 26  and  name H1' ) (resid 26  and  name H3'  ) 4.00 1.35 1.50
assign (resid 22  and  name H5  ) (resid 21  and  name H2'  ) 4.00 1.35 1.50
assign (resid 22  and  name H5  ) (resid 21  and  name H3'  ) 4.00 1.35 1.50
assign (resid 27  and  name H1' ) (resid 27  and  name H2'  ) 2.90 0.90 0.90
assign (resid 27  and  name H1' ) (resid 27  and  name H3'  ) 4.50 1.50 1.50
assign (resid 27  and  name H1' ) (resid 27  and  name H4'  ) 4.00 1.35 1.50
assign (resid 25  and  name H1' ) (resid 25  and  name H2'  ) 2.90 0.90 0.90
assign (resid 25  and  name H1' ) (resid 25  and  name H3'  ) 4.00 1.35 1.50
assign (resid 25  and  name H1' ) (resid 25  and  name H5'' ) 4.50 1.50 1.50
assign (resid 22  and  name H1' ) (resid 22  and  name H2'  ) 2.90 0.90 0.90
assign (resid 22  and  name H1' ) (resid 22  and  name H3'  ) 4.00 1.35 1.50
assign (resid 4  and  name H1' ) (resid 4  and  name H2'  ) 2.90 0.90 0.90
assign (resid 4  and  name H1' ) (resid 4  and  name H3'  ) 4.00 1.35 1.50
assign (resid 14  and  name H1' ) (resid 14  and  name H2'  ) 2.90 0.90 0.90
assign (resid 14  and  name H1' ) (resid 14  and  name H3'  ) 4.00 1.35 1.50
assign (resid 11  and  name H1' ) (resid 11  and  name H2'  ) 2.90 0.90 0.90
assign (resid 11  and  name H1' ) (resid 11  and  name H3'  ) 4.00 1.35 1.50
assign (resid 5  and  name H5  ) (resid 4  and  name H3'  ) 4.00 1.35 1.50
assign (resid 5  and  name H5  ) (resid 4  and  name H2'  ) 4.00 1.35 1.50
assign (resid 5  and  name H1' ) (resid 5  and  name H2'  ) 2.90 0.90 0.90
assign (resid 5  and  name H1' ) (resid 5  and  name H3'  ) 4.00 1.35 1.50
assign (resid 11  and  name H5  ) (resid 10  and  name H2'  ) 4.00 1.35 1.50
assign (resid 11  and  name H5  ) (resid 10  and  name H3'  ) 4.00 1.35 1.50
assign (resid 6  and  name H5  ) (resid 5  and  name H2'  ) 4.00 1.35 1.50
assign (resid 16  and  name H1' ) (resid 16  and  name H2'  ) 2.90 0.90 0.90
assign (resid 16  and  name H1' ) (resid 16  and  name H3'  ) 4.00 1.35 1.50
assign (resid 16  and  name H1' ) (resid 16  and  name H4'  ) 4.00 1.35 1.50
assign (resid 27  and  name H5  ) (resid 26  and  name H2'  ) 4.00 1.35 1.50
assign (resid 27  and  name H5  ) (resid 26  and  name H3'  ) 4.00 1.35 1.50
assign (resid 35  and  name H5  ) (resid 34  and  name H2'  ) 4.00 1.35 1.50
assign (resid 35  and  name H5  ) (resid 34  and  name H3'  ) 4.00 1.35 1.50
assign (resid 6  and  name H1' ) (resid 6  and  name H2'  ) 2.90 0.90 0.90
assign (resid 6  and  name H1' ) (resid 6  and  name H3'  ) 4.00 1.35 1.50
assign (resid 6  and  name H1' ) (resid 6  and  name H4'  ) 4.00 1.35 1.50
assign (resid 12  and  name H5  ) (resid 11  and  name H2'  ) 4.00 1.35 1.50
assign (resid 12  and  name H5  ) (resid 11  and  name H3'  ) 4.00 1.35 1.50
assign (resid 12  and  name H5  ) (resid 12  and  name H3'  ) 4.50 1.50 1.50
assign (resid 33  and  name H1' ) (resid 33  and  name H2'  ) 2.90 0.90 0.90
assign (resid 33  and  name H1' ) (resid 33  and  name H3'  ) 4.00 1.35 1.50
assign (resid 33  and  name H1' ) (resid 33  and  name H4'  ) 4.00 1.35 1.50
assign (resid 9  and  name H1' ) (resid 9  and  name H2'  ) 4.00 1.35 1.50
assign (resid 9  and  name H1' ) (resid 9  and  name H3'  ) 4.00 1.35 1.50
assign (resid 34  and  name H1' ) (resid 34  and  name H2'  ) 2.90 0.90 0.90
assign (resid 34  and  name H1' ) (resid 34  and  name H3'  ) 4.00 1.35 1.50
assign (resid 26  and  name H5  ) (resid 25  and  name H2'  ) 4.00 1.50 1.50
assign (resid 26  and  name H5  ) (resid 25  and  name H3'  ) 4.00 1.35 1.50
assign (resid 26  and  name H5  ) (resid 26  and  name H3'  ) 4.50 1.50 1.50
assign (resid 7  and  name H1' ) (resid 7  and  name H2'  ) 2.90 0.90 0.90
assign (resid 7  and  name H1' ) (resid 7  and  name H3'  ) 4.00 1.35 1.50
assign (resid 34  and  name H5  ) (resid 33  and  name H2'  ) 4.00 1.35 1.50
assign (resid 34  and  name H5  ) (resid 33  and  name H5'  ) 4.50 1.50 1.50
assign (resid 34  and  name H5  ) (resid 33  and  name H3'  ) 4.00 1.35 1.50
assign (resid 12  and  name H1' ) (resid 12  and  name H2'  ) 2.90 0.90 0.90
assign (resid 12  and  name H1' ) (resid 12  and  name H3'  ) 4.00 1.35 1.50
assign (resid 17  and  name H1' ) (resid 17  and  name H2'  ) 2.90 0.90 0.90
assign (resid 17  and  name H1' ) (resid 17  and  name H3'  ) 4.00 1.35 1.50
assign (resid 17  and  name H1' ) (resid 17  and  name H4'  ) 4.00 1.35 1.50
assign (resid 31  and  name H1' ) (resid 31  and  name H2'  ) 2.90 0.90 0.90
assign (resid 31  and  name H1' ) (resid 31  and  name H3'  ) 4.00 1.35 1.50
assign (resid 35  and  name H1' ) (resid 35  and  name H2'  ) 2.90 0.90 0.90
assign (resid 35  and  name H1' ) (resid 35  and  name H3'  ) 4.00 1.35 1.50
assign (resid 13  and  name H1' ) (resid 13  and  name H2'  ) 2.90 0.90 0.90
assign (resid 13  and  name H1' ) (resid 13  and  name H4'  ) 4.00 1.35 1.50
assign (resid 13  and  name H1' ) (resid 13  and  name H3'  ) 4.00 1.35 1.50
assign (resid 29  and  name H1' ) (resid 29  and  name H2'  ) 4.00 1.35 1.50
assign (resid 29  and  name H1' ) (resid 29  and  name H3'  ) 4.00 1.35 1.50
assign (resid 29  and  name H1' ) (resid 29  and  name H4'  ) 4.00 1.35 1.50
assign (resid 9  and  name H5  ) (resid 8  and  name H2'  ) 4.50 1.50 1.50
assign (resid 1  and  name H1' ) (resid 1  and  name H2'  ) 2.90 0.90 0.90
assign (resid 1  and  name H1' ) (resid 1  and  name H3'  ) 4.50 1.50 1.50
assign (resid 1  and  name H1' ) (resid 1  and  name H4'  ) 4.00 1.35 1.50
assign (resid 21  and  name H1' ) (resid 21  and  name H2'  ) 2.90 0.90 0.90
assign (resid 21  and  name H1' ) (resid 21  and  name H3'  ) 4.00 1.35 1.50
assign (resid 21  and  name H1' ) (resid 21  and  name H5'  ) 4.50 1.50 1.50
assign (resid 32  and  name H1' ) (resid 32  and  name H2'  ) 2.90 0.90 0.90
assign (resid 32  and  name H1' ) (resid 32  and  name H3'  ) 4.00 1.35 1.50
assign (resid 28  and  name H1' ) (resid 28  and  name H3'  ) 2.90 0.90 0.90
assign (resid 28  and  name H1' ) (resid 28  and  name H2'  ) 4.00 1.35 1.50
assign (resid 2  and  name H1' ) (resid 2  and  name H2'  ) 2.90 0.90 0.90
assign (resid 2  and  name H1' ) (resid 2  and  name H3'  ) 4.00 1.35 1.50
assign (resid 2  and  name H1' ) (resid 2  and  name H4'  ) 4.00 1.35 1.50
assign (resid 2  and  name H1' ) (resid 2  and  name H5'  ) 4.50 1.50 1.50
assign (resid 8  and  name H1' ) (resid 8  and  name H2'  ) 2.90 0.90 0.90
assign (resid 8  and  name H1' ) (resid 8  and  name H3'  ) 4.00 1.35 1.50
assign (resid 23  and  name H1' ) (resid 23  and  name H2'  ) 2.90 0.90 0.90
assign (resid 23  and  name H1' ) (resid 23  and  name H3'  ) 4.00 1.35 1.50
assign (resid 20  and  name H5  ) (resid 20  and  name H4'  ) 4.50 1.50 1.50
assign (resid 20  and  name H5  ) (resid 20  and  name H5'  ) 4.50 1.50 1.50
assign (resid 24  and  name H1' ) (resid 24  and  name H2'  ) 2.90 0.90 0.90
assign (resid 24  and  name H1' ) (resid 24  and  name H3'  ) 4.00 1.35 1.50
assign (resid 24  and  name H1' ) (resid 24  and  name H4'  ) 4.00 1.35 1.50
assign (resid 15  and  name H1' ) (resid 15  and  name H2'  ) 2.90 0.90 0.90
assign (resid 15  and  name H1' ) (resid 15  and  name H3'  ) 4.00 1.35 1.50
assign (resid 15  and  name H1' ) (resid 15  and  name H4'  ) 4.00 1.35 1.50
assign (resid 3  and  name H1' ) (resid 3  and  name H2'  ) 2.90 0.90 0.90
assign (resid 3  and  name H1' ) (resid 3  and  name H3'  ) 4.00 1.35 1.50
assign (resid 10  and  name H1' ) (resid 10  and  name H2'  ) 2.90 0.90 0.90
assign (resid 10  and  name H1' ) (resid 10  and  name H3'  ) 4.00 1.35 1.50
assign (resid 30  and  name H1' ) (resid 30  and  name H2'  ) 2.90 0.90 0.90
assign (resid 30  and  name H1' ) (resid 30  and  name H3'  ) 4.00 1.35 1.50
assign (resid 19  and  name H1' ) (resid 19  and  name H2'  ) 2.90 0.90 0.90
assign (resid 19  and  name H1' ) (resid 19  and  name H3'  ) 4.00 1.35 1.50
assign (resid 2  and  name H1  ) (resid 33  and  name H3   ) 3.50 1.50 1.50
assign (resid 33  and  name H3  ) (resid 32  and  name H1   ) 3.50 1.50 1.50
assign (resid 32  and  name H1  ) (resid 31  and  name H1   ) 3.50 1.50 1.50
assign (resid 12  and  name H3  ) (resid 13  and  name H1   ) 3.50 1.50 1.50
assign (resid 13  and  name H1  ) (resid 21  and  name H1   ) 3.50 1.50 1.50
assign (resid 21  and  name H1  ) (resid 20  and  name H3   ) 3.50 1.50 1.50
assign (resid 20  and  name H3  ) (resid 16  and  name H1   ) 3.50 1.50 1.50
assign (resid 34  and  name H42  ) (resid 2  and  name H1   ) 2.90 0.90 0.90
assign (resid 34  and  name H41  ) (resid 2  and  name H1   ) 3.50 1.50 1.50
assign (resid 3  and  name H62  ) (resid 33  and  name H3  ) 3.50 1.50 1.50
assign (resid 3  and  name H62  ) (resid 33  and  name H3  ) 3.50 1.50 1.50
assign (resid 4  and  name H42  ) (resid 32  and  name H1  ) 2.90 0.90 0.90
assign (resid 4  and  name H41  ) (resid 32  and  name H1  ) 3.50 1.50 1.50
assign (resid 3  and  name H62  ) (resid 32  and  name H1  ) 3.50 1.50 1.50
assign (resid 5  and  name H42  ) (resid 31  and  name H1  ) 2.90 0.90 0.90
assign (resid 5  and  name H41  ) (resid 31  and  name H1  ) 3.50 1.50 1.50
assign (resid 23  and  name H62  ) (resid 12  and  name H3  ) 3.50 1.50 1.50
assign (resid 22  and  name H42  ) (resid 13  and  name H1  ) 2.90 0.90 0.90
assign (resid 22  and  name H41  ) (resid 13  and  name H1  ) 3.50 1.50 1.50
assign (resid 14  and  name H42  ) (resid 21  and  name H1  ) 2.90 0.90 0.90
assign (resid 14  and  name H41  ) (resid 21  and  name H1  ) 3.50 1.50 1.50
assign (resid 15  and  name H62  ) (resid 20  and  name H3  ) 3.50 1.50 1.50
assign (resid 15  and  name H62  ) (resid 20  and  name H3  ) 3.50 1.50 1.50
assign (resid 3  and  name H2  ) (resid 33  and  name H3  ) 2.90 0.90 0.90
assign (resid 3  and  name H2  ) (resid 2  and  name H1  ) 3.50 1.50 1.50
assign (resid 3  and  name H2  ) (resid 32  and  name H1  ) 3.50 1.50 1.50
assign (resid 15  and  name H2  ) (resid 20  and  name H3  ) 2.90 0.90 0.90
assign (resid 15  and  name H2  ) (resid 21  and  name H1  ) 3.50 1.50 1.50
assign (resid 23  and  name H2  ) (resid 12  and  name H3  ) 3.50 1.50 1.50
assign (resid 23  and  name H2  ) (resid 13  and  name H1  ) 3.50 1.50 1.50
assign (resid 24  and  name H61 ) (resid 11  and  name N3  ) 4.00 2.00 2.00
assign (resid 24  and  name N1 ) (resid 11  and  name O2  ) 4.00 1.35 1.50
assign (resid 1  and  name H1 ) (resid 35  and  name N3  ) 1.95 0.1 0.1 
assign (resid 1  and  name O6  ) (resid 35  and  name H42 ) 1.91 0.1 0.1
assign (resid 1  and  name H22 ) (resid 35  and  name O2 ) 1.86 0.1 0.1
assign (resid 2  and  name H1 ) (resid 34  and  name N3 ) 1.95 0.1 0.1 
assign (resid 2  and  name O6  ) (resid 34  and  name H42 ) 1.91 0.1 0.1
assign (resid 2  and  name H22 ) (resid 34  and  name O2 ) 1.86 0.1 0.1 
assign (resid 3  and  name N1 ) (resid 33  and  name H3 ) 1.82 0.1 0.1
assign (resid 3  and  name H62 ) (resid 33  and  name O4 ) 1.95 0.1 0.1
assign (resid 32  and  name H1 ) (resid 4  and  name N3 ) 1.95 0.1 0.1 
assign (resid 32  and  name O6  ) (resid 4  and  name H42 ) 1.91 0.1 0.1
assign (resid 32  and  name H22 ) (resid 4  and  name O2 ) 1.86 0.1 0.1 
assign (resid 31  and  name H1 ) (resid 5  and  name N3 ) 1.95 0.1 0.1 
assign (resid 31  and  name O6  ) (resid 5  and  name H42 ) 1.91 0.1 0.1
assign (resid 31  and  name H22 ) (resid 5  and  name O2 ) 1.86 0.1 0.1
assign (resid 23  and  name N1 ) (resid 12  and  name H3 ) 1.82 0.1 0.1
assign (resid 23  and  name H62 ) (resid 12  and  name O4 ) 1.95 0.1 0.1
assign (resid 13  and  name H1 ) (resid 22  and  name N3 ) 1.95 0.1 0.1 
assign (resid 13  and  name O6  ) (resid 22  and  name H42 ) 1.91 0.1 0.1
assign (resid 13  and  name H22 ) (resid 22  and  name O2 ) 1.86 0.1 0.1
assign (resid 21  and  name H1 ) (resid 14  and  name N3 ) 1.95 0.1 0.1 
assign (resid 21  and  name O6  ) (resid 14  and  name H42 ) 1.91 0.1 0.1
assign (resid 21  and  name H22 ) (resid 14  and  name O2 ) 1.86 0.1 0.1
assign (resid 21  and  name N1 ) (resid 14  and  name N3 ) 2.95 0.1 0.1 
assign (resid 21  and  name O6  ) (resid 14  and  name N4  ) 2.91 0.1 0.1
assign (resid 21  and  name N2  ) (resid 14  and  name O2 ) 2.86 0.1 0.1 
assign (resid 15  and  name N1 ) (resid 20  and  name H3 ) 1.82 0.1 0.1
assign (resid 15  and  name H62 ) (resid 20  and  name O4 ) 1.95 0.1 0.1
assign (resid 16  and  name N3  ) (resid 19  and  name H61 ) 2.1 0.1 0.1
assign (resid 16  and  name N3  ) (resid 19  and  name N6 ) 3.10 0.1 0.1
assign (resid 16  and  name H21 ) (resid 19  and  name N7 ) 2.10 0.1 0.1
assign (resid 25  and  name H6 ) (resid 24  and  name H4' ) 5.50 0.75 100.00
assign (resid 25  and  name H6 ) (resid 24  and  name H5'' ) 5.50 0.75 100.00
assign (resid 26  and  name H6 ) (resid 25  and  name H4' ) 5.50 0.75 100.00
assign (resid 26  and  name H6 ) (resid 25  and  name H5'' ) 5.50 0.75 100.00
assign (resid 27  and  name H6 ) (resid 26  and  name H4' ) 5.50 0.75 100.00
assign (resid 27  and  name H6 ) (resid 26  and  name H5'' ) 5.50 0.75 100.00
assign (resid 28  and  name H8 ) (resid 27  and  name H4') 5.50 0.75 100.00
assign (resid 28  and  name H8 ) (resid 27  and  name H5' ) 5.50 0.75 100.00
assign (resid 28  and  name H8 ) (resid 27  and  name H5'' ) 5.50 0.75 100.00
assign (resid 29  and  name H8 ) (resid 28  and  name H4' ) 5.50 0.75 100.00
assign (resid 29  and  name H8 ) (resid 28  and  name H5'' ) 5.50 0.75 100.00
assign (resid 30  and  name H6 ) (resid 29  and  name H1' ) 5.50 0.75 100.00
assign (resid 30  and  name H6 ) (resid 29  and  name H2' ) 5.50 0.75 100.00
assign (resid 30  and  name H6 ) (resid 29  and  name H3' ) 5.50 0.75 100.00
assign (resid 30  and  name H6 ) (resid 29  and  name H4' ) 5.50 0.75 100.00
assign (resid 30  and  name H6 ) (resid 29  and  name H5' ) 5.50 0.75 100.00
assign (resid 30  and  name H6 ) (resid 29  and  name H5'' ) 5.50 0.75 100.00
assign (resid 6  and  name H6 ) (resid 5  and  name H4') 5.50 0.75 100.00
assign (resid 6  and  name H6 ) (resid 11  and  name H5'') 5.50 0.75 100.00
assign (resid 6  and  name H6 ) (resid 7  and  name H5') 5.50 0.75 100.00
assign (resid 6  and  name H6 ) (resid 7  and  name H5'') 5.50 0.75 100.00
assign (resid 7  and  name H8 ) (resid 6  and  name H4') 5.50 0.75 100.00
assign (resid 7  and  name H8 ) (resid 6  and  name H5'') 5.50 0.75 100.00
assign (resid 7  and  name H8 ) (resid 8  and  name H5'') 5.50 0.75 100.00
assign (resid 8  and  name H6 ) (resid 7  and  name H4') 5.50 0.75 100.00
assign (resid 9  and  name H6 ) (resid 8  and  name H4') 5.50 0.75 100.00
assign (resid 9  and  name H6 ) (resid 10  and  name H5'') 5.50 0.75 100.00
assign (resid 10  and  name H6 ) (resid 9  and  name H4' ) 5.50 0.75 100.00
assign (resid 24  and  name H3' ) (resid 25  and  name H3' ) 5.50 0.75 100.00
assign (resid 24  and  name H3' ) (resid 25  and  name H4' ) 5.50 0.75 100.00
assign (resid 28  and  name H1' ) (resid 27  and  name H5'') 5.50 0.75 100.00
assign (resid 28  and  name H1' ) (resid 27  and  name H4') 5.50 0.75 100.00
assign (resid 28  and  name H3' ) (resid 29  and  name H4' ) 5.50 0.75 100.00
assign (resid 28  and  name H3' ) (resid 29  and  name H5'') 5.50 0.75 100.00
assign (resid 30  and  name H1' ) (resid 31  and  name H5'') 5.50 0.75 100.00
assign (resid 6  and  name H1' ) (resid 7  and  name H5'' ) 5.50 0.75 100.00
assign (resid 6  and  name H3' ) (resid 7  and  name H4' ) 5.50 0.75 100.00
assign (resid 6  and  name H3' ) (resid 7  and  name H5'' ) 5.50 0.75 100.00
assign (resid 7  and  name H3' ) (resid 8  and  name H4' ) 5.50 0.75 100.00
assign (resid 7  and  name H3' ) (resid 8  and  name H5'') 5.50 0.75 100.00
assign (resid 8  and  name H3' ) (resid 9  and  name H5'') 5.50 0.75 100.00
assign (resid 9  and  name H3' ) (resid 10  and  name H4' ) 5.50 0.75 100.00
assign (resid 9  and  name H3' ) (resid 10  and  name H5'') 5.50 0.75 100.00


Dihedral restraints

assign (resid 1  and  name O3') (resid 2  and  name P  )
       (resid 2  and  name O5') (resid 2  and  name C5')  1 295 30 2
assign (resid 2  and  name O3') (resid 3  and  name P  )
       (resid 3  and  name O5') (resid 3  and  name C5')  1 295 30 2
assign (resid 3  and  name O3') (resid 4  and  name P  )
       (resid 4  and  name O5') (resid 4  and  name C5')  1 295 30 2
assign (resid 4  and  name O3') (resid 5  and  name P  )
       (resid 5  and  name O5') (resid 5  and  name C5')  1 295 30 2
assign (resid 5  and  name O3') (resid 6  and  name P  )
       (resid 6  and  name O5') (resid 6  and  name C5')  1 295 30 2
assign (resid 6  and  name O3') (resid 7  and  name P  )
       (resid 7  and  name O5') (resid 7  and  name C5')  1 295 30 2
assign (resid 7  and  name O3') (resid 8  and  name P  )
       (resid 8  and  name O5') (resid 8  and  name C5')  1 295 30 2
assign (resid 8  and  name O3') (resid 9  and  name P  )
       (resid 9  and  name O5') (resid 9  and  name C5')  1 295 30 2
assign (resid 9  and  name O3') (resid 10  and  name P  )
       (resid 10  and  name O5') (resid 10  and  name C5')  1 295 30 2
assign (resid 10  and  name O3') (resid 11  and  name P  )
       (resid 11  and  name O5') (resid 11  and  name C5')  1 295 30 2
assign (resid 11  and  name O3') (resid 12  and  name P  )
       (resid 12  and  name O5') (resid 12  and  name C5')  1 295 30 2
assign (resid 12  and  name O3') (resid 13  and  name P  )
       (resid 13  and  name O5') (resid 13  and  name C5')  1 295 30 2
assign (resid 13  and  name O3') (resid 14  and  name P  )
       (resid 14  and  name O5') (resid 14  and  name C5')  1 295 30 2
assign (resid 14  and  name O3') (resid 15  and  name P  )
       (resid 15  and  name O5') (resid 15  and  name C5')  1 295 30 2
assign (resid 15  and  name O3') (resid 16  and  name P  )
       (resid 16  and  name O5') (resid 16  and  name C5')  1 295 30 2
assign (resid 18  and  name O3') (resid 19  and  name P  )
       (resid 19  and  name O5') (resid 19  and  name C5')  1 295 30 2
assign (resid 20  and  name O3') (resid 21  and  name P  )
       (resid 21  and  name O5') (resid 21  and  name C5')  1 295 30 2
assign (resid 21  and  name O3') (resid 22  and  name P  )
       (resid 22  and  name O5') (resid 22  and  name C5')  1 295 30 2
assign (resid 22  and  name O3') (resid 23  and  name P  )
       (resid 23  and  name O5') (resid 23  and  name C5')  1 295 30 2
assign (resid 23  and  name O3') (resid 24  and  name P  )
       (resid 24  and  name O5') (resid 24  and  name C5')  1 295 30 2
assign (resid 24  and  name O3') (resid 25  and  name P  )
       (resid 25  and  name O5') (resid 25  and  name C5')  1 295 30 2
assign (resid 25  and  name O3') (resid 26  and  name P  )
       (resid 26  and  name O5') (resid 26  and  name C5')  1 295 30 2
assign (resid 26  and  name O3') (resid 27  and  name P  )
       (resid 27  and  name O5') (resid 27  and  name C5')  1 295 30 2
assign (resid 27  and  name O3') (resid 28  and  name P  )
       (resid 28  and  name O5') (resid 28  and  name C5')  1 295 30 2
assign (resid 28  and  name O3') (resid 29  and  name P  )
       (resid 29  and  name O5') (resid 29  and  name C5')  1 295 30 2
assign (resid 29  and  name O3') (resid 30  and  name P  )
       (resid 30  and  name O5') (resid 30  and  name C5')  1 295 30 2
assign (resid 30  and  name O3') (resid 31  and  name P  )
       (resid 31  and  name O5') (resid 31  and  name C5')  1 295 30 2
assign (resid 31  and  name O3') (resid 32  and  name P  )
       (resid 32  and  name O5') (resid 32  and  name C5')  1 295 30 2
assign (resid 32  and  name O3') (resid 33  and  name P  )
       (resid 33  and  name O5') (resid 33  and  name C5')  1 295 30 2
assign (resid 33  and  name O3') (resid 34  and  name P  )
       (resid 34  and  name O5') (resid 34  and  name C5')  1 295 30 2
assign (resid 34  and  name O3') (resid 35  and  name P  )
       (resid 35  and  name O5') (resid 35  and  name C5')  1 295 30 2
assign (resid 2  and  name P  ) (resid 2  and  name O5')
       (resid 2  and  name C5') (resid 2  and  name C4')  1 185 60 2
assign (resid 3  and  name P  ) (resid 3  and  name O5')
       (resid 3  and  name C5') (resid 3  and  name C4')  1 185 60 2
assign (resid 4  and  name P  ) (resid 4  and  name O5')
       (resid 4  and  name C5') (resid 4  and  name C4')  1 185 60 2
assign (resid 5  and  name P  ) (resid 5  and  name O5')
       (resid 5  and  name C5') (resid 5  and  name C4')  1 185 60 2
assign (resid 12  and  name P  ) (resid 12  and  name O5')
       (resid 12  and  name C5') (resid 12  and  name C4')  1 185 60 2
assign (resid 13  and  name P  ) (resid 13  and  name O5')
       (resid 13  and  name C5') (resid 13  and  name C4')  1 185 60 2
assign (resid 14  and  name P  ) (resid 14  and  name O5')
       (resid 14  and  name C5') (resid 14  and  name C4')  1 185 60 2
assign (resid 15  and  name P  ) (resid 15  and  name O5')
       (resid 15  and  name C5') (resid 15  and  name C4')  1 185 60 2
assign (resid 20  and  name P  ) (resid 20  and  name O5')
       (resid 20  and  name C5') (resid 20  and  name C4')  1 185 60 2
assign (resid 21  and  name P  ) (resid 21  and  name O5')
       (resid 21  and  name C5') (resid 21  and  name C4')  1 185 60 2
assign (resid 22  and  name P  ) (resid 22  and  name O5')
       (resid 22  and  name C5') (resid 22  and  name C4')  1 185 60 2
assign (resid 23  and  name P  ) (resid 23  and  name O5')
       (resid 23  and  name C5') (resid 23  and  name C4')  1 185 60 2
assign (resid 31  and  name P  ) (resid 31  and  name O5')
       (resid 31  and  name C5') (resid 31  and  name C4')  1 185 60 2
assign (resid 32  and  name P  ) (resid 32  and  name O5')
       (resid 32  and  name C5') (resid 32  and  name C4')  1 185 60 2
assign (resid 33  and  name P  ) (resid 33  and  name O5')
       (resid 33  and  name C5') (resid 33  and  name C4')  1 185 60 2
assign (resid 34  and  name P  ) (resid 34  and  name O5')
       (resid 34  and  name C5') (resid 34  and  name C4')  1 185 60 2
assign (resid 35  and  name P  ) (resid 35  and  name O5')
       (resid 35  and  name C5') (resid 35  and  name C4')  1 185 60 2
assign (resid 1  and  name O5') (resid 1  and  name C5')
       (resid 1  and  name C4') (resid 1  and  name C3')  1 45 60 2
assign (resid 2  and  name O5') (resid 2  and  name C5')
       (resid 2  and  name C4') (resid 2  and  name C3')  1 45 60 2
assign (resid 3  and  name O5') (resid 3  and  name C5')
       (resid 3  and  name C4') (resid 3  and  name C3')  1 45 60 2
assign (resid 4  and  name O5') (resid 4  and  name C5')
       (resid 4  and  name C4') (resid 4  and  name C3')  1 45 60 2
assign (resid 5  and  name O5') (resid 5  and  name C5')
       (resid 5  and  name C4') (resid 5  and  name C3')  1 45 60 2
assign (resid 12  and  name O5') (resid 12  and  name C5')
       (resid 12  and  name C4') (resid 12  and  name C3')  1 45 60 2
assign (resid 13  and  name O5') (resid 13  and  name C5')
       (resid 13  and  name C4') (resid 13  and  name C3')  1 45 60 2
assign (resid 14  and  name O5') (resid 14  and  name C5')
       (resid 14  and  name C4') (resid 14  and  name C3')  1 45 60 2
assign (resid 15  and  name O5') (resid 15  and  name C5')
       (resid 15  and  name C4') (resid 15  and  name C3')  1 45 60 2
assign (resid 20  and  name O5') (resid 20  and  name C5')
       (resid 20  and  name C4') (resid 20  and  name C3')  1 45 60 2
assign (resid 21  and  name O5') (resid 21  and  name C5')
       (resid 21  and  name C4') (resid 21  and  name C3')  1 45 60 2
assign (resid 22  and  name O5') (resid 22  and  name C5')
       (resid 22  and  name C4') (resid 22  and  name C3')  1 45 60 2
assign (resid 23  and  name O5') (resid 23  and  name C5')
       (resid 23  and  name C4') (resid 23  and  name C3')  1 45 60 2
assign (resid 31  and  name O5') (resid 31  and  name C5')
       (resid 31  and  name C4') (resid 31  and  name C3')  1 45 60 2
assign (resid 32  and  name O5') (resid 32  and  name C5')
       (resid 32  and  name C4') (resid 32  and  name C3')  1 45 60 2
assign (resid 33  and  name O5') (resid 33  and  name C5')
       (resid 33  and  name C4') (resid 33  and  name C3')  1 45 60 2
assign (resid 34  and  name O5') (resid 34  and  name C5')
       (resid 34  and  name C4') (resid 34  and  name C3')  1 45 60 2
assign (resid 35  and  name O5') (resid 35  and  name C5')
       (resid 35  and  name C4') (resid 35  and  name C3')  1 45 60 2
assign (resid 1  and  name C4') (resid 1  and  name C3')
       (resid 1  and  name O3') (resid 2  and  name P  )    1 195 30 2
assign (resid 2  and  name C4') (resid 2  and  name C3')
       (resid 2  and  name O3') (resid 3  and  name P  )    1 195 30 2
assign (resid 3  and  name C4') (resid 3  and  name C3')
       (resid 3  and  name O3') (resid 4  and  name P  )    1 195 30 2
assign (resid 4  and  name C4') (resid 4  and  name C3')
       (resid 4  and  name O3') (resid 5  and  name P  )    1 195 30 2
assign (resid 5  and  name C4') (resid 5  and  name C3')
       (resid 5  and  name O3') (resid 6  and  name P  )    1 195 30 2
assign (resid 6  and  name C4') (resid 6  and  name C3')
       (resid 6  and  name O3') (resid 7  and  name P  )    1 195 30 2
assign (resid 7  and  name C4') (resid 7  and  name C3')
       (resid 7  and  name O3') (resid 8  and  name P  )    1 195 30 2
assign (resid 8  and  name C4') (resid 8  and  name C3')
       (resid 8  and  name O3') (resid 9  and  name P  )    1 195 30 2
assign (resid 9  and  name C4') (resid 9  and  name C3')
       (resid 9  and  name O3') (resid 10  and  name P  )    1 195 30 2
assign (resid 10  and  name C4') (resid 10  and  name C3')
       (resid 10  and  name O3') (resid 11  and  name P  )    1 195 30 2
assign (resid 11  and  name C4') (resid 11  and  name C3')
       (resid 11  and  name O3') (resid 12  and  name P  )    1 195 30 2
assign (resid 12  and  name C4') (resid 12  and  name C3')
       (resid 12  and  name O3') (resid 13  and  name P  )    1 195 30 2
assign (resid 13  and  name C4') (resid 13  and  name C3')
       (resid 13  and  name O3') (resid 14  and  name P  )    1 195 30 2
assign (resid 14  and  name C4') (resid 14  and  name C3')
       (resid 14  and  name O3') (resid 15  and  name P  )    1 195 30 2
assign (resid 15  and  name C4') (resid 15  and  name C3')
       (resid 15  and  name O3') (resid 16  and  name P  )    1 195 30 2
assign (resid 16  and  name C4') (resid 16  and  name C3')
       (resid 16  and  name O3') (resid 17  and  name P  )    1 195 30 2
assign (resid 17  and  name C4') (resid 17  and  name C3')
       (resid 17  and  name O3') (resid 18  and  name P  )    1 195 30 2
assign (resid 18  and  name C4') (resid 18  and  name C3')
       (resid 18  and  name O3') (resid 19  and  name P  )    1 195 30 2
assign (resid 19  and  name C4') (resid 19  and  name C3')
       (resid 19  and  name O3') (resid 20  and  name P  )    1 195 30 2
assign (resid 20  and  name C4') (resid 20  and  name C3')
       (resid 20  and  name O3') (resid 21  and  name P  )    1 195 30 2
assign (resid 21  and  name C4') (resid 21  and  name C3')
       (resid 21  and  name O3') (resid 22  and  name P  )    1 195 30 2
assign (resid 22  and  name C4') (resid 22  and  name C3')
       (resid 22  and  name O3') (resid 23  and  name P  )    1 195 30 2
assign (resid 23  and  name C4') (resid 23  and  name C3')
       (resid 23  and  name O3') (resid 24  and  name P  )    1 195 30 2
assign (resid 24  and  name C4') (resid 24  and  name C3')
       (resid 24  and  name O3') (resid 25  and  name P  )    1 195 30 2
assign (resid 25  and  name C4') (resid 25  and  name C3')
       (resid 25  and  name O3') (resid 26  and  name P  )    1 195 30 2
assign (resid 26  and  name C4') (resid 26  and  name C3')
       (resid 26  and  name O3') (resid 27  and  name P  )    1 195 30 2
assign (resid 27  and  name C4') (resid 27  and  name C3')
       (resid 27  and  name O3') (resid 28  and  name P  )    1 195 30 2
assign (resid 28  and  name C4') (resid 28  and  name C3')
       (resid 28  and  name O3') (resid 29  and  name P  )    1 195 30 2
assign (resid 29  and  name C4') (resid 29  and  name C3')
       (resid 29  and  name O3') (resid 30  and  name P  )    1 195 30 2
assign (resid 30  and  name C4') (resid 30  and  name C3')
       (resid 30  and  name O3') (resid 31  and  name P  )    1 195 30 2
assign (resid 31  and  name C4') (resid 31  and  name C3')
       (resid 31  and  name O3') (resid 32  and  name P  )    1 195 30 2
assign (resid 32  and  name C4') (resid 32  and  name C3')
       (resid 32  and  name O3') (resid 33  and  name P  )    1 195 30 2
assign (resid 33  and  name C4') (resid 33  and  name C3')
       (resid 33  and  name O3') (resid 34  and  name P  )    1 195 30 2
assign (resid 34  and  name C4') (resid 34  and  name C3')
       (resid 34  and  name O3') (resid 35  and  name P  )    1 195 30 2
assign (resid 1  and  name C3') (resid 1  and  name O3')
       (resid 2  and  name P  ) (resid 2  and  name O5')     1 295 30 2
assign (resid 2  and  name C3') (resid 2  and  name O3')
       (resid 3  and  name P  ) (resid 3  and  name O5')     1 295 30 2
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assign (resid 25  and  name C1') (resid 25  and  name C2')
       (resid 25  and  name C3') (resid 25  and  name C4')  1 36.5 15 2
assign (resid 26  and  name C1') (resid 26  and  name C2')
       (resid 26  and  name C3') (resid 26  and  name C4')  1 36.5 15 2
assign (resid 27  and  name C1') (resid 27  and  name C2')
       (resid 27  and  name C3') (resid 27  and  name C4')  1 36.5 15 2
assign (resid 28  and  name C1') (resid 28  and  name C2')
       (resid 28  and  name C3') (resid 28  and  name C4')  1 36.5 15 2
assign (resid 31  and  name C1') (resid 31  and  name C2')
       (resid 31  and  name C3') (resid 31  and  name C4')  1 36.5 15 2
assign (resid 32  and  name C1') (resid 32  and  name C2')
       (resid 32  and  name C3') (resid 32  and  name C4')  1 36.5 15 2
assign (resid 33  and  name C1') (resid 33  and  name C2')
       (resid 33  and  name C3') (resid 33  and  name C4')  1 36.5 15 2
assign (resid 34  and  name C1') (resid 34  and  name C2')
       (resid 34  and  name C3') (resid 34  and  name C4')  1 36.5 15 2
assign (resid 1  and  name C1') (resid 1  and  name C2')
       (resid 1  and  name C3') (resid 1  and  name C4')  1 -35.2 15 2
assign (resid 23  and  name C1') (resid 23  and  name C2')
       (resid 23  and  name C3') (resid 23  and  name C4')  1 -35.2 15 2
assign (resid 29  and  name C1') (resid 29  and  name C2')
       (resid 29  and  name C3') (resid 29  and  name C4')  1 -35.2 15 2
assign (resid 30  and  name C1') (resid 30  and  name C2')
       (resid 30  and  name C3') (resid 30  and  name C4')  1 -35.2 15 2
assign (resid 2  and  name C2') (resid 2  and  name C3')
       (resid 2  and  name C4') (resid 2  and  name O4')  1 -33 15 2
assign (resid 3  and  name C2') (resid 3  and  name C3')
       (resid 3  and  name C4') (resid 3  and  name O4')  1 -33 15 2
assign (resid 4  and  name C2') (resid 4  and  name C3')
       (resid 4  and  name C4') (resid 4  and  name O4')  1 -33 15 2
assign (resid 5  and  name C2') (resid 5  and  name C3')
       (resid 5  and  name C4') (resid 5  and  name O4')  1 -33 15 2
assign (resid 6  and  name C2') (resid 6  and  name C3')
       (resid 6  and  name C4') (resid 6  and  name O4')  1 -33 15 2
assign (resid 7  and  name C2') (resid 7  and  name C3')
       (resid 7  and  name C4') (resid 7  and  name O4')  1 -33 15 2
assign (resid 8  and  name C2') (resid 8  and  name C3')
       (resid 8  and  name C4') (resid 8  and  name O4')  1 -33 15 2
assign (resid 9  and  name C2') (resid 9  and  name C3')
       (resid 9  and  name C4') (resid 9  and  name O4')  1 -33 15 2
assign (resid 10  and  name C2') (resid 10  and  name C3')
       (resid 10  and  name C4') (resid 10  and  name O4')  1 -33 15 2
assign (resid 11  and  name C2') (resid 11  and  name C3')
       (resid 11  and  name C4') (resid 11  and  name O4')  1 -33 15 2
assign (resid 12  and  name C2') (resid 12  and  name C3')
       (resid 12  and  name C4') (resid 12  and  name O4')  1 -33 15 2
assign (resid 13  and  name C2') (resid 13  and  name C3')
       (resid 13  and  name C4') (resid 13  and  name O4')  1 -33 15 2
assign (resid 14  and  name C2') (resid 14  and  name C3')
       (resid 14  and  name C4') (resid 14  and  name O4')  1 -33 15 2
assign (resid 15  and  name C2') (resid 15  and  name C3')
       (resid 15  and  name C4') (resid 15  and  name O4')  1 -33 15 2
assign (resid 16  and  name C2') (resid 16  and  name C3')
       (resid 16  and  name C4') (resid 16  and  name O4')  1 -33 15 2
assign (resid 17  and  name C2') (resid 17  and  name C3')
       (resid 17  and  name C4') (resid 17  and  name O4')  1 -33 15 2
assign (resid 18  and  name C2') (resid 18  and  name C3')
       (resid 18  and  name C4') (resid 18  and  name O4')  1 -33 15 2
assign (resid 19  and  name C2') (resid 19  and  name C3')
       (resid 19  and  name C4') (resid 19  and  name O4')  1 -33 15 2
assign (resid 20  and  name C2') (resid 20  and  name C3')
       (resid 20  and  name C4') (resid 20  and  name O4')  1 -33 15 2
assign (resid 21  and  name C2') (resid 21  and  name C3')
       (resid 21  and  name C4') (resid 21  and  name O4')  1 -33 15 2
assign (resid 22  and  name C2') (resid 22  and  name C3')
       (resid 22  and  name C4') (resid 22  and  name O4')  1 -33 15 2
assign (resid 24  and  name C2') (resid 24  and  name C3')
       (resid 24  and  name C4') (resid 24  and  name O4')  1 -33 15 2
assign (resid 25  and  name C2') (resid 25  and  name C3')
       (resid 25  and  name C4') (resid 25  and  name O4')  1 -33 15 2
assign (resid 26  and  name C2') (resid 26  and  name C3')
       (resid 26  and  name C4') (resid 26  and  name O4')  1 -33 15 2
assign (resid 27  and  name C2') (resid 27  and  name C3')
       (resid 27  and  name C4') (resid 27  and  name O4')  1 -33 15 2
assign (resid 28  and  name C2') (resid 28  and  name C3')
       (resid 28  and  name C4') (resid 28  and  name O4')  1 -33 15 2
assign (resid 31  and  name C2') (resid 31  and  name C3')
       (resid 31  and  name C4') (resid 31  and  name O4')  1 -33 15 2
assign (resid 32  and  name C2') (resid 32  and  name C3')
       (resid 32  and  name C4') (resid 32  and  name O4')  1 -33 15 2
assign (resid 33  and  name C2') (resid 33  and  name C3')
       (resid 33  and  name C4') (resid 33  and  name O4')  1 -33 15 2
assign (resid 34  and  name C2') (resid 34  and  name C3')
       (resid 34  and  name C4') (resid 34  and  name O4')  1 -33 15 2
assign (resid 1  and  name C2') (resid 1  and  name C3')
       (resid 1  and  name C4') (resid 1  and  name O4')  1 21.7 15 2
assign (resid 23  and  name C2') (resid 23  and  name C3')
       (resid 23  and  name C4') (resid 23  and  name O4')  1 21.7 15 2
assign (resid 29  and  name C2') (resid 29  and  name C3')
       (resid 29  and  name C4') (resid 29  and  name O4')  1 21.7 15 2
assign (resid 30  and  name C2') (resid 30  and  name C3')
       (resid 30  and  name C4') (resid 30  and  name O4')  1 21.7 15 2
assign (resid 2  and  name C3') (resid 2  and  name C4')
       (resid 2  and  name O4') (resid 2  and  name C1')  1 16.8 15 2
assign (resid 3  and  name C3') (resid 3  and  name C4')
       (resid 3  and  name O4') (resid 3  and  name C1')  1 16.8 15 2
assign (resid 4  and  name C3') (resid 4  and  name C4')
       (resid 4  and  name O4') (resid 4  and  name C1')  1 16.8 15 2
assign (resid 5  and  name C3') (resid 5  and  name C4')
       (resid 5  and  name O4') (resid 5  and  name C1')  1 16.8 15 2
assign (resid 6  and  name C3') (resid 6  and  name C4')
       (resid 6  and  name O4') (resid 6  and  name C1')  1 16.8 15 2
assign (resid 7  and  name C3') (resid 7  and  name C4')
       (resid 7  and  name O4') (resid 7  and  name C1')  1 16.8 15 2
assign (resid 8  and  name C3') (resid 8  and  name C4')
       (resid 8  and  name O4') (resid 8  and  name C1')  1 16.8 15 2
assign (resid 9  and  name C3') (resid 9  and  name C4')
       (resid 9  and  name O4') (resid 9  and  name C1')  1 16.8 15 2
assign (resid 10  and  name C3') (resid 10  and  name C4')
       (resid 10  and  name O4') (resid 10  and  name C1')  1 16.8 15 2
assign (resid 11  and  name C3') (resid 11  and  name C4')
       (resid 11  and  name O4') (resid 11  and  name C1')  1 16.8 15 2
assign (resid 12  and  name C3') (resid 12  and  name C4')
       (resid 12  and  name O4') (resid 12  and  name C1')  1 16.8 15 2
assign (resid 13  and  name C3') (resid 13  and  name C4')
       (resid 13  and  name O4') (resid 13  and  name C1')  1 16.8 15 2
assign (resid 14  and  name C3') (resid 14  and  name C4')
       (resid 14  and  name O4') (resid 14  and  name C1')  1 16.8 15 2
assign (resid 15  and  name C3') (resid 15  and  name C4')
       (resid 15  and  name O4') (resid 15  and  name C1')  1 16.8 15 2
assign (resid 16  and  name C3') (resid 16  and  name C4')
       (resid 16  and  name O4') (resid 16  and  name C1')  1 16.8 15 2
assign (resid 17  and  name C3') (resid 17  and  name C4')
       (resid 17  and  name O4') (resid 17  and  name C1')  1 16.8 15 2
assign (resid 18  and  name C3') (resid 18  and  name C4')
       (resid 18  and  name O4') (resid 18  and  name C1')  1 16.8 15 2
assign (resid 19  and  name C3') (resid 19  and  name C4')
       (resid 19  and  name O4') (resid 19  and  name C1')  1 16.8 15 2
assign (resid 20  and  name C3') (resid 20  and  name C4')
       (resid 20  and  name O4') (resid 20  and  name C1')  1 16.8 15 2
assign (resid 21  and  name C3') (resid 21  and  name C4')
       (resid 21  and  name O4') (resid 21  and  name C1')  1 16.8 15 2
assign (resid 22  and  name C3') (resid 22  and  name C4')
       (resid 22  and  name O4') (resid 22  and  name C1')  1 16.8 15 2
assign (resid 24  and  name C3') (resid 24  and  name C4')
       (resid 24  and  name O4') (resid 24  and  name C1')  1 16.8 15 2
assign (resid 25  and  name C3') (resid 25  and  name C4')
       (resid 25  and  name O4') (resid 25  and  name C1')  1 16.8 15 2
assign (resid 26  and  name C3') (resid 26  and  name C4')
       (resid 26  and  name O4') (resid 26  and  name C1')  1 16.8 15 2
assign (resid 27  and  name C3') (resid 27  and  name C4')
       (resid 27  and  name O4') (resid 27  and  name C1')  1 16.8 15 2
assign (resid 28  and  name C3') (resid 28  and  name C4')
       (resid 28  and  name O4') (resid 28  and  name C1')  1 16.8 15 2
assign (resid 31  and  name C3') (resid 31  and  name C4')
       (resid 31  and  name O4') (resid 31  and  name C1')  1 16.8 15 2
assign (resid 32  and  name C3') (resid 32  and  name C4')
       (resid 32  and  name O4') (resid 32  and  name C1')  1 16.8 15 2
assign (resid 33  and  name C3') (resid 33  and  name C4')
       (resid 33  and  name O4') (resid 33  and  name C1')  1 16.8 15 2
assign (resid 34  and  name C3') (resid 34  and  name C4')
       (resid 34  and  name O4') (resid 34  and  name C1')  1 16.8 15 2
assign (resid 1  and  name C3') (resid 1  and  name C4')
       (resid 1  and  name O4') (resid 1  and  name C1')  1 0.0 15 2
assign (resid 23  and  name C3') (resid 23  and  name C4')
       (resid 23  and  name O4') (resid 23  and  name C1')  1 0.0 15 2
assign (resid 29  and  name C3') (resid 29  and  name C4')
       (resid 29  and  name O4') (resid 29  and  name C1')  1 0.0 15 2
assign (resid 30  and  name C3') (resid 30  and  name C4')
       (resid 30  and  name O4') (resid 30  and  name C1')  1 0.0 15 2


Base planarity restraints

evaluate ($pscale = 300)  
group
selection=     ((resid  1  and  name C1') or (resid  1  and  name N9) or
  (resid  1  and  name C8) or (resid  1  and  name H8) or
   (resid  1  and  name N7) or (resid  1  and  name C5) or
  (resid  1  and  name C4) or (resid  1  and  name N3) or 
  (resid  1  and  name C2) or (resid  1  and  name N2) or 
  (resid  1  and  name H21) or (resid  1  and  name H22) or 
  (resid  1  and  name N1) or (resid  1  and  name H1) or 
  (resid  1  and  name C6) or (resid  1  and  name O6))
weight = $pscale end
group
selection=     ((resid  2  and  name C1') or (resid  2  and  name N9) or
  (resid  2  and  name C8) or (resid  2  and  name H8) or
   (resid  2  and  name N7) or (resid  2  and  name C5) or
  (resid  2  and  name C4) or (resid  2  and  name N3) or 
  (resid  2  and  name C2) or (resid  2  and  name N2) or 
  (resid  2  and  name H21) or (resid  2  and  name H22) or 
  (resid  2  and  name N1) or (resid  2  and  name H1) or 
  (resid  2  and  name C6) or (resid  2  and  name O6))
weight = $pscale end
group
selection=     ((resid  7  and  name C1') or (resid  7  and  name N9) or
  (resid  7  and  name C8) or (resid  7  and  name H8) or
   (resid  7  and  name N7) or (resid  7  and  name C5) or
  (resid  7  and  name C4) or (resid  7  and  name N3) or 
  (resid  7  and  name C2) or (resid  7  and  name N2) or 
  (resid  7  and  name H21) or (resid  7  and  name H22) or 
  (resid  7  and  name N1) or (resid  7  and  name H1) or 
  (resid  7  and  name C6) or (resid  7  and  name O6))
weight = $pscale end
group
selection=     ((resid  13  and  name C1') or (resid  13  and  name N9) or
  (resid  13  and  name C8) or (resid  13  and  name H8) or
   (resid  13  and  name N7) or (resid  13  and  name C5) or
  (resid  13  and  name C4) or (resid  13  and  name N3) or 
  (resid  13  and  name C2) or (resid  13  and  name N2) or 
  (resid  13  and  name H21) or (resid  13  and  name H22) or 
  (resid  13  and  name N1) or (resid  13  and  name H1) or 
  (resid  13  and  name C6) or (resid  13  and  name O6))
weight = $pscale end
group
selection=     ((resid  16  and  name C1') or (resid  16  and  name N9) or
  (resid  16  and  name C8) or (resid  16  and  name H8) or
   (resid  16  and  name N7) or (resid  16  and  name C5) or
  (resid  16  and  name C4) or (resid  16  and  name N3) or 
  (resid  16  and  name C2) or (resid  16  and  name N2) or 
  (resid  16  and  name H21) or (resid  16  and  name H22) or 
  (resid  16  and  name N1) or (resid  16  and  name H1) or 
  (resid  16  and  name C6) or (resid  16  and  name O6))
weight = $pscale end
group
selection=     ((resid  18  and  name C1') or (resid  18  and  name N9) or
  (resid  18  and  name C8) or (resid  18  and  name H8) or
   (resid  18  and  name N7) or (resid  18  and  name C5) or
  (resid  18  and  name C4) or (resid  18  and  name N3) or 
  (resid  18  and  name C2) or (resid  18  and  name N2) or 
  (resid  18  and  name H21) or (resid  18  and  name H22) or 
  (resid  18  and  name N1) or (resid  18  and  name H1) or 
  (resid  18  and  name C6) or (resid  18  and  name O6))
weight = $pscale end
group
selection=     ((resid  21  and  name C1') or (resid  21  and  name N9) or
  (resid  21  and  name C8) or (resid  21  and  name H8) or
   (resid  21  and  name N7) or (resid  21  and  name C5) or
  (resid  21  and  name C4) or (resid  21  and  name N3) or 
  (resid  21  and  name C2) or (resid  21  and  name N2) or 
  (resid  21  and  name H21) or (resid  21  and  name H22) or 
  (resid  21  and  name N1) or (resid  21  and  name H1) or 
  (resid  21  and  name C6) or (resid  21  and  name O6))
weight = $pscale end
group
selection=     ((resid  29  and  name C1') or (resid  29  and  name N9) or
  (resid  29  and  name C8) or (resid  29  and  name H8) or
   (resid  29  and  name N7) or (resid  29  and  name C5) or
  (resid  29  and  name C4) or (resid  29  and  name N3) or 
  (resid  29  and  name C2) or (resid  29  and  name N2) or 
  (resid  29  and  name H21) or (resid  29  and  name H22) or 
  (resid  29  and  name N1) or (resid  29  and  name H1) or 
  (resid  29  and  name C6) or (resid  29  and  name O6))
weight = $pscale end
group
selection=     ((resid  31  and  name C1') or (resid  31  and  name N9) or
  (resid  31  and  name C8) or (resid  31  and  name H8) or
   (resid  31  and  name N7) or (resid  31  and  name C5) or
  (resid  31  and  name C4) or (resid  31  and  name N3) or 
  (resid  31  and  name C2) or (resid  31  and  name N2) or 
  (resid  31  and  name H21) or (resid  31  and  name H22) or 
  (resid  31  and  name N1) or (resid  31  and  name H1) or 
  (resid  31  and  name C6) or (resid  31  and  name O6))
weight = $pscale end
group
selection=     ((resid  32  and  name C1') or (resid  32  and  name N9) or
  (resid  32  and  name C8) or (resid  32  and  name H8) or
   (resid  32  and  name N7) or (resid  32  and  name C5) or
  (resid  32  and  name C4) or (resid  32  and  name N3) or 
  (resid  32  and  name C2) or (resid  32  and  name N2) or 
  (resid  32  and  name H21) or (resid  32  and  name H22) or 
  (resid  32  and  name N1) or (resid  32  and  name H1) or 
  (resid  32  and  name C6) or (resid  32  and  name O6))
weight = $pscale end
group
selection=     ((resid  4  and  name C1') or (resid  4  and  name N1) or
  (resid  4  and  name C2) or (resid  4  and  name O2) or
   (resid  4  and  name N3) or (resid  4  and  name C4) or
  (resid  4  and  name N4) or (resid  4  and  name H42) or 
  (resid  4  and  name H41) or (resid  4  and  name C5) or 
  (resid  4  and  name H5) or (resid  4  and  name C6) or 
  (resid  4  and  name H6))
weight = $pscale end
group
selection=     ((resid  5  and  name C1') or (resid  5  and  name N1) or
  (resid  5  and  name C2) or (resid  5  and  name O2) or
   (resid  5  and  name N3) or (resid  5  and  name C4) or
  (resid  5  and  name N4) or (resid  5  and  name H42) or 
  (resid  5  and  name H41) or (resid  5  and  name C5) or 
  (resid  5  and  name H5) or (resid  5  and  name C6) or 
  (resid  5  and  name H6))
weight = $pscale end
group
selection=     ((resid  6  and  name C1') or (resid  6  and  name N1) or
  (resid  6  and  name C2) or (resid  6  and  name O2) or
   (resid  6  and  name N3) or (resid  6  and  name C4) or
  (resid  6  and  name N4) or (resid  6  and  name H42) or 
  (resid  6  and  name H41) or (resid  6  and  name C5) or 
  (resid  6  and  name H5) or (resid  6  and  name C6) or 
  (resid  6  and  name H6))
weight = $pscale end
group
selection=     ((resid  8  and  name C1') or (resid  8  and  name N1) or
  (resid  8  and  name C2) or (resid  8  and  name O2) or
   (resid  8  and  name N3) or (resid  8  and  name C4) or
  (resid  8  and  name N4) or (resid  8  and  name H42) or 
  (resid  8  and  name H41) or (resid  8  and  name C5) or 
  (resid  8  and  name H5) or (resid  8  and  name C6) or 
  (resid  8  and  name H6))
weight = $pscale end
group
selection=     ((resid  9  and  name C1') or (resid  9  and  name N1) or
  (resid  9  and  name C2) or (resid  9  and  name O2) or
   (resid  9  and  name N3) or (resid  9  and  name C4) or
  (resid  9  and  name N4) or (resid  9  and  name H42) or 
  (resid  9  and  name H41) or (resid  9  and  name C5) or 
  (resid  9  and  name H5) or (resid  9  and  name C6) or 
  (resid  9  and  name H6))
weight = $pscale end
group
selection=     ((resid  11  and  name C1') or (resid  11  and  name N1) or
  (resid  11  and  name C2) or (resid  11  and  name O2) or
   (resid  11  and  name N3) or (resid  11  and  name C4) or
  (resid  11  and  name N4) or (resid  11  and  name H42) or 
  (resid  11  and  name H41) or (resid  11  and  name C5) or 
  (resid  11  and  name H5) or (resid  11  and  name C6) or 
  (resid  11  and  name H6))
weight = $pscale end
group
selection=     ((resid  14  and  name C1') or (resid  14  and  name N1) or
  (resid  14  and  name C2) or (resid  14  and  name O2) or
   (resid  14  and  name N3) or (resid  14  and  name C4) or
  (resid  14  and  name N4) or (resid  14  and  name H42) or 
  (resid  14  and  name H41) or (resid  14  and  name C5) or 
  (resid  14  and  name H5) or (resid  14  and  name C6) or 
  (resid  14  and  name H6))
weight = $pscale end
group
selection=     ((resid  22  and  name C1') or (resid  22  and  name N1) or
  (resid  22  and  name C2) or (resid  22  and  name O2) or
   (resid  22  and  name N3) or (resid  22  and  name C4) or
  (resid  22  and  name N4) or (resid  22  and  name H42) or 
  (resid  22  and  name H41) or (resid  22  and  name C5) or 
  (resid  22  and  name H5) or (resid  22  and  name C6) or 
  (resid  22  and  name H6))
weight = $pscale end
group
selection=     ((resid  26  and  name C1') or (resid  26  and  name N1) or
  (resid  26  and  name C2) or (resid  26  and  name O2) or
   (resid  26  and  name N3) or (resid  26  and  name C4) or
  (resid  26  and  name N4) or (resid  26  and  name H42) or 
  (resid  26  and  name H41) or (resid  26  and  name C5) or 
  (resid  26  and  name H5) or (resid  26  and  name C6) or 
  (resid  26  and  name H6))
weight = $pscale end
group
selection=     ((resid  27  and  name C1') or (resid  27  and  name N1) or
  (resid  27  and  name C2) or (resid  27  and  name O2) or
   (resid  27  and  name N3) or (resid  27  and  name C4) or
  (resid  27  and  name N4) or (resid  27  and  name H42) or 
  (resid  27  and  name H41) or (resid  27  and  name C5) or 
  (resid  27  and  name H5) or (resid  27  and  name C6) or 
  (resid  27  and  name H6))
weight = $pscale end
group
selection=     ((resid  34  and  name C1') or (resid  34  and  name N1) or
  (resid  34  and  name C2) or (resid  34  and  name O2) or
   (resid  34  and  name N3) or (resid  34  and  name C4) or
  (resid  34  and  name N4) or (resid  34  and  name H42) or 
  (resid  34  and  name H41) or (resid  34  and  name C5) or 
  (resid  34  and  name H5) or (resid  34  and  name C6) or 
  (resid  34  and  name H6))
weight = $pscale end
group
selection=     ((resid  35  and  name C1') or (resid  35  and  name N1) or
  (resid  35  and  name C2) or (resid  35  and  name O2) or
   (resid  35  and  name N3) or (resid  35  and  name C4) or
  (resid  35  and  name N4) or (resid  35  and  name H42) or 
  (resid  35  and  name H41) or (resid  35  and  name C5) or 
  (resid  35  and  name H5) or (resid  35  and  name C6) or 
  (resid  35  and  name H6))
weight = $pscale end
group
selection=     ((resid  3  and  name C1') or (resid  3  and  name N9) or
  (resid  3  and  name C8) or (resid  3  and  name H8) or
   (resid  3  and  name N7) or (resid  3  and  name C5) or
  (resid  3  and  name C4) or (resid  3  and  name N3) or 
  (resid  3  and  name C2) or (resid  3  and  name H2) or 
  (resid  3  and  name N1) or (resid  3  and  name C6) or 
  (resid  3  and  name N6) or (resid  3  and  name H61) or 
  (resid  3  and  name H62))
weight = $pscale end
group
selection=     ((resid  10  and  name C1') or (resid  10  and  name N9) or
  (resid  10  and  name C8) or (resid  10  and  name H8) or
   (resid  10  and  name N7) or (resid  10  and  name C5) or
  (resid  10  and  name C4) or (resid  10  and  name N3) or 
  (resid  10  and  name C2) or (resid  10  and  name H2) or 
  (resid  10  and  name N1) or (resid  10  and  name C6) or 
  (resid  10  and  name N6) or (resid  10  and  name H61) or 
  (resid  10  and  name H62))
weight = $pscale end
group
selection=     ((resid  15  and  name C1') or (resid  15  and  name N9) or
  (resid  15  and  name C8) or (resid  15  and  name H8) or
   (resid  15  and  name N7) or (resid  15  and  name C5) or
  (resid  15  and  name C4) or (resid  15  and  name N3) or 
  (resid  15  and  name C2) or (resid  15  and  name H2) or 
  (resid  15  and  name N1) or (resid  15  and  name C6) or 
  (resid  15  and  name N6) or (resid  15  and  name H61) or 
  (resid  15  and  name H62))
weight = $pscale end
group
selection=     ((resid  17  and  name C1') or (resid  17  and  name N9) or
  (resid  17  and  name C8) or (resid  17  and  name H8) or
   (resid  17  and  name N7) or (resid  17  and  name C5) or
  (resid  17  and  name C4) or (resid  17  and  name N3) or 
  (resid  17  and  name C2) or (resid  17  and  name H2) or 
  (resid  17  and  name N1) or (resid  17  and  name C6) or 
  (resid  17  and  name N6) or (resid  17  and  name H61) or 
  (resid  17  and  name H62))
weight = $pscale end
group
selection=     ((resid  19  and  name C1') or (resid  19  and  name N9) or
  (resid  19  and  name C8) or (resid  19  and  name H8) or
   (resid  19  and  name N7) or (resid  19  and  name C5) or
  (resid  19  and  name C4) or (resid  19  and  name N3) or 
  (resid  19  and  name C2) or (resid  19  and  name H2) or 
  (resid  19  and  name N1) or (resid  19  and  name C6) or 
  (resid  19  and  name N6) or (resid  19  and  name H61) or 
  (resid  19  and  name H62))
weight = $pscale end
group
selection=     ((resid  23  and  name C1') or (resid  23  and  name N9) or
  (resid  23  and  name C8) or (resid  23  and  name H8) or
   (resid  23  and  name N7) or (resid  23  and  name C5) or
  (resid  23  and  name C4) or (resid  23  and  name N3) or 
  (resid  23  and  name C2) or (resid  23  and  name H2) or 
  (resid  23  and  name N1) or (resid  23  and  name C6) or 
  (resid  23  and  name N6) or (resid  23  and  name H61) or 
  (resid  23  and  name H62))
weight = $pscale end
group
selection=     ((resid  24  and  name C1') or (resid  24  and  name N9) or
  (resid  24  and  name C8) or (resid  24  and  name H8) or
   (resid  24  and  name N7) or (resid  24  and  name C5) or
  (resid  24  and  name C4) or (resid  24  and  name N3) or 
  (resid  24  and  name C2) or (resid  24  and  name H2) or 
  (resid  24  and  name N1) or (resid  24  and  name C6) or 
  (resid  24  and  name N6) or (resid  24  and  name H61) or 
  (resid  24  and  name H62))
weight = $pscale end
group
selection=     ((resid  28  and  name C1') or (resid  28  and  name N9) or
  (resid  28  and  name C8) or (resid  28  and  name H8) or
   (resid  28  and  name N7) or (resid  28  and  name C5) or
  (resid  28  and  name C4) or (resid  28  and  name N3) or 
  (resid  28  and  name C2) or (resid  28  and  name H2) or 
  (resid  28  and  name N1) or (resid  28  and  name C6) or 
  (resid  28  and  name N6) or (resid  28  and  name H61) or 
  (resid  28  and  name H62))
weight = $pscale end
group
selection=     ((resid  12  and  name C1') or (resid  12  and  name N1) or
  (resid  12  and  name C2) or (resid  12  and  name O2) or
   (resid  12  and  name N3) or (resid  12  and  name H3) or
  (resid  12  and  name C4) or (resid  12  and  name O4) or 
  (resid  12  and  name C5) or (resid  12  and  name H5) or 
  (resid  12  and  name C6) or (resid  12  and  name H6))
weight = $pscale end
group
selection=     ((resid  20  and  name C1') or (resid  20  and  name N1) or
  (resid  20  and  name C2) or (resid  20  and  name O2) or
   (resid  20  and  name N3) or (resid  20  and  name H3) or
  (resid  20  and  name C4) or (resid  20  and  name O4) or 
  (resid  20  and  name C5) or (resid  20  and  name H5) or 
  (resid  20  and  name C6) or (resid  20  and  name H6))
weight = $pscale end
group
selection=     ((resid  25  and  name C1') or (resid  25  and  name N1) or
  (resid  25  and  name C2) or (resid  25  and  name O2) or
   (resid  25  and  name N3) or (resid  25  and  name H3) or
  (resid  25  and  name C4) or (resid  25  and  name O4) or 
  (resid  25  and  name C5) or (resid  25  and  name H5) or 
  (resid  25  and  name C6) or (resid  25  and  name H6))
weight = $pscale end
group
selection=     ((resid  30  and  name C1') or (resid  30  and  name N1) or
  (resid  30  and  name C2) or (resid  30  and  name O2) or
   (resid  30  and  name N3) or (resid  30  and  name H3) or
  (resid  30  and  name C4) or (resid  30  and  name O4) or 
  (resid  30  and  name C5) or (resid  30  and  name H5) or 
  (resid  30  and  name C6) or (resid  30  and  name H6))
weight = $pscale end
group
selection=     ((resid  33  and  name C1') or (resid  33  and  name N1) or
  (resid  33  and  name C2) or (resid  33  and  name O2) or
   (resid  33  and  name N3) or (resid  33  and  name H3) or
  (resid  33  and  name C4) or (resid  33  and  name O4) or 
  (resid  33  and  name C5) or (resid  33  and  name H5) or 
  (resid  33  and  name C6) or (resid  33  and  name H6))
weight = $pscale end


Base pair planarity restraints

evaluate ($pscale = 15)  
group
selection=     ((resid  1  and  name N1) or (resid  1  and  name N3) or
  (resid  1  and  name C5) or (resid 35  and  name N1) or
   (resid 35  and  name N3) or (resid 35  and  name C5))
weight = $pscale end
group
selection=     ((resid   2  and  name N1) or (resid  2  and  name N3) or
  (resid   2  and  name C5) or (resid 34  and  name N1) or
   (resid  34  and  name N3) or (resid 34  and  name C5))
weight = $pscale end
group
selection=     ((resid  3  and  name N1) or (resid  3  and  name N3) or
  (resid  3  and  name C5) or (resid 33  and  name N1) or
   (resid 33  and  name N3) or (resid 33  and  name C5))
weight = $pscale end
group
selection=     ((resid  4  and  name N1) or (resid  4  and  name N3) or
  (resid  4  and  name C5) or (resid 32  and  name N1) or
   (resid 32  and  name N3) or (resid 32  and  name C5))
weight = $pscale end
group
selection=     ((resid  5  and  name N1) or (resid  5  and  name N3) or
  (resid  5  and  name C5) or (resid 31  and  name N1) or
   (resid 31  and  name N3) or (resid 31  and  name C5))
weight = $pscale end
group
selection=     ((resid 12  and  name N1) or (resid 12  and  name N3) or
  (resid  12  and  name C5) or (resid 23  and  name N1) or
   (resid 23  and  name N3) or (resid 23  and  name C5))
weight = $pscale end
group
selection=     ((resid  13  and  name N1) or (resid  13  and  name N3) or
  (resid  13  and  name C5) or (resid 22  and  name N1) or
   (resid 22  and  name N3) or (resid 22  and  name C5))
weight = $pscale end
group
selection=     ((resid   14  and  name N1) or (resid  14  and  name N3) or
  (resid   14  and  name C5) or (resid 21  and  name N1) or
   (resid  21  and  name N3) or (resid 21  and  name C5))
weight = $pscale end
group
selection=     ((resid  15  and  name N1) or (resid  15  and  name N3) or
  (resid  15  and  name C5) or (resid 20  and  name N1) or
   (resid 20  and  name N3) or (resid 20  and  name C5))
weight = $pscale end
group
selection=     ((resid 16  and  name N1) or (resid 16  and  name N3) or
  (resid 16  and  name C5) or (resid 19  and  name N1) or
   (resid 19  and  name N3) or (resid 19  and  name C5))
weight = $pscale end
group
selection=     ((resid  23  and  name N1) or (resid  23  and  name N3) or
  (resid  23  and  name C5) or (resid 11  and  name N1) or
   (resid 11  and  name N3) or (resid 11  and  name C5))
weight = $pscale end
group
selection=     ((resid  10  and  name N1) or (resid  10  and  name N3) or
  (resid  10  and  name C5) or (resid 25  and  name N1) or
   (resid 25  and  name N3) or (resid 25  and  name C5))
weight = $pscale end







  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          H5*         G   1  19.720  -0.153 -23.492
    2   2H5*    G   1          H5**        G   1  18.398  -0.747 -22.491
    3    H4*    G   1           H4*        G   1  20.009  -0.100 -21.024
    4    H3*    G   1           H3*        G   1  17.591   1.222 -20.809
    5    H2*    G   1           H2*        G   1  18.227   3.418 -21.119
    6   2HO*    G   1          2HO*        G   1  18.841   2.678 -18.624
    7    H1*    G   1           H1*        G   1  21.158   3.039 -20.470
    8    H8     G   1           H8         G   1  19.171   3.375 -23.735
    9    H1     G   1           H1         G   1  22.921   8.380 -22.311
   10   1H2     G   1          H22         G   1  23.862   8.121 -20.384
   11   2H2     G   1          H21         G   1  23.551   6.685 -19.412
   12    H5T    G   1           H5T        G   1  17.172   0.936 -23.062
   13   1H5*    G   2          H5*         G   2  18.779   1.308 -16.154
   14   2H5*    G   2          H5**        G   2  17.163   1.162 -15.463
   15    H4*    G   2           H4*        G   2  18.549   3.179 -14.838
   16    H3*    G   2           H3*        G   2  15.708   3.648 -15.780
   17    H2*    G   2           H2*        G   2  16.150   5.935 -15.174
   18   2HO*    G   2          2HO*        G   2  17.656   4.882 -13.339
   19    H1*    G   2           H1*        G   2  18.794   5.894 -16.199
   20    H8     G   2           H8         G   2  16.251   4.375 -18.576
   21    H1     G   2           H1         G   2  16.843  10.772 -18.853
   22   1H2     G   2          H22         G   2  18.083  11.493 -17.223
   23   2H2     G   2          H21         G   2  18.715  10.362 -16.043
   24   1H5*    A   3          H5*         A   3  16.326   5.190 -11.670
   25   2H5*    A   3          H5**        A   3  14.766   5.368 -10.860
   26    H4*    A   3           H4*        A   3  16.211   7.440 -11.140
   27    H3*    A   3           H3*        A   3  13.297   7.542 -11.962
   28    H2*    A   3           H2*        A   3  13.709   9.875 -12.359
   29   2HO*    A   3          2HO*        A   3  15.332   9.712 -10.387
   30    H1*    A   3           H1*        A   3  16.221   9.466 -13.561
   31    H8     A   3           H8         A   3  14.102   6.860 -15.075
   32   1H6     A   3          H61         A   3  11.775  11.391 -18.693
   33   2H6     A   3          H62         A   3  11.817   9.685 -18.657
   34    H2     A   3           H2         A   3  14.010  13.269 -15.529
   35   1H5*    C   4          H5*         C   4  13.724  10.647  -9.096
   36   2H5*    C   4          H5**        C   4  12.241  10.796  -8.148
   37    H4*    C   4           H4*        C   4  12.910  12.850  -9.369
   38    H3*    C   4           H3*        C   4  10.160  11.726  -9.918
   39    H2*    C   4           H2*        C   4   9.831  13.652 -11.307
   40   2HO*    C   4          2HO*        C   4  11.300  14.883  -9.631
   41    H1*    C   4           H1*        C   4  12.404  13.587 -12.442
   42   1H4     C   4          H41         C   4   8.442  11.108 -16.615
   43   2H4     C   4          H42         C   4   8.882   9.488 -16.389
   44    H5     C   4           H5         C   4  10.414   9.025 -14.222
   45    H6     C   4           H6         C   4  11.613  10.180 -12.440
   46   1H5*    C   5          H5*         C   5   9.832  16.241  -9.169
   47   2H5*    C   5          H5**        C   5   8.663  16.183  -7.836
   48    H4*    C   5           H4*        C   5   7.949  17.801  -9.426
   49    H3*    C   5           H3*        C   5   6.192  15.345  -9.384
   50    H2*    C   5           H2*        C   5   4.727  16.556 -10.831
   51   2HO*    C   5          2HO*        C   5   5.501  18.668  -9.696
   52    H1*    C   5           H1*        C   5   6.803  17.358 -12.527
   53   1H4     C   5          H42         C   5   5.032  11.748 -15.115
   54   2H4     C   5          H41         C   5   6.067  10.956 -13.955
   55    H5     C   5           H5         C   5   7.215  12.018 -12.199
   56    H6     C   5           H6         C   5   7.669  14.125 -11.122
   57   1H5*    C   6          H5*         C   6   3.825  18.676  -7.595
   58   2H5*    C   6          H5**        C   6   3.262  18.008  -6.057
   59    H4*    C   6           H4*        C   6   1.449  19.088  -7.040
   60    H3*    C   6           H3*        C   6   1.067  16.109  -7.295
   61    H2*    C   6           H2*        C   6  -1.074  16.643  -8.185
   62   2HO*    C   6          2HO*        C   6  -1.747  18.290  -6.770
   63    H1*    C   6           H1*        C   6  -0.115  18.963  -9.578
   64   1H4     C   6          H41         C   6  -1.213  14.809 -14.180
   65   2H4     C   6          H42         C   6   0.329  14.017 -13.901
   66    H5     C   6           H5         C   6   1.767  14.626 -12.055
   67    H6     C   6           H6         C   6   2.006  16.101 -10.113
   68   1H5*    G   7          H5*         G   7  -1.722  18.675  -4.618
   69   2H5*    G   7          H5**        G   7  -2.103  17.614  -3.248
   70    H4*    G   7           H4*        G   7  -4.072  18.833  -3.887
   71    H3*    G   7           H3*        G   7  -4.193  15.880  -4.504
   72    H2*    G   7           H2*        G   7  -6.424  16.240  -5.234
   73   2HO*    G   7          2HO*        G   7  -6.765  17.800  -3.371
   74    H1*    G   7           H1*        G   7  -5.878  18.731  -6.484
   75    H8     G   7           H8         G   7  -3.472  15.813  -7.111
   76    H1     G   7           H1         G   7  -8.215  16.480 -11.386
   77   1H2     G   7          H22         G   7  -9.630  18.031 -10.690
   78   2H2     G   7          H21         G   7  -9.368  18.872  -9.172
   79   1H5*    C   8          H5*         C   8  -7.435  17.554  -1.383
   80   2H5*    C   8          H5**        C   8  -6.915  16.457  -0.088
   81    H4*    C   8           H4*        C   8  -9.298  16.793   0.012
   82    H3*    C   8           H3*        C   8  -8.368  14.010  -0.694
   83    H2*    C   8           H2*        C   8 -10.648  13.351  -0.819
   84   2HO*    C   8          2HO*        C   8 -10.931  14.983   1.158
   85    H1*    C   8           H1*        C   8 -11.613  15.809  -1.912
   86   1H4     C   8          H41         C   8 -11.746  12.141  -7.006
   87   2H4     C   8          H42         C   8  -9.990  12.081  -7.110
   88    H5     C   8           H5         C   8  -8.572  13.098  -5.435
   89    H6     C   8           H6         C   8  -8.557  14.356  -3.341
   90   1H5*    C   9          H5*         C   9 -10.931  12.819   1.997
   91   2H5*    C   9          H5**        C   9 -10.055  12.799   3.541
   92    H4*    C   9           H4*        C   9 -11.624  10.961   3.314
   93    H3*    C   9           H3*        C   9  -8.713  10.188   3.589
   94    H2*    C   9           H2*        C   9  -9.571   7.943   3.877
   95   2HO*    C   9          2HO*        C   9 -11.727   9.051   4.752
   96    H1*    C   9           H1*        C   9 -11.071   8.093   1.565
   97   1H4     C   9          H42         C   9  -5.215   6.220  -0.040
   98   2H4     C   9          H41         C   9  -4.837   7.857  -0.579
   99    H5     C   9           H5         C   9  -6.353   9.708  -0.213
  100    H6     C   9           H6         C   9  -8.497  10.336   0.729
  101   1H5*    A  10          H5*         A  10 -11.246   8.510   6.687
  102   2H5*    A  10          H5**        A  10 -10.338   8.401   8.195
  103    H4*    A  10           H4*        A  10 -11.453   6.322   7.601
  104    H3*    A  10           H3*        A  10  -8.443   6.094   7.716
  105    H2*    A  10           H2*        A  10  -8.886   3.725   7.561
  106   2HO*    A  10          2HO*        A  10 -10.738   3.112   8.523
  107    H1*    A  10           H1*        A  10 -10.798   4.067   5.523
  108    H8     A  10           H8         A  10  -7.776   6.336   5.159
  109   1H6     A  10          H62         A  10  -5.257   1.743   1.829
  110   2H6     A  10          H61         A  10  -5.066   3.423   2.339
  111    H2     A  10           H2         A  10  -8.970   0.192   3.615
  112   1H5*    C  11          H5*         C  11 -10.980   4.254  10.802
  113   2H5*    C  11          H5**        C  11 -10.185   3.661  12.267
  114    H4*    C  11           H4*        C  11 -11.619   1.994  11.045
  115    H3*    C  11           H3*        C  11  -8.740   1.326  11.662
  116    H2*    C  11           H2*        C  11  -9.130  -0.797  10.610
  117   2HO*    C  11          2HO*        C  11 -11.273  -1.099  11.560
  118    H1*    C  11           H1*        C  11 -10.846   0.215   8.593
  119   1H4     C  11          H42         C  11  -5.634  -0.490   5.166
  120   2H4     C  11          H41         C  11  -4.768   0.774   6.040
  121    H5     C  11           H5         C  11  -5.749   1.901   7.936
  122    H6     C  11           H6         C  11  -7.724   2.046   9.358
  123   1H5*    U  12          H5*         U  12 -12.761  -0.506  12.803
  124   2H5*    U  12          H5**        U  12 -12.621  -1.262  14.401
  125    H4*    U  12           H4*        U  12 -14.123  -2.410  12.702
  126    H3*    U  12           H3*        U  12 -12.103  -3.780  14.401
  127    H2*    U  12           H2*        U  12 -12.249  -5.765  13.205
  128   2HO*    U  12          2HO*        U  12 -14.256  -6.418  12.905
  129    H1*    U  12           H1*        U  12 -13.000  -4.697  10.658
  130    H3     U  12           H3         U  12  -9.407  -7.444  10.043
  131    H5     U  12           H5         U  12  -7.817  -3.679  11.063
  132    H6     U  12           H6         U  12 -10.040  -3.000  11.633
  133   1H5*    G  13          H5*         G  13 -15.835  -5.791  14.507
  134   2H5*    G  13          H5**        G  13 -16.277  -6.449  16.088
  135    H4*    G  13           H4*        G  13 -16.219  -8.182  14.385
  136    H3*    G  13           H3*        G  13 -14.261  -8.447  16.656
  137    H2*    G  13           H2*        G  13 -13.471 -10.456  15.671
  138   2HO*    G  13          2HO*        G  13 -15.920 -10.783  14.938
  139    H1*    G  13           H1*        G  13 -13.504  -9.554  13.005
  140    H8     G  13           H8         G  13 -12.274  -7.046  15.599
  141    H1     G  13           H1         G  13  -7.715 -10.695  12.977
  142   1H2     G  13          H21         G  13  -8.357 -12.070  11.925
  143   2H2     G  13          H22         G  13  -9.919 -12.551  11.506
  144   1H5*    C  14          H5*         C  14 -15.628 -12.060  16.738
  145   2H5*    C  14          H5**        C  14 -16.204 -12.437  18.363
  146    H4*    C  14           H4*        C  14 -14.639 -14.040  17.911
  147    H3*    C  14           H3*        C  14 -13.245 -12.033  19.670
  148    H2*    C  14           H2*        C  14 -11.475 -13.632  19.713
  149   2HO*    C  14          2HO*        C  14 -12.132 -15.686  19.751
  150    H1*    C  14           H1*        C  14 -11.850 -14.351  16.985
  151   1H4     C  14          H42         C  14  -6.481 -11.098  16.918
  152   2H4     C  14          H41         C  14  -7.320  -9.550  17.068
  153    H5     C  14           H5         C  14  -9.727  -9.424  17.404
  154    H6     C  14           H6         C  14 -11.772 -10.753  17.651
  155   1H5*    A  15          H5*         A  15 -14.113 -16.094  21.159
  156   2H5*    A  15          H5**        A  15 -14.024 -16.308  22.912
  157    H4*    A  15           H4*        A  15 -12.684 -17.928  21.576
  158    H3*    A  15           H3*        A  15 -11.263 -16.306  23.694
  159    H2*    A  15           H2*        A  15  -9.297 -17.516  23.115
  160   2HO*    A  15          2HO*        A  15 -10.918 -19.482  22.750
  161    H1*    A  15           H1*        A  15  -9.773 -17.561  20.327
  162    H8     A  15           H8         A  15 -10.263 -14.278  22.268
  163   1H6     A  15          H62         A  15  -4.475 -12.927  20.408
  164   2H6     A  15          H61         A  15  -5.898 -12.311  21.232
  165    H2     A  15           H2         A  15  -5.385 -17.090  19.174
  166   1H5*    G  16          H5*         G  16 -10.333 -20.180  25.092
  167   2H5*    G  16          H5**        G  16 -10.282 -20.045  26.850
  168    H4*    G  16           H4*        G  16  -8.157 -20.688  25.984
  169    H3*    G  16           H3*        G  16  -8.009 -17.878  27.105
  170    H2*    G  16           H2*        G  16  -5.623 -18.310  26.984
  171   2HO*    G  16          2HO*        G  16  -4.834 -20.308  26.235
  172    H1*    G  16           H1*        G  16  -5.915 -18.783  24.259
  173    H8     G  16           H8         G  16  -8.770 -16.704  25.673
  174    H1     G  16           H1         G  16  -3.976 -13.191  23.265
  175   1H2     G  16          H22         G  16  -2.301 -14.451  22.744
  176   2H2     G  16          H21         G  16  -2.332 -16.187  22.998
  177   1H5*    A  17          H5*         A  17  -4.651 -17.664  29.976
  178   2H5*    A  17          H5**        A  17  -5.282 -18.811  28.821
  179    H4*    A  17           H4*        A  17  -5.901 -19.226  31.686
  180    H3*    A  17           H3*        A  17  -3.272 -19.464  30.338
  181    H2*    A  17           H2*        A  17  -2.998 -21.677  30.829
  182   2HO*    A  17          2HO*        A  17  -3.756 -20.990  33.176
  183    H1*    A  17           H1*        A  17  -5.861 -22.228  31.118
  184    H8     A  17           H8         A  17  -6.399 -21.872  27.904
  185   1H6     A  17          H62         A  17  -3.088 -26.916  26.374
  186   2H6     A  17          H61         A  17  -4.316 -25.792  25.799
  187    H2     A  17           H2         A  17  -1.892 -25.698  30.440
  188   1H5*    G  18          H5*         G  18  -0.973 -16.346  30.438
  189   2H5*    G  18          H5**        G  18  -2.341 -17.408  30.124
  190    H4*    G  18           H4*        G  18   0.306 -18.621  30.748
  191    H3*    G  18           H3*        G  18  -0.290 -17.463  28.016
  192    H2*    G  18           H2*        G  18   0.757 -19.415  27.144
  193   2HO*    G  18          2HO*        G  18   2.320 -19.121  29.197
  194    H1*    G  18           H1*        G  18  -0.212 -21.129  29.293
  195    H8     G  18           H8         G  18  -2.980 -19.291  27.757
  196    H1     G  18           H1         G  18  -1.446 -24.602  24.483
  197   1H2     G  18          H21         G  18   0.482 -25.411  25.198
  198   2H2     G  18          H22         G  18   1.361 -24.604  26.486
  199   1H5*    A  19          H5*         A  19   3.736 -17.721  27.270
  200   2H5*    A  19          H5**        A  19   4.152 -16.292  26.317
  201    H4*    A  19           H4*        A  19   4.372 -18.385  25.073
  202    H3*    A  19           H3*        A  19   2.306 -16.481  23.915
  203    H2*    A  19           H2*        A  19   2.278 -18.046  22.098
  204   2HO*    A  19          2HO*        A  19   4.740 -18.509  22.626
  205    H1*    A  19           H1*        A  19   2.060 -20.259  23.715
  206    H8     A  19           H8         A  19   0.112 -17.422  25.211
  207   1H6     A  19          H62         A  19  -4.314 -18.750  21.054
  208   2H6     A  19          H61         A  19  -3.952 -17.807  22.499
  209    H2     A  19           H2         A  19  -0.702 -21.081  20.003
  210   1H5*    U  20          H5*         U  20   4.159 -17.295  20.471
  211   2H5*    U  20          H5**        U  20   4.015 -15.864  19.457
  212    H4*    U  20           H4*        U  20   2.706 -18.101  19.010
  213    H3*    U  20           H3*        U  20   1.739 -15.391  18.237
  214    H2*    U  20           H2*        U  20  -0.214 -16.433  17.408
  215   2HO*    U  20          2HO*        U  20  -0.145 -18.448  16.699
  216    H1*    U  20           H1*        U  20  -0.669 -18.040  19.609
  217    H3     U  20           H3         U  20  -3.603 -14.549  19.631
  218    H5     U  20           H5         U  20  -0.036 -13.114  21.390
  219    H6     U  20           H6         U  20   0.992 -15.111  20.750
  220   1H5*    G  21          H5*         G  21   1.451 -18.455  15.158
  221   2H5*    G  21          H5**        G  21   1.496 -17.727  13.551
  222    H4*    G  21           H4*        G  21  -0.469 -19.160  13.977
  223    H3*    G  21           H3*        G  21  -0.951 -16.302  13.136
  224    H2*    G  21           H2*        G  21  -3.272 -16.936  12.995
  225   2HO*    G  21          2HO*        G  21  -2.465 -19.268  12.376
  226    H1*    G  21           H1*        G  21  -3.297 -18.211  15.458
  227    H8     G  21           H8         G  21  -0.994 -15.194  15.522
  228    H1     G  21           H1         G  21  -7.139 -13.819  16.732
  229   1H2     G  21          H22         G  21  -8.390 -15.538  16.342
  230   2H2     G  21          H21         G  21  -7.725 -17.060  15.766
  231   1H5*    C  22          H5*         C  22  -2.942 -18.269  10.608
  232   2H5*    C  22          H5**        C  22  -2.634 -17.860   8.918
  233    H4*    C  22           H4*        C  22  -4.922 -17.605   9.295
  234    H3*    C  22           H3*        C  22  -3.664 -14.867   9.118
  235    H2*    C  22           H2*        C  22  -5.937 -14.101   9.080
  236   2HO*    C  22          2HO*        C  22  -7.138 -15.501   7.905
  237    H1*    C  22           H1*        C  22  -6.757 -15.943  11.072
  238   1H4     C  22          H42         C  22  -6.126 -10.277  14.048
  239   2H4     C  22          H41         C  22  -4.497 -10.780  14.444
  240    H5     C  22           H5         C  22  -3.426 -12.716  13.633
  241    H6     C  22           H6         C  22  -3.658 -14.690  12.222
  242   1H5*    A  23          H5*         A  23  -5.750 -16.241   5.343
  243   2H5*    A  23          H5**        A  23  -5.846 -15.073   4.026
  244    H4*    A  23           H4*        A  23  -7.930 -15.827   5.419
  245    H3*    A  23           H3*        A  23  -7.604 -13.632   3.727
  246    H2*    A  23           H2*        A  23  -7.836 -11.920   5.254
  247   2HO*    A  23          2HO*        A  23 -10.095 -11.811   6.179
  248    H1*    A  23           H1*        A  23  -9.260 -13.623   7.325
  249    H8     A  23           H8         A  23  -5.681 -12.270   7.440
  250   1H6     A  23          H61         A  23  -8.174  -7.931  11.184
  251   2H6     A  23          H62         A  23  -6.633  -8.385  10.580
  252    H2     A  23           H2         A  23 -11.400 -10.282   9.564
  253   1H5*    A  24          H5*         A  24 -12.455 -13.954   3.708
  254   2H5*    A  24          H5**        A  24 -12.677 -13.724   1.966
  255    H4*    A  24           H4*        A  24 -14.084 -12.200   3.193
  256    H3*    A  24           H3*        A  24 -11.857 -10.888   1.649
  257    H2*    A  24           H2*        A  24 -12.675  -8.774   2.442
  258   2HO*    A  24          2HO*        A  24 -14.982  -9.875   2.143
  259    H1*    A  24           H1*        A  24 -13.438  -9.727   5.009
  260    H8     A  24           H8         A  24  -9.964 -10.551   3.712
  261   1H6     A  24          H61         A  24  -8.155  -5.542   6.945
  262   2H6     A  24          H62         A  24  -7.559  -6.918   6.010
  263    H2     A  24           H2         A  24 -12.550  -5.729   7.048
  264   1H5*    U  25          H5*         U  25 -13.958  -7.844   0.455
  265   2H5*    U  25          H5**        U  25 -13.562  -7.691  -1.255
  266    H4*    U  25           H4*        U  25 -12.762  -5.805   0.008
  267    H3*    U  25           H3*        U  25 -10.511  -7.402  -1.221
  268    H2*    U  25           H2*        U  25  -9.088  -5.679  -0.422
  269   2HO*    U  25          2HO*        U  25  -9.820  -3.677  -0.069
  270    H1*    U  25           H1*        U  25 -10.307  -5.503   2.093
  271    H3     U  25           H3         U  25  -6.199  -7.325   2.814
  272    H5     U  25           H5         U  25  -8.568 -10.517   1.475
  273    H6     U  25           H6         U  25 -10.286  -8.915   0.959
  274   1H5*    C  26          H5*         C  26 -10.441  -3.281  -2.220
  275   2H5*    C  26          H5**        C  26 -10.023  -3.045  -3.919
  276    H4*    C  26           H4*        C  26  -8.703  -1.619  -2.490
  277    H3*    C  26           H3*        C  26  -7.075  -3.757  -3.878
  278    H2*    C  26           H2*        C  26  -5.198  -2.428  -3.137
  279   2HO*    C  26          2HO*        C  26  -6.429  -0.338  -3.340
  280    H1*    C  26           H1*        C  26  -6.228  -2.285  -0.521
  281   1H4     C  26          H42         C  26  -2.315  -7.261  -0.817
  282   2H4     C  26          H41         C  26  -3.665  -8.339  -1.131
  283    H5     C  26           H5         C  26  -5.911  -7.487  -1.520
  284    H6     C  26           H6         C  26  -7.258  -5.468  -1.691
  285   1H5*    C  27          H5*         C  27  -6.608   0.658  -4.970
  286   2H5*    C  27          H5**        C  27  -6.932   0.537  -6.708
  287    H4*    C  27           H4*        C  27  -5.443   2.347  -6.341
  288    H3*    C  27           H3*        C  27  -4.223  -0.017  -7.751
  289    H2*    C  27           H2*        C  27  -2.184   1.186  -7.888
  290   2HO*    C  27          2HO*        C  27  -3.580   3.229  -8.265
  291    H1*    C  27           H1*        C  27  -2.330   2.325  -5.313
  292   1H4     C  27          H41         C  27   1.595  -2.536  -4.491
  293   2H4     C  27          H42         C  27   0.250  -3.628  -4.187
  294    H5     C  27           H5         C  27  -2.050  -2.921  -4.456
  295    H6     C  27           H6         C  27  -3.485  -1.057  -5.074
  296   1H5*    A  28          H5*         A  28  -3.236   3.051 -10.370
  297   2H5*    A  28          H5**        A  28  -4.460   2.902 -11.642
  298    H4*    A  28           H4*        A  28  -2.427   3.398 -12.703
  299    H3*    A  28           H3*        A  28  -3.102   0.473 -13.075
  300    H2*    A  28           H2*        A  28  -1.257   0.411 -14.563
  301   2HO*    A  28          2HO*        A  28  -1.496   2.415 -15.655
  302    H1*    A  28           H1*        A  28   0.369   2.040 -12.911
  303    H8     A  28           H8         A  28  -1.014  -0.369 -10.526
  304   1H6     A  28          H62         A  28   2.992  -4.562 -12.786
  305   2H6     A  28          H61         A  28   1.879  -4.219 -11.463
  306    H2     A  28           H2         A  28   2.899  -1.139 -15.569
  307   1H5*    G  29          H5*         G  29  -4.192   3.278 -17.235
  308   2H5*    G  29          H5**        G  29  -3.517   2.320 -18.547
  309    H4*    G  29           H4*        G  29  -2.274   4.439 -16.906
  310    H3*    G  29           H3*        G  29  -3.044   4.696 -19.409
  311    H2*    G  29           H2*        G  29  -1.874   2.646 -20.084
  312   2HO*    G  29          2HO*        G  29   0.110   3.514 -21.210
  313    H1*    G  29           H1*        G  29   0.566   3.871 -18.685
  314    H8     G  29           H8         G  29   0.272   0.771 -17.203
  315    H1     G  29           H1         G  29   2.835  -0.126 -23.014
  316   1H2     G  29          H22         G  29   2.487   1.645 -24.264
  317   2H2     G  29          H21         G  29   1.623   3.042 -23.649
  318   1H5*    U  30          H5*         U  30   0.414   7.543 -21.530
  319   2H5*    U  30          H5**        U  30  -0.025   8.667 -20.237
  320    H4*    U  30           H4*        U  30  -0.896   8.646 -23.106
  321    H3*    U  30           H3*        U  30   1.206  10.070 -22.342
  322    H2*    U  30           H2*        U  30  -0.085  10.979 -20.399
  323   2HO*    U  30          2HO*        U  30   0.690  12.663 -22.417
  324    H1*    U  30           H1*        U  30  -2.073  11.644 -22.653
  325    H3     U  30           H3         U  30  -4.704  14.318 -20.127
  326    H5     U  30           H5         U  30  -3.742  11.218 -17.487
  327    H6     U  30           H6         U  30  -2.319  10.303 -19.200
  328   1H5*    G  31          H5*         G  31   0.299  14.048 -24.099
  329   2H5*    G  31          H5**        G  31   1.590  14.071 -25.318
  330    H4*    G  31           H4*        G  31   1.837  15.925 -23.767
  331    H3*    G  31           H3*        G  31   3.995  13.825 -23.700
  332    H2*    G  31           H2*        G  31   5.094  15.020 -22.037
  333   2HO*    G  31          2HO*        G  31   5.018  17.152 -21.986
  334    H1*    G  31           H1*        G  31   2.782  15.806 -20.626
  335    H8     G  31           H8         G  31   3.248  12.165 -21.847
  336    H1     G  31           H1         G  31   5.359  13.467 -15.942
  337   1H2     G  31          H21         G  31   5.245  15.294 -15.493
  338   2H2     G  31          H22         G  31   4.697  16.645 -16.337
  339   1H5*    G  32          H5*         G  32   5.853  17.432 -24.064
  340   2H5*    G  32          H5**        G  32   7.300  17.334 -25.073
  341    H4*    G  32           H4*        G  32   7.825  18.134 -22.853
  342    H3*    G  32           H3*        G  32   9.012  15.409 -23.431
  343    H2*    G  32           H2*        G  32  10.247  15.843 -21.410
  344   2HO*    G  32          2HO*        G  32  10.510  18.163 -21.741
  345    H1*    G  32           H1*        G  32   7.994  16.652 -20.018
  346    H8     G  32           H8         G  32   7.236  13.770 -22.362
  347    H1     G  32           H1         G  32  10.075  12.050 -16.885
  348   1H2     G  32          H21         G  32  10.684  13.491 -15.875
  349   2H2     G  32          H22         G  32  10.608  15.162 -16.091
  350   1H5*    U  33          H5*         U  33  12.831  18.103 -24.616
  351   2H5*    U  33          H5**        U  33  14.063  16.872 -24.591
  352    H4*    U  33           H4*        U  33  13.497  18.563 -22.570
  353    H3*    U  33           H3*        U  33  15.066  16.001 -22.592
  354    H2*    U  33           H2*        U  33  15.091  16.120 -20.165
  355   2HO*    U  33          2HO*        U  33  14.951  18.705 -20.611
  356    H1*    U  33           H1*        U  33  12.433  16.744 -19.825
  357    H3     U  33           H3         U  33  13.332  12.240 -18.862
  358    H5     U  33           H5         U  33  11.440  12.453 -22.620
  359    H6     U  33           H6         U  33  11.808  14.795 -22.578
  360   1H5*    C  34          H5*         C  34  17.625  18.973 -20.780
  361   2H5*    C  34          H5**        C  34  19.275  18.946 -21.427
  362    H4*    C  34           H4*        C  34  19.283  18.558 -19.036
  363    H3*    C  34           H3*        C  34  20.197  16.219 -20.710
  364    H2*    C  34           H2*        C  34  20.560  15.017 -18.667
  365   2HO*    C  34          2HO*        C  34  20.983  17.356 -17.632
  366    H1*    C  34           H1*        C  34  18.120  15.676 -17.537
  367   1H4     C  34          H41         C  34  17.352  10.329 -20.686
  368   2H4     C  34          H42         C  34  16.362  10.959 -21.913
  369    H5     C  34           H5         C  34  16.222  13.683 -22.007
  370    H6     C  34           H6         C  34  16.974  15.621 -20.787
  371   1H5*    C  35          H5*         C  35  23.308  15.681 -17.487
  372   2H5*    C  35          H5**        C  35  24.576  16.467 -18.446
  373    H4*    C  35           H4*        C  35  25.322  14.346 -17.516
  374    H3*    C  35           H3*        C  35  25.153  14.411 -20.537
  375    H2*    C  35           H2*        C  35  26.215  12.272 -20.475
  376   2HO*    C  35          2HO*        C  35  27.389  11.663 -18.734
  377    H1*    C  35           H1*        C  35  24.496  11.280 -18.503
  378   1H4     C  35          H42         C  35  21.843   9.746 -24.062
  379   2H4     C  35          H41         C  35  21.014  11.293 -24.110
  380    H5     C  35           H5         C  35  21.397  13.021 -22.493
  381    H6     C  35           H6         C  35  22.637  13.628 -20.507
  382    H3T    C  35           H3T        C  35  27.380  14.478 -18.856
  Start of MODEL    2
    1   1H5*    G   1          H5*         G   1   7.318  -3.880 -17.020
    2   2H5*    G   1          H5**        G   1   6.369  -3.015 -15.817
    3    H4*    G   1           H4*        G   1   8.369  -3.727 -14.854
    4    H3*    G   1           H3*        G   1   7.629  -1.066 -14.642
    5    H2*    G   1           H2*        G   1   9.431  -0.011 -15.591
    6   2HO*    G   1          2HO*        G   1  10.029  -0.296 -13.159
    7    H1*    G   1           H1*        G   1  11.387  -2.301 -15.312
    8    H8     G   1           H8         G   1   9.325  -0.954 -18.250
    9    H1     G   1           H1         G   1  15.609   0.267 -18.580
   10   1H2     G   1          H22         G   1  16.630  -0.387 -16.814
   11   2H2     G   1          H21         G   1  15.754  -1.142 -15.484
   12    H5T    G   1           H5T        G   1   6.783  -1.107 -16.864
   13   1H5*    G   2          H5*         G   2   9.902  -1.352 -10.468
   14   2H5*    G   2          H5**        G   2   8.797  -0.360  -9.512
   15    H4*    G   2           H4*        G   2  11.185   0.382  -9.593
   16    H3*    G   2           H3*        G   2   9.088   2.428 -10.364
   17    H2*    G   2           H2*        G   2  10.934   3.956 -10.466
   18   2HO*    G   2          2HO*        G   2  11.903   2.535  -8.532
   19    H1*    G   2           H1*        G   2  12.698   2.061 -11.636
   20    H8     G   2           H8         G   2   9.246   2.262 -13.232
   21    H1     G   2           H1         G   2  13.627   6.375 -15.512
   22   1H2     G   2          H22         G   2  15.421   6.340 -14.292
   23   2H2     G   2          H21         G   2  15.495   5.301 -12.879
   24   1H5*    A   3          H5*         A   3  11.519   4.026  -7.031
   25   2H5*    A   3          H5**        A   3  10.525   5.225  -6.197
   26    H4*    A   3           H4*        A   3  12.701   6.039  -7.154
   27    H3*    A   3           H3*        A   3  10.177   7.504  -7.979
   28    H2*    A   3           H2*        A   3  11.696   9.062  -8.999
   29   2HO*    A   3          2HO*        A   3  13.299   8.497  -7.087
   30    H1*    A   3           H1*        A   3  13.341   7.046 -10.064
   31    H8     A   3           H8         A   3   9.781   6.003 -10.591
   32   1H6     A   3          H61         A   3   9.936   9.842 -15.526
   33   2H6     A   3          H62         A   3   8.939   8.598 -14.923
   34    H2     A   3           H2         A   3  13.487  10.559 -13.194
   35   1H5*    C   4          H5*         C   4  12.811  10.515  -6.229
   36   2H5*    C   4          H5**        C   4  11.752  11.689  -5.432
   37    H4*    C   4           H4*        C   4  13.287  12.612  -7.182
   38    H3*    C   4           H3*        C   4  10.326  13.175  -7.369
   39    H2*    C   4           H2*        C   4  10.843  14.501  -9.294
   40   2HO*    C   4          2HO*        C   4  13.016  15.048  -8.050
   41    H1*    C   4           H1*        C   4  12.739  12.709 -10.367
   42   1H4     C   4          H41         C   4   7.450  11.847 -13.591
   43   2H4     C   4          H42         C   4   6.837  10.543 -12.734
   44    H5     C   4           H5         C   4   8.134  10.016 -10.408
   45    H6     C   4           H6         C   4  10.083  10.685  -9.106
   46   1H5*    C   5          H5*         C   5  11.482  16.927  -8.067
   47   2H5*    C   5          H5**        C   5  10.739  17.929  -6.810
   48    H4*    C   5           H4*        C   5  10.116  18.805  -8.899
   49    H3*    C   5           H3*        C   5   7.766  17.463  -7.559
   50    H2*    C   5           H2*        C   5   6.455  18.232  -9.399
   51   2HO*    C   5          2HO*        C   5   8.087  20.272  -9.293
   52    H1*    C   5           H1*        C   5   8.567  17.901 -11.321
   53   1H4     C   5          H42         C   5   4.596  13.139 -12.842
   54   2H4     C   5          H41         C   5   5.106  12.301 -11.400
   55    H5     C   5           H5         C   5   6.572  13.161  -9.747
   56    H6     C   5           H6         C   5   7.932  15.080  -9.080
   57   1H5*    C   6          H5*         C   6   5.608  20.195  -8.404
   58   2H5*    C   6          H5**        C   6   5.578  21.297  -7.020
   59    H4*    C   6           H4*        C   6   3.432  21.119  -6.852
   60    H3*    C   6           H3*        C   6   3.654  18.102  -6.672
   61    H2*    C   6           H2*        C   6   1.229  18.244  -6.549
   62   2HO*    C   6          2HO*        C   6   1.368  20.357  -5.340
   63    H1*    C   6           H1*        C   6   1.233  20.088  -8.707
   64   1H4     C   6          H41         C   6   0.095  14.554 -11.532
   65   2H4     C   6          H42         C   6   1.818  14.208 -11.636
   66    H5     C   6           H5         C   6   3.473  15.623 -10.604
   67    H6     C   6           H6         C   6   3.818  17.646  -9.269
   68   1H5*    G   7          H5*         G   7   1.951  19.755  -2.357
   69   2H5*    G   7          H5**        G   7   1.867  18.206  -1.503
   70    H4*    G   7           H4*        G   7  -0.205  19.124  -1.232
   71    H3*    G   7           H3*        G   7  -0.414  17.106  -3.456
   72    H2*    G   7           H2*        G   7  -2.754  17.651  -3.545
   73   2HO*    G   7          2HO*        G   7  -2.500  17.796  -0.987
   74    H1*    G   7           H1*        G   7  -2.330  20.378  -2.789
   75    H8     G   7           H8         G   7  -0.881  18.585  -5.913
   76    H1     G   7           H1         G   7  -5.894  22.470  -6.834
   77   1H2     G   7          H22         G   7  -6.611  23.249  -4.894
   78   2H2     G   7          H21         G   7  -5.824  22.781  -3.397
   79   1H5*    C   8          H5*         C   8  -4.639  15.310  -1.308
   80   2H5*    C   8          H5**        C   8  -3.502  16.061  -0.229
   81    H4*    C   8           H4*        C   8  -3.983  13.096  -0.429
   82    H3*    C   8           H3*        C   8  -5.052  15.244   1.399
   83    H2*    C   8           H2*        C   8  -5.009  13.722   3.182
   84   2HO*    C   8          2HO*        C   8  -5.610  11.780   1.985
   85    H1*    C   8           H1*        C   8  -2.421  12.815   2.649
   86   1H4     C   8          H41         C   8  -1.599  17.648   6.627
   87   2H4     C   8          H42         C   8  -1.572  18.798   5.292
   88    H5     C   8           H5         C   8  -2.039  18.129   3.019
   89    H6     C   8           H6         C   8  -2.619  16.236   1.596
   90   1H5*    C   9          H5*         C   9  -7.786  11.198   0.507
   91   2H5*    C   9          H5**        C   9  -9.317  11.625   1.282
   92    H4*    C   9           H4*        C   9  -8.625   9.306   1.702
   93    H3*    C   9           H3*        C   9  -8.915  11.056   4.155
   94    H2*    C   9           H2*        C   9  -8.488   9.037   5.401
   95   2HO*    C   9          2HO*        C   9  -9.747   7.635   4.003
   96    H1*    C   9           H1*        C   9  -6.450   8.139   3.684
   97   1H4     C   9          H42         C   9  -3.190  10.790   8.383
   98   2H4     C   9          H41         C   9  -3.555  12.414   7.806
   99    H5     C   9           H5         C   9  -5.020  12.812   5.971
  100    H6     C   9           H6         C   9  -6.456  11.746   4.279
  101   1H5*    A  10          H5*         A  10 -12.224   7.300   3.123
  102   2H5*    A  10          H5**        A  10 -13.140   7.225   4.630
  103    H4*    A  10           H4*        A  10 -12.574   5.034   4.065
  104    H3*    A  10           H3*        A  10 -10.812   5.871   6.368
  105    H2*    A  10           H2*        A  10  -9.938   3.669   6.291
  106   2HO*    A  10          2HO*        A  10 -11.876   2.511   6.107
  107    H1*    A  10           H1*        A  10 -10.196   3.416   3.472
  108    H8     A  10           H8         A  10  -8.123   6.084   5.462
  109   1H6     A  10          H62         A  10  -3.328   2.621   3.569
  110   2H6     A  10          H61         A  10  -3.768   4.078   4.453
  111    H2     A  10           H2         A  10  -7.048   0.684   2.154
  112   1H5*    C  11          H5*         C  11 -13.632   2.031   6.632
  113   2H5*    C  11          H5**        C  11 -13.853   1.767   8.366
  114    H4*    C  11           H4*        C  11 -13.181  -0.236   6.931
  115    H3*    C  11           H3*        C  11 -11.734   0.411   9.493
  116    H2*    C  11           H2*        C  11 -10.550  -1.645   9.147
  117   2HO*    C  11          2HO*        C  11 -11.970  -3.107   8.254
  118    H1*    C  11           H1*        C  11 -10.066  -1.141   6.421
  119   1H4     C  11          H42         C  11  -4.906   0.953   9.414
  120   2H4     C  11          H41         C  11  -5.644   2.534   9.668
  121    H5     C  11           H5         C  11  -7.968   2.969   9.083
  122    H6     C  11           H6         C  11  -9.979   1.959   8.186
  123   1H5*    U  12          H5*         U  12 -14.098  -3.463   8.678
  124   2H5*    U  12          H5**        U  12 -14.688  -4.044  10.241
  125    H4*    U  12           H4*        U  12 -13.855  -5.827   8.741
  126    H3*    U  12           H3*        U  12 -12.526  -5.561  11.436
  127    H2*    U  12           H2*        U  12 -11.312  -7.519  10.853
  128   2HO*    U  12          2HO*        U  12 -12.416  -8.990   9.760
  129    H1*    U  12           H1*        U  12 -11.028  -6.797   8.107
  130    H3     U  12           H3         U  12  -6.886  -7.348  10.134
  131    H5     U  12           H5         U  12  -7.892  -3.278  10.444
  132    H6     U  12           H6         U  12 -10.103  -3.848   9.729
  133   1H5*    G  13          H5*         G  13 -14.552  -9.466  10.714
  134   2H5*    G  13          H5**        G  13 -14.918 -10.273  12.242
  135    H4*    G  13           H4*        G  13 -13.573 -11.595  10.608
  136    H3*    G  13           H3*        G  13 -12.481 -11.241  13.406
  137    H2*    G  13           H2*        G  13 -10.701 -12.689  12.717
  138   2HO*    G  13          2HO*        G  13 -12.484 -13.831  11.274
  139    H1*    G  13           H1*        G  13 -10.357 -11.500  10.198
  140    H8     G  13           H8         G  13 -10.996  -9.098  13.115
  141    H1     G  13           H1         G  13  -4.837 -10.481  12.007
  142   1H2     G  13          H21         G  13  -4.592 -11.810  10.710
  143   2H2     G  13          H22         G  13  -5.663 -12.724   9.794
  144   1H5*    C  14          H5*         C  14 -12.654 -15.828  13.219
  145   2H5*    C  14          H5**        C  14 -13.384 -16.117  14.805
  146    H4*    C  14           H4*        C  14 -11.253 -17.337  14.386
  147    H3*    C  14           H3*        C  14 -11.432 -15.566  16.821
  148    H2*    C  14           H2*        C  14  -9.222 -16.284  17.348
  149   2HO*    C  14          2HO*        C  14  -8.803 -18.346  16.910
  150    H1*    C  14           H1*        C  14  -8.309 -16.311  14.656
  151   1H4     C  14          H42         C  14  -5.704 -11.086  16.951
  152   2H4     C  14          H41         C  14  -7.183 -10.151  16.737
  153    H5     C  14           H5         C  14  -9.271 -11.221  16.011
  154    H6     C  14           H6         C  14 -10.273 -13.367  15.380
  155   1H5*    A  15          H5*         A  15 -10.499 -19.972  17.307
  156   2H5*    A  15          H5**        A  15 -10.833 -20.525  18.956
  157    H4*    A  15           H4*        A  15  -8.537 -21.024  18.084
  158    H3*    A  15           H3*        A  15  -8.827 -19.550  20.703
  159    H2*    A  15           H2*        A  15  -6.456 -19.516  20.816
  160   2HO*    A  15          2HO*        A  15  -6.598 -21.875  19.869
  161    H1*    A  15           H1*        A  15  -6.025 -19.278  18.004
  162    H8     A  15           H8         A  15  -8.287 -16.790  19.936
  163   1H6     A  15          H61         A  15  -3.195 -13.152  19.672
  164   2H6     A  15          H62         A  15  -4.797 -13.060  20.243
  165    H2     A  15           H2         A  15  -2.140 -17.016  18.067
  166   1H5*    G  16          H5*         G  16  -6.645 -22.759  22.260
  167   2H5*    G  16          H5**        G  16  -7.201 -22.891  23.927
  168    H4*    G  16           H4*        G  16  -4.927 -22.230  23.841
  169    H3*    G  16           H3*        G  16  -6.599 -19.896  24.818
  170    H2*    G  16           H2*        G  16  -4.404 -19.104  25.579
  171   2HO*    G  16          2HO*        G  16  -3.594 -21.604  25.261
  172    H1*    G  16           H1*        G  16  -3.595 -19.221  22.930
  173    H8     G  16           H8         G  16  -7.346 -19.053  23.077
  174    H1     G  16           H1         G  16  -4.531 -13.304  23.442
  175   1H2     G  16          H22         G  16  -2.421 -13.524  23.695
  176   2H2     G  16          H21         G  16  -1.653 -15.100  23.788
  177   1H5*    A  17          H5*         A  17  -5.357 -17.853  28.215
  178   2H5*    A  17          H5**        A  17  -4.651 -19.276  27.486
  179    H4*    A  17           H4*        A  17  -6.264 -19.670  29.934
  180    H3*    A  17           H3*        A  17  -3.823 -18.068  29.688
  181    H2*    A  17           H2*        A  17  -2.396 -19.433  30.856
  182   2HO*    A  17          2HO*        A  17  -3.886 -19.424  32.740
  183    H1*    A  17           H1*        A  17  -3.853 -21.912  30.501
  184    H8     A  17           H8         A  17  -3.170 -20.978  27.140
  185   1H6     A  17          H62         A  17   2.493 -23.482  27.820
  186   2H6     A  17          H61         A  17   1.335 -22.892  26.631
  187    H2     A  17           H2         A  17   0.737 -22.974  31.835
  188   1H5*    G  18          H5*         G  18  -3.847 -14.283  29.705
  189   2H5*    G  18          H5**        G  18  -4.060 -15.961  29.220
  190    H4*    G  18           H4*        G  18  -2.053 -15.332  31.322
  191    H3*    G  18           H3*        G  18  -1.383 -14.941  28.395
  192    H2*    G  18           H2*        G  18   0.790 -15.647  29.076
  193   2HO*    G  18          2HO*        G  18   0.242 -14.461  31.322
  194    H1*    G  18           H1*        G  18  -0.317 -17.663  30.818
  195    H8     G  18           H8         G  18  -1.896 -17.718  27.458
  196    H1     G  18           H1         G  18   3.815 -20.644  27.632
  197   1H2     G  18          H21         G  18   4.836 -20.195  29.541
  198   2H2     G  18          H22         G  18   4.071 -19.168  30.739
  199   1H5*    A  19          H5*         A  19   1.817 -13.248  29.528
  200   2H5*    A  19          H5**        A  19   2.131 -11.796  28.567
  201    H4*    A  19           H4*        A  19   3.853 -13.432  28.199
  202    H3*    A  19           H3*        A  19   2.139 -12.945  25.755
  203    H2*    A  19           H2*        A  19   3.643 -14.421  24.609
  204   2HO*    A  19          2HO*        A  19   5.443 -13.558  26.201
  205    H1*    A  19           H1*        A  19   3.609 -16.372  26.552
  206    H8     A  19           H8         A  19   0.234 -14.645  26.318
  207   1H6     A  19          H62         A  19  -1.219 -18.818  21.988
  208   2H6     A  19          H61         A  19  -1.855 -17.526  22.998
  209    H2     A  19           H2         A  19   3.103 -19.251  22.895
  210   1H5*    U  20          H5*         U  20   5.082 -12.528  23.713
  211   2H5*    U  20          H5**        U  20   4.846 -11.311  22.464
  212    H4*    U  20           H4*        U  20   4.888 -13.771  21.868
  213    H3*    U  20           H3*        U  20   2.885 -11.976  20.548
  214    H2*    U  20           H2*        U  20   2.321 -13.953  19.260
  215   2HO*    U  20          2HO*        U  20   4.712 -14.698  19.511
  216    H1*    U  20           H1*        U  20   2.064 -15.591  21.460
  217    H3     U  20           H3         U  20  -2.157 -14.323  20.245
  218    H5     U  20           H5         U  20  -0.691 -11.303  22.818
  219    H6     U  20           H6         U  20   1.391 -12.320  22.697
  220   1H5*    G  21          H5*         G  21   4.794 -14.297  17.475
  221   2H5*    G  21          H5**        G  21   5.247 -13.137  16.220
  222    H4*    G  21           H4*        G  21   4.014 -15.031  15.326
  223    H3*    G  21           H3*        G  21   2.776 -12.311  14.981
  224    H2*    G  21           H2*        G  21   1.006 -13.363  13.774
  225   2HO*    G  21          2HO*        G  21   2.843 -15.053  13.042
  226    H1*    G  21           H1*        G  21   0.713 -15.529  15.489
  227    H8     G  21           H8         G  21   1.364 -12.168  17.197
  228    H1     G  21           H1         G  21  -4.789 -13.510  16.049
  229   1H2     G  21          H22         G  21  -4.959 -15.310  14.864
  230   2H2     G  21          H21         G  21  -3.543 -16.197  14.314
  231   1H5*    C  22          H5*         C  22   3.135 -14.566  11.102
  232   2H5*    C  22          H5**        C  22   3.664 -13.359   9.918
  233    H4*    C  22           H4*        C  22   1.730 -14.760   9.201
  234    H3*    C  22           H3*        C  22   1.468 -11.760   9.199
  235    H2*    C  22           H2*        C  22  -0.704 -12.048   8.336
  236   2HO*    C  22          2HO*        C  22  -0.914 -13.654   6.932
  237    H1*    C  22           H1*        C  22  -1.409 -14.215   9.991
  238   1H4     C  22          H42         C  22  -3.892  -8.938  12.725
  239   2H4     C  22          H41         C  22  -2.370  -8.786  13.565
  240    H5     C  22           H5         C  22  -0.466 -10.092  13.209
  241    H6     C  22           H6         C  22   0.492 -11.914  11.939
  242   1H5*    A  23          H5*         A  23   0.787 -13.377   5.219
  243   2H5*    A  23          H5**        A  23   0.882 -12.147   3.960
  244    H4*    A  23           H4*        A  23  -1.324 -13.351   4.440
  245    H3*    A  23           H3*        A  23  -0.967 -10.916   3.205
  246    H2*    A  23           H2*        A  23  -1.893  -9.498   4.829
  247   2HO*    A  23          2HO*        A  23  -3.832 -10.282   3.280
  248    H1*    A  23           H1*        A  23  -3.616 -11.641   6.080
  249    H8     A  23           H8         A  23  -0.469  -9.868   7.432
  250   1H6     A  23          H62         A  23  -4.505  -6.649  10.902
  251   2H6     A  23          H61         A  23  -2.790  -6.941  10.616
  252    H2     A  23           H2         A  23  -6.807  -9.211   8.116
  253   1H5*    A  24          H5*         A  24  -5.532 -11.707   2.611
  254   2H5*    A  24          H5**        A  24  -5.624 -11.559   0.851
  255    H4*    A  24           H4*        A  24  -7.379 -10.326   1.878
  256    H3*    A  24           H3*        A  24  -5.381  -8.543   0.482
  257    H2*    A  24           H2*        A  24  -6.851  -6.755   1.006
  258   2HO*    A  24          2HO*        A  24  -8.719  -8.386   0.504
  259    H1*    A  24           H1*        A  24  -7.596  -7.819   3.543
  260    H8     A  24           H8         A  24  -3.855  -7.611   3.077
  261   1H6     A  24          H61         A  24  -4.449  -1.833   5.335
  262   2H6     A  24          H62         A  24  -3.259  -3.054   4.887
  263    H2     A  24           H2         A  24  -8.477  -3.423   4.588
  264   1H5*    U  25          H5*         U  25  -9.010  -7.683  -1.508
  265   2H5*    U  25          H5**        U  25  -8.688  -7.497  -3.238
  266    H4*    U  25           H4*        U  25  -9.693  -5.490  -2.243
  267    H3*    U  25           H3*        U  25  -6.920  -5.145  -3.387
  268    H2*    U  25           H2*        U  25  -7.146  -2.836  -2.863
  269   2HO*    U  25          2HO*        U  25  -9.112  -1.977  -3.004
  270    H1*    U  25           H1*        U  25  -8.358  -3.273  -0.353
  271    H3     U  25           H3         U  25  -4.317  -1.376   0.538
  272    H5     U  25           H5         U  25  -3.473  -5.411  -0.176
  273    H6     U  25           H6         U  25  -5.745  -5.686  -0.909
  274   1H5*    C  26          H5*         C  26 -10.120  -2.636  -4.860
  275   2H5*    C  26          H5**        C  26  -9.922  -2.138  -6.540
  276    H4*    C  26           H4*        C  26 -10.401  -0.319  -4.869
  277    H3*    C  26           H3*        C  26  -8.098  -0.067  -6.795
  278    H2*    C  26           H2*        C  26  -7.755   2.119  -5.863
  279   2HO*    C  26          2HO*        C  26 -10.291   2.187  -5.643
  280    H1*    C  26           H1*        C  26  -8.328   1.348  -3.191
  281   1H4     C  26          H42         C  26  -2.028   1.834  -3.498
  282   2H4     C  26          H41         C  26  -1.892   0.082  -3.620
  283    H5     C  26           H5         C  26  -3.876  -1.327  -3.894
  284    H6     C  26           H6         C  26  -6.284  -1.302  -4.124
  285   1H5*    C  27          H5*         C  27 -11.165   3.298  -7.708
  286   2H5*    C  27          H5**        C  27 -11.626   2.754  -9.335
  287    H4*    C  27           H4*        C  27 -11.413   5.059  -9.518
  288    H3*    C  27           H3*        C  27  -8.958   3.701 -10.669
  289    H2*    C  27           H2*        C  27  -8.147   5.908 -11.129
  290   2HO*    C  27          2HO*        C  27 -10.488   6.435 -11.830
  291    H1*    C  27           H1*        C  27  -9.263   7.150  -8.830
  292   1H4     C  27          H41         C  27  -3.121   6.988  -7.463
  293   2H4     C  27          H42         C  27  -3.105   5.234  -7.352
  294    H5     C  27           H5         C  27  -5.064   3.902  -7.852
  295    H6     C  27           H6         C  27  -7.413   3.998  -8.547
  296   1H5*    A  28          H5*         A  28  -7.278   4.277 -14.246
  297   2H5*    A  28          H5**        A  28  -8.084   5.266 -13.044
  298    H4*    A  28           H4*        A  28  -9.528   4.403 -15.526
  299    H3*    A  28           H3*        A  28  -7.630   6.742 -15.217
  300    H2*    A  28           H2*        A  28  -9.094   7.944 -16.668
  301   2HO*    A  28          2HO*        A  28  -9.592   5.560 -17.676
  302    H1*    A  28           H1*        A  28 -11.438   7.003 -15.405
  303    H8     A  28           H8         A  28  -8.589   7.876 -13.024
  304   1H6     A  28          H62         A  28 -11.240  13.465 -12.664
  305   2H6     A  28          H61         A  28  -9.983  12.422 -12.004
  306    H2     A  28           H2         A  28 -13.323  11.184 -15.846
  307   1H5*    G  29          H5*         G  29  -8.029   6.846 -19.114
  308   2H5*    G  29          H5**        G  29  -6.748   5.817 -19.764
  309    H4*    G  29           H4*        G  29  -5.810   7.403 -20.980
  310    H3*    G  29           H3*        G  29  -5.541   9.168 -19.007
  311    H2*    G  29           H2*        G  29  -8.002   9.593 -19.027
  312   2HO*    G  29          2HO*        G  29  -7.719  11.729 -20.646
  313    H1*    G  29           H1*        G  29  -7.450   9.930 -22.030
  314    H8     G  29           H8         G  29 -10.391   8.414 -19.995
  315    H1     G  29           H1         G  29 -11.971  13.148 -24.018
  316   1H2     G  29          H22         G  29 -10.159  14.003 -24.938
  317   2H2     G  29          H21         G  29  -8.570  13.379 -24.533
  318   1H5*    U  30          H5*         U  30  -5.381  12.993 -21.729
  319   2H5*    U  30          H5**        U  30  -4.157  12.048 -22.585
  320    H4*    U  30           H4*        U  30  -3.512  14.252 -22.788
  321    H3*    U  30           H3*        U  30  -1.709  12.585 -21.466
  322    H2*    U  30           H2*        U  30  -1.617  13.708 -19.417
  323   2HO*    U  30          2HO*        U  30   0.168  14.781 -20.980
  324    H1*    U  30           H1*        U  30  -2.535  16.347 -20.618
  325    H3     U  30           H3         U  30  -2.873  17.929 -16.424
  326    H5     U  30           H5         U  30  -4.775  14.208 -16.179
  327    H6     U  30           H6         U  30  -4.125  13.816 -18.479
  328   1H5*    G  31          H5*         G  31   0.619  16.298 -22.510
  329   2H5*    G  31          H5**        G  31   1.867  15.658 -23.593
  330    H4*    G  31           H4*        G  31   2.844  17.194 -22.063
  331    H3*    G  31           H3*        G  31   3.687  14.344 -21.470
  332    H2*    G  31           H2*        G  31   5.286  15.378 -20.012
  333   2HO*    G  31          2HO*        G  31   5.198  17.377 -21.686
  334    H1*    G  31           H1*        G  31   3.351  17.159 -18.968
  335    H8     G  31           H8         G  31   2.006  13.664 -19.485
  336    H1     G  31           H1         G  31   5.176  14.572 -13.987
  337   1H2     G  31          H21         G  31   6.072  16.215 -13.905
  338   2H2     G  31          H22         G  31   6.190  17.490 -14.999
  339   1H5*    G  32          H5*         G  32   6.974  16.484 -22.397
  340   2H5*    G  32          H5**        G  32   8.098  15.631 -23.467
  341    H4*    G  32           H4*        G  32   9.302  16.332 -21.566
  342    H3*    G  32           H3*        G  32   8.801  13.350 -21.373
  343    H2*    G  32           H2*        G  32  10.369  13.491 -19.555
  344   2HO*    G  32          2HO*        G  32  11.712  15.167 -20.610
  345    H1*    G  32           H1*        G  32   9.151  15.746 -18.471
  346    H8     G  32           H8         G  32   6.460  13.433 -19.667
  347    H1     G  32           H1         G  32   9.209  11.594 -14.182
  348   1H2     G  32          H21         G  32  10.730  12.537 -13.753
  349   2H2     G  32          H22         G  32  11.538  13.813 -14.503
  350   1H5*    U  33          H5*         U  33  13.227  13.078 -23.263
  351   2H5*    U  33          H5**        U  33  13.554  11.412 -22.884
  352    H4*    U  33           H4*        U  33  14.355  13.543 -21.429
  353    H3*    U  33           H3*        U  33  14.210  10.619 -20.734
  354    H2*    U  33           H2*        U  33  14.754  11.264 -18.453
  355   2HO*    U  33          2HO*        U  33  16.009  13.226 -19.621
  356    H1*    U  33           H1*        U  33  12.985  13.363 -18.285
  357    H3     U  33           H3         U  33  11.522   9.562 -15.979
  358    H5     U  33           H5         U  33   9.364   9.831 -19.586
  359    H6     U  33           H6         U  33  10.922  11.485 -20.294
  360   1H5*    C  34          H5*         C  34  18.509  11.694 -19.995
  361   2H5*    C  34          H5**        C  34  19.511  10.392 -20.663
  362    H4*    C  34           H4*        C  34  19.897  10.721 -18.268
  363    H3*    C  34           H3*        C  34  18.765   8.038 -19.066
  364    H2*    C  34           H2*        C  34  18.876   7.423 -16.755
  365   2HO*    C  34          2HO*        C  34  20.834   9.078 -16.581
  366    H1*    C  34           H1*        C  34  17.619   9.706 -15.847
  367   1H4     C  34          H41         C  34  13.264   5.395 -17.162
  368   2H4     C  34          H42         C  34  12.550   6.245 -18.447
  369    H5     C  34           H5         C  34  13.952   8.388 -19.348
  370    H6     C  34           H6         C  34  15.930   9.672 -18.821
  371   1H5*    C  35          H5*         C  35  21.041   6.155 -15.769
  372   2H5*    C  35          H5**        C  35  22.467   6.111 -16.815
  373    H4*    C  35           H4*        C  35  22.423   3.982 -15.961
  374    H3*    C  35           H3*        C  35  20.929   3.800 -18.587
  375    H2*    C  35           H2*        C  35  20.823   1.457 -18.201
  376   2HO*    C  35          2HO*        C  35  22.979   1.549 -16.944
  377    H1*    C  35           H1*        C  35  19.772   1.774 -15.665
  378   1H4     C  35          H42         C  35  14.835   2.122 -19.702
  379   2H4     C  35          H41         C  35  14.983   3.871 -19.697
  380    H5     C  35           H5         C  35  16.771   5.028 -18.626
  381    H6     C  35           H6         C  35  18.795   4.771 -17.320
  382    H3T    C  35           H3T        C  35  23.057   4.331 -18.755
  Start of MODEL    3
    1   1H5*    G   1          H5*         G   1  18.552  15.712 -35.938
    2   2H5*    G   1          H5**        G   1  18.909  14.745 -34.509
    3    H4*    G   1           H4*        G   1  20.038  16.758 -34.323
    4    H3*    G   1           H3*        G   1  18.426  15.954 -32.245
    5    H2*    G   1           H2*        G   1  16.871  17.662 -32.177
    6   2HO*    G   1          2HO*        G   1  18.892  18.379 -30.740
    7    H1*    G   1           H1*        G   1  18.551  19.751 -33.575
    8    H8     G   1           H8         G   1  15.623  17.469 -34.579
    9    H1     G   1           H1         G   1  14.237  23.715 -34.389
   10   1H2     G   1          H22         G   1  15.907  24.868 -33.693
   11   2H2     G   1          H21         G   1  17.435  24.101 -33.256
   12    H5T    G   1           H5T        G   1  16.672  14.727 -35.180
   13   1H5*    G   2          H5*         G   2  21.529  18.486 -29.638
   14   2H5*    G   2          H5**        G   2  21.649  17.390 -28.256
   15    H4*    G   2           H4*        G   2  20.910  19.741 -27.779
   16    H3*    G   2           H3*        G   2  19.134  17.496 -26.778
   17    H2*    G   2           H2*        G   2  17.897  19.251 -25.718
   18   2HO*    G   2          2HO*        G   2  20.200  20.412 -25.487
   19    H1*    G   2           H1*        G   2  18.117  21.011 -27.935
   20    H8     G   2           H8         G   2  17.167  17.504 -28.975
   21    H1     G   2           H1         G   2  12.299  21.214 -26.982
   22   1H2     G   2          H22         G   2  13.034  23.021 -26.114
   23   2H2     G   2          H21         G   2  14.762  23.306 -25.984
   24   1H5*    A   3          H5*         A   3  20.346  19.902 -23.336
   25   2H5*    A   3          H5**        A   3  20.282  18.888 -21.888
   26    H4*    A   3           H4*        A   3  18.805  20.924 -21.888
   27    H3*    A   3           H3*        A   3  17.513  18.240 -21.384
   28    H2*    A   3           H2*        A   3  15.536  19.464 -20.935
   29   2HO*    A   3          2HO*        A   3  15.510  21.613 -20.458
   30    H1*    A   3           H1*        A   3  15.966  21.313 -23.040
   31    H8     A   3           H8         A   3  16.490  18.031 -24.621
   32   1H6     A   3          H61         A   3  10.260  17.500 -24.638
   33   2H6     A   3          H62         A   3  11.617  16.776 -25.393
   34    H2     A   3           H2         A   3  11.291  20.801 -22.063
   35   1H5*    C   4          H5*         C   4  16.455  20.851 -18.167
   36   2H5*    C   4          H5**        C   4  16.418  19.899 -16.673
   37    H4*    C   4           H4*        C   4  14.286  21.105 -17.231
   38    H3*    C   4           H3*        C   4  14.252  18.132 -16.767
   39    H2*    C   4           H2*        C   4  11.929  18.161 -17.162
   40   2HO*    C   4          2HO*        C   4  10.925  19.836 -16.265
   41    H1*    C   4           H1*        C   4  11.996  20.176 -19.178
   42   1H4     C   4          H41         C   4  10.695  14.810 -22.136
   43   2H4     C   4          H42         C   4  12.256  14.372 -22.534
   44    H5     C   4           H5         C   4  14.204  15.828 -21.340
   45    H6     C   4           H6         C   4  14.536  17.777 -19.900
   46   1H5*    C   5          H5*         C   5  11.527  20.652 -14.337
   47   2H5*    C   5          H5**        C   5  11.218  19.944 -12.741
   48    H4*    C   5           H4*        C   5   9.161  20.529 -14.054
   49    H3*    C   5           H3*        C   5   9.651  17.909 -12.799
   50    H2*    C   5           H2*        C   5   7.976  16.790 -14.023
   51   2HO*    C   5          2HO*        C   5   6.684  18.972 -13.397
   52    H1*    C   5           H1*        C   5   7.833  18.571 -16.270
   53   1H4     C   5          H42         C   5   9.916  13.235 -19.156
   54   2H4     C   5          H41         C   5  11.321  13.269 -18.126
   55    H5     C   5           H5         C   5  11.732  14.817 -16.405
   56    H6     C   5           H6         C   5  10.882  16.765 -15.225
   57   1H5*    C   6          H5*         C   6   6.233  16.514 -11.736
   58   2H5*    C   6          H5**        C   6   6.150  17.054 -10.048
   59    H4*    C   6           H4*        C   6   5.908  14.729  -9.990
   60    H3*    C   6           H3*        C   6   8.666  15.556  -9.116
   61    H2*    C   6           H2*        C   6   9.139  13.305  -8.681
   62   2HO*    C   6          2HO*        C   6   7.328  12.272  -7.885
   63    H1*    C   6           H1*        C   6   8.151  12.334 -11.076
   64   1H4     C   6          H41         C   6  14.328  13.655 -11.767
   65   2H4     C   6          H42         C   6  13.918  15.239 -12.424
   66    H5     C   6           H5         C   6  11.673  16.068 -12.441
   67    H6     C   6           H6         C   6   9.348  15.532 -11.857
   68   1H5*    G   7          H5*         G   7   5.644  13.401  -6.640
   69   2H5*    G   7          H5**        G   7   5.851  13.717  -4.912
   70    H4*    G   7           H4*        G   7   5.263  11.372  -5.514
   71    H3*    G   7           H3*        G   7   7.810  11.804  -3.930
   72    H2*    G   7           H2*        G   7   7.786   9.403  -3.703
   73   2HO*    G   7          2HO*        G   7   5.479   9.050  -3.568
   74    H1*    G   7           H1*        G   7   7.298   9.019  -6.428
   75    H8     G   7           H8         G   7   9.563  11.810  -6.741
   76    H1     G   7           H1         G   7  12.601   6.634  -4.469
   77   1H2     G   7          H22         G   7  11.127   5.159  -3.770
   78   2H2     G   7          H21         G   7   9.408   5.467  -3.871
   79   1H5*    C   8          H5*         C   8   3.577  10.405  -2.515
   80   2H5*    C   8          H5**        C   8   3.530  10.249  -0.752
   81    H4*    C   8           H4*        C   8   2.242   8.532  -2.059
   82    H3*    C   8           H3*        C   8   4.292   7.592  -0.036
   83    H2*    C   8           H2*        C   8   3.485   5.384  -0.517
   84   2HO*    C   8          2HO*        C   8   1.217   6.459  -0.875
   85    H1*    C   8           H1*        C   8   3.431   5.797  -3.305
   86   1H4     C   8          H41         C   8   9.082   3.156  -2.537
   87   2H4     C   8          H42         C   8   9.695   4.518  -1.603
   88    H5     C   8           H5         C   8   8.307   6.396  -1.021
   89    H6     C   8           H6         C   8   6.070   7.342  -1.209
   90   1H5*    C   9          H5*         C   9   1.007   5.430   1.200
   91   2H5*    C   9          H5**        C   9   0.285   6.533   2.380
   92    H4*    C   9           H4*        C   9  -0.091   4.222   2.973
   93    H3*    C   9           H3*        C   9   1.644   5.730   4.940
   94    H2*    C   9           H2*        C   9   1.378   3.761   6.316
   95   2HO*    C   9          2HO*        C   9  -0.778   3.157   5.736
   96    H1*    C   9           H1*        C   9   2.054   2.033   4.264
   97   1H4     C   9          H42         C   9   7.428   3.526   7.237
   98   2H4     C   9          H41         C   9   7.697   4.910   6.178
   99    H5     C   9           H5         C   9   6.022   5.603   4.547
  100    H6     C   9           H6         C   9   3.796   5.078   3.663
  101   1H5*    A  10          H5*         A  10  -3.044   4.251   5.693
  102   2H5*    A  10          H5**        A  10  -3.358   4.754   7.357
  103    H4*    A  10           H4*        A  10  -4.221   2.581   7.083
  104    H3*    A  10           H3*        A  10  -1.679   2.397   8.711
  105    H2*    A  10           H2*        A  10  -2.376   0.132   9.083
  106   2HO*    A  10          2HO*        A  10  -4.549  -0.161   9.155
  107    H1*    A  10           H1*        A  10  -3.125  -0.199   6.380
  108    H8     A  10           H8         A  10   0.254   1.557   7.143
  109   1H6     A  10          H62         A  10   2.694  -4.079   6.475
  110   2H6     A  10          H61         A  10   3.049  -2.369   6.709
  111    H2     A  10           H2         A  10  -1.720  -4.511   6.291
  112   1H5*    C  11          H5*         C  11  -5.657   1.682  10.455
  113   2H5*    C  11          H5**        C  11  -5.730   1.651  12.219
  114    H4*    C  11           H4*        C  11  -6.869  -0.235  11.078
  115    H3*    C  11           H3*        C  11  -4.686  -1.003  13.034
  116    H2*    C  11           H2*        C  11  -5.582  -3.232  12.732
  117   2HO*    C  11          2HO*        C  11  -7.801  -3.038  12.344
  118    H1*    C  11           H1*        C  11  -5.535  -2.987   9.963
  119   1H4     C  11          H42         C  11   0.055  -5.443  11.538
  120   2H4     C  11          H41         C  11   0.768  -3.841  11.722
  121    H5     C  11           H5         C  11  -0.577  -1.834  11.574
  122    H6     C  11           H6         C  11  -2.833  -0.988  11.225
  123   1H5*    U  12          H5*         U  12  -9.033  -1.252  13.330
  124   2H5*    U  12          H5**        U  12  -9.684  -1.273  14.980
  125    H4*    U  12           H4*        U  12 -10.998  -2.664  13.472
  126    H3*    U  12           H3*        U  12  -9.590  -4.083  15.736
  127    H2*    U  12           H2*        U  12 -10.651  -6.094  14.972
  128   2HO*    U  12          2HO*        U  12 -12.545  -4.515  14.178
  129    H1*    U  12           H1*        U  12 -10.097  -5.676  12.284
  130    H3     U  12           H3         U  12  -7.459  -9.079  13.939
  131    H5     U  12           H5         U  12  -5.221  -5.550  14.341
  132    H6     U  12           H6         U  12  -7.188  -4.322  13.794
  133   1H5*    G  13          H5*         G  13 -13.620  -5.048  15.719
  134   2H5*    G  13          H5**        G  13 -14.291  -5.283  17.333
  135    H4*    G  13           H4*        G  13 -14.549  -7.225  15.834
  136    H3*    G  13           H3*        G  13 -13.064  -7.639  18.427
  137    H2*    G  13           H2*        G  13 -13.049  -9.972  17.855
  138   2HO*    G  13          2HO*        G  13 -15.272  -9.487  16.650
  139    H1*    G  13           H1*        G  13 -12.291  -9.543  15.194
  140    H8     G  13           H8         G  13 -10.616  -7.139  17.581
  141    H1     G  13           H1         G  13  -7.738 -12.833  17.103
  142   1H2     G  13          H21         G  13  -8.631 -14.074  16.163
  143   2H2     G  13          H22         G  13 -10.098 -14.110  15.366
  144   1H5*    C  14          H5*         C  14 -16.484 -10.174  17.984
  145   2H5*    C  14          H5**        C  14 -17.311 -10.424  19.531
  146    H4*    C  14           H4*        C  14 -16.745 -12.525  18.357
  147    H3*    C  14           H3*        C  14 -15.781 -12.024  21.135
  148    H2*    C  14           H2*        C  14 -14.435 -13.909  21.101
  149   2HO*    C  14          2HO*        C  14 -15.487 -15.663  20.443
  150    H1*    C  14           H1*        C  14 -14.024 -14.015  18.256
  151   1H4     C  14          H41         C  14  -8.207 -13.077  20.049
  152   2H4     C  14          H42         C  14  -8.413 -11.589  20.881
  153    H5     C  14           H5         C  14 -10.813 -10.581  20.925
  154    H6     C  14           H6         C  14 -13.142 -11.085  20.326
  155   1H5*    A  15          H5*         A  15 -17.783 -15.714  20.608
  156   2H5*    A  15          H5**        A  15 -18.863 -16.159  21.937
  157    H4*    A  15           H4*        A  15 -17.313 -17.954  21.485
  158    H3*    A  15           H3*        A  15 -16.976 -16.579  24.149
  159    H2*    A  15           H2*        A  15 -15.275 -18.142  24.654
  160   2HO*    A  15          2HO*        A  15 -16.663 -19.841  23.354
  161    H1*    A  15           H1*        A  15 -14.146 -18.177  22.089
  162    H8     A  15           H8         A  15 -15.063 -14.777  23.634
  163   1H6     A  15          H62         A  15  -9.068 -14.639  25.334
  164   2H6     A  15          H61         A  15 -10.553 -13.700  25.292
  165    H2     A  15           H2         A  15  -9.885 -18.585  23.566
  166   1H5*    G  16          H5*         G  16 -17.984 -20.589  24.814
  167   2H5*    G  16          H5**        G  16 -18.956 -20.830  26.275
  168    H4*    G  16           H4*        G  16 -16.951 -22.061  26.500
  169    H3*    G  16           H3*        G  16 -16.878 -19.574  28.236
  170    H2*    G  16           H2*        G  16 -14.945 -20.704  29.254
  171   2HO*    G  16          2HO*        G  16 -15.979 -22.871  28.325
  172    H1*    G  16           H1*        G  16 -13.774 -20.895  26.724
  173    H8     G  16           H8         G  16 -16.265 -17.985  27.225
  174    H1     G  16           H1         G  16 -10.095 -16.355  27.681
  175   1H2     G  16          H22         G  16  -8.849 -18.103  27.580
  176   2H2     G  16          H21         G  16  -9.507 -19.714  27.412
  177   1H5*    A  17          H5*         A  17 -17.273 -20.191  32.785
  178   2H5*    A  17          H5**        A  17 -16.212 -20.840  31.512
  179    H4*    A  17           H4*        A  17 -17.724 -22.517  33.523
  180    H3*    A  17           H3*        A  17 -14.796 -21.798  33.503
  181    H2*    A  17           H2*        A  17 -14.408 -23.863  34.548
  182   2HO*    A  17          2HO*        A  17 -16.397 -23.948  35.837
  183    H1*    A  17           H1*        A  17 -15.965 -25.148  32.622
  184    H8     A  17           H8         A  17 -14.825 -23.077  30.222
  185   1H6     A  17          H62         A  17  -9.026 -25.271  30.766
  186   2H6     A  17          H61         A  17 -10.088 -24.358  29.701
  187    H2     A  17           H2         A  17 -11.261 -26.401  34.362
  188   1H5*    G  18          H5*         G  18 -11.899 -21.807  36.946
  189   2H5*    G  18          H5**        G  18 -12.627 -20.547  35.928
  190    H4*    G  18           H4*        G  18 -11.341 -23.123  35.007
  191    H3*    G  18           H3*        G  18 -10.400 -20.289  35.018
  192    H2*    G  18           H2*        G  18  -9.733 -20.377  32.768
  193   2HO*    G  18          2HO*        G  18  -8.907 -22.500  32.732
  194    H1*    G  18           H1*        G  18 -12.015 -21.541  31.738
  195    H8     G  18           H8         G  18 -14.053 -20.054  33.984
  196    H1     G  18           H1         G  18 -11.031 -15.300  30.922
  197   1H2     G  18          H21         G  18  -9.249 -16.084  29.922
  198   2H2     G  18          H22         G  18  -8.815 -17.783  30.008
  199   1H5*    A  19          H5*         A  19  -6.043 -19.017  34.481
  200   2H5*    A  19          H5**        A  19  -7.216 -18.830  33.212
  201    H4*    A  19           H4*        A  19  -5.622 -21.254  33.851
  202    H3*    A  19           H3*        A  19  -6.090 -19.572  31.375
  203    H2*    A  19           H2*        A  19  -5.386 -21.488  30.134
  204   2HO*    A  19          2HO*        A  19  -3.905 -22.039  32.176
  205    H1*    A  19           H1*        A  19  -6.947 -23.251  31.609
  206    H8     A  19           H8         A  19  -8.725 -19.966  31.079
  207   1H6     A  19          H62         A  19 -10.938 -22.384  25.829
  208   2H6     A  19          H61         A  19 -11.068 -21.028  26.936
  209    H2     A  19           H2         A  19  -7.847 -25.146  27.395
  210   1H5*    U  20          H5*         U  20  -3.123 -20.817  30.112
  211   2H5*    U  20          H5**        U  20  -2.052 -19.718  29.241
  212    H4*    U  20           H4*        U  20  -3.308 -21.396  27.895
  213    H3*    U  20           H3*        U  20  -3.396 -18.544  26.993
  214    H2*    U  20           H2*        U  20  -4.610 -19.370  25.108
  215   2HO*    U  20          2HO*        U  20  -3.340 -21.494  25.186
  216    H1*    U  20           H1*        U  20  -6.399 -20.863  26.552
  217    H3     U  20           H3         U  20  -8.337 -16.906  25.182
  218    H5     U  20           H5         U  20  -6.357 -16.104  28.817
  219    H6     U  20           H6         U  20  -5.417 -18.211  28.693
  220   1H5*    G  21          H5*         G  21  -2.392 -21.013  23.705
  221   2H5*    G  21          H5**        G  21  -1.392 -20.134  22.548
  222    H4*    G  21           H4*        G  21  -3.705 -20.990  21.790
  223    H3*    G  21           H3*        G  21  -2.734 -18.205  21.200
  224    H2*    G  21           H2*        G  21  -4.742 -17.842  20.034
  225   2HO*    G  21          2HO*        G  21  -5.398 -19.530  18.860
  226    H1*    G  21           H1*        G  21  -6.380 -19.300  21.812
  227    H8     G  21           H8         G  21  -4.085 -16.855  23.516
  228    H1     G  21           H1         G  21  -9.415 -14.286  21.046
  229   1H2     G  21          H22         G  21 -10.447 -15.734  19.780
  230   2H2     G  21          H21         G  21  -9.798 -17.356  19.599
  231   1H5*    C  22          H5*         C  22  -4.220 -20.861  17.758
  232   2H5*    C  22          H5**        C  22  -3.304 -20.353  16.337
  233    H4*    C  22           H4*        C  22  -5.790 -20.589  16.062
  234    H3*    C  22           H3*        C  22  -4.405 -18.055  15.190
  235    H2*    C  22           H2*        C  22  -6.529 -17.456  14.254
  236   2HO*    C  22          2HO*        C  22  -6.951 -19.932  13.905
  237    H1*    C  22           H1*        C  22  -7.957 -18.060  16.554
  238   1H4     C  22          H41         C  22  -6.152 -11.979  16.681
  239   2H4     C  22          H42         C  22  -4.967 -12.193  17.857
  240    H5     C  22           H5         C  22  -4.316 -14.723  18.444
  241    H6     C  22           H6         C  22  -4.955 -17.008  17.993
  242   1H5*    A  23          H5*         A  23  -6.269 -19.702  11.881
  243   2H5*    A  23          H5**        A  23  -5.512 -19.305  10.341
  244    H4*    A  23           H4*        A  23  -7.887 -18.534  10.835
  245    H3*    A  23           H3*        A  23  -6.050 -17.392   9.089
  246    H2*    A  23           H2*        A  23  -5.838 -15.281  10.076
  247   2HO*    A  23          2HO*        A  23  -8.024 -15.292   8.579
  248    H1*    A  23           H1*        A  23  -8.460 -15.479  11.600
  249    H8     A  23           H8         A  23  -4.859 -15.689  12.913
  250   1H6     A  23          H62         A  23  -5.875  -9.963  15.128
  251   2H6     A  23          H61         A  23  -4.749 -11.312  15.101
  252    H2     A  23           H2         A  23  -9.369 -11.136  12.663
  253   1H5*    A  24          H5*         A  24 -10.409 -15.994   7.698
  254   2H5*    A  24          H5**        A  24 -10.253 -16.104   5.937
  255    H4*    A  24           H4*        A  24 -11.263 -14.001   6.673
  256    H3*    A  24           H3*        A  24  -8.593 -13.717   5.283
  257    H2*    A  24           H2*        A  24  -9.089 -11.335   5.349
  258   2HO*    A  24          2HO*        A  24 -11.525 -12.028   5.058
  259    H1*    A  24           H1*        A  24 -10.024 -11.456   7.988
  260    H8     A  24           H8         A  24  -6.861 -13.444   7.661
  261   1H6     A  24          H61         A  24  -3.857  -8.041   8.169
  262   2H6     A  24          H62         A  24  -3.667  -9.794   8.151
  263    H2     A  24           H2         A  24  -8.172  -7.165   7.636
  264   1H5*    U  25          H5*         U  25  -9.853 -10.590   3.341
  265   2H5*    U  25          H5**        U  25  -9.365 -10.895   1.673
  266    H4*    U  25           H4*        U  25  -8.245  -8.967   2.564
  267    H3*    U  25           H3*        U  25  -6.339 -11.234   1.968
  268    H2*    U  25           H2*        U  25  -4.635  -9.588   2.312
  269   2HO*    U  25          2HO*        U  25  -5.076  -7.446   2.314
  270    H1*    U  25           H1*        U  25  -5.714  -8.787   4.744
  271    H3     U  25           H3         U  25  -2.049 -11.497   5.417
  272    H5     U  25           H5         U  25  -5.339 -14.073   5.127
  273    H6     U  25           H6         U  25  -6.647 -12.203   4.412
  274   1H5*    C  26          H5*         C  26  -5.723  -7.599  -0.103
  275   2H5*    C  26          H5**        C  26  -5.313  -7.854  -1.802
  276    H4*    C  26           H4*        C  26  -3.913  -6.171  -0.649
  277    H3*    C  26           H3*        C  26  -2.571  -8.504  -1.997
  278    H2*    C  26           H2*        C  26  -0.482  -7.532  -1.332
  279   2HO*    C  26          2HO*        C  26  -1.731  -5.303  -1.690
  280    H1*    C  26           H1*        C  26  -1.352  -6.676   1.214
  281   1H4     C  26          H42         C  26   2.099 -11.892   2.166
  282   2H4     C  26          H41         C  26   0.633 -12.864   2.246
  283    H5     C  26           H5         C  26  -1.550 -11.923   1.725
  284    H6     C  26           H6         C  26  -2.718  -9.913   1.029
  285   1H5*    C  27          H5*         C  27  -1.138  -4.630  -3.246
  286   2H5*    C  27          H5**        C  27  -1.435  -4.431  -4.975
  287    H4*    C  27           H4*        C  27   0.732  -3.512  -4.060
  288    H3*    C  27           H3*        C  27   0.532  -5.160  -6.551
  289    H2*    C  27           H2*        C  27   2.887  -5.203  -6.749
  290   2HO*    C  27          2HO*        C  27   2.623  -2.781  -5.632
  291    H1*    C  27           H1*        C  27   3.505  -5.250  -3.986
  292   1H4     C  27          H41         C  27   4.733 -11.117  -5.976
  293   2H4     C  27          H42         C  27   3.136 -11.639  -5.455
  294    H5     C  27           H5         C  27   1.468 -10.064  -4.677
  295    H6     C  27           H6         C  27   1.012  -7.708  -4.258
  296   1H5*    A  28          H5*         A  28   3.168  -2.651  -8.176
  297   2H5*    A  28          H5**        A  28   2.103  -1.420  -8.880
  298    H4*    A  28           H4*        A  28   3.763  -1.806 -10.469
  299    H3*    A  28           H3*        A  28   1.247  -3.273 -11.296
  300    H2*    A  28           H2*        A  28   2.392  -3.780 -13.307
  301   2HO*    A  28          2HO*        A  28   3.463  -1.777 -13.716
  302    H1*    A  28           H1*        A  28   4.865  -4.268 -12.007
  303    H8     A  28           H8         A  28   2.681  -6.235  -9.884
  304   1H6     A  28          H62         A  28   2.358 -10.473 -14.442
  305   2H6     A  28          H61         A  28   2.031 -10.184 -12.734
  306    H2     A  28           H2         A  28   4.047  -6.774 -16.152
  307   1H5*    G  29          H5*         G  29   0.048   0.608 -14.673
  308   2H5*    G  29          H5**        G  29   0.600  -0.544 -15.886
  309    H4*    G  29           H4*        G  29   2.319   0.629 -13.687
  310    H3*    G  29           H3*        G  29   1.782   2.210 -15.669
  311    H2*    G  29           H2*        G  29   1.898   0.328 -17.313
  312   2HO*    G  29          2HO*        G  29   3.971   0.756 -18.454
  313    H1*    G  29           H1*        G  29   4.689  -0.202 -16.155
  314    H8     G  29           H8         G  29   3.077  -3.251 -15.806
  315    H1     G  29           H1         G  29   4.508  -2.465 -22.009
  316   1H2     G  29          H22         G  29   4.947  -0.341 -22.411
  317   2H2     G  29          H21         G  29   4.880   0.856 -21.133
  318   1H5*    U  30          H5*         U  30   4.157   3.775 -17.858
  319   2H5*    U  30          H5**        U  30   4.314   5.410 -17.231
  320    H4*    U  30           H4*        U  30   2.199   4.219 -18.958
  321    H3*    U  30           H3*        U  30   4.040   5.864 -19.864
  322    H2*    U  30           H2*        U  30   3.672   7.306 -17.808
  323   2HO*    U  30          2HO*        U  30   2.737   8.352 -20.307
  324    H1*    U  30           H1*        U  30   0.801   7.285 -18.889
  325    H3     U  30           H3         U  30  -0.616  10.596 -16.179
  326    H5     U  30           H5         U  30   1.747   8.272 -13.630
  327    H6     U  30           H6         U  30   2.348   6.919 -15.542
  328   1H5*    G  31          H5*         G  31   0.607   8.320 -21.757
  329   2H5*    G  31          H5**        G  31   1.066   8.485 -23.461
  330    H4*    G  31           H4*        G  31   0.619  10.615 -22.101
  331    H3*    G  31           H3*        G  31   3.080  10.340 -23.831
  332    H2*    G  31           H2*        G  31   3.564  12.586 -23.234
  333   2HO*    G  31          2HO*        G  31   1.985  13.942 -22.766
  334    H1*    G  31           H1*        G  31   2.898  12.260 -20.520
  335    H8     G  31           H8         G  31   4.868   9.407 -22.126
  336    H1     G  31           H1         G  31   8.394  14.237 -19.809
  337   1H2     G  31          H21         G  31   7.365  15.716 -19.236
  338   2H2     G  31          H22         G  31   5.691  15.966 -19.240
  339   1H5*    G  32          H5*         G  32   0.767  13.835 -24.677
  340   2H5*    G  32          H5**        G  32   1.026  14.450 -26.307
  341    H4*    G  32           H4*        G  32   1.548  16.019 -24.404
  342    H3*    G  32           H3*        G  32   3.647  15.561 -26.520
  343    H2*    G  32           H2*        G  32   4.834  17.313 -25.398
  344   2HO*    G  32          2HO*        G  32   3.558  18.853 -24.603
  345    H1*    G  32           H1*        G  32   4.259  16.373 -22.818
  346    H8     G  32           H8         G  32   5.193  13.671 -25.320
  347    H1     G  32           H1         G  32  10.181  16.554 -22.511
  348   1H2     G  32          H21         G  32   9.745  17.997 -21.487
  349   2H2     G  32          H22         G  32   8.281  18.731 -21.105
  350   1H5*    U  33          H5*         U  33   2.004  20.153 -26.805
  351   2H5*    U  33          H5**        U  33   3.120  20.831 -27.976
  352    H4*    U  33           H4*        U  33   3.064  21.515 -25.390
  353    H3*    U  33           H3*        U  33   5.409  21.608 -27.272
  354    H2*    U  33           H2*        U  33   6.706  22.371 -25.334
  355   2HO*    U  33          2HO*        U  33   4.502  23.414 -24.523
  356    H1*    U  33           H1*        U  33   5.792  20.439 -23.647
  357    H3     U  33           H3         U  33  10.051  19.276 -24.934
  358    H5     U  33           H5         U  33   7.486  17.508 -27.748
  359    H6     U  33           H6         U  33   5.710  18.788 -26.810
  360   1H5*    C  34          H5*         C  34   5.058  25.826 -26.054
  361   2H5*    C  34          H5**        C  34   5.333  26.845 -27.479
  362    H4*    C  34           H4*        C  34   6.980  27.305 -25.759
  363    H3*    C  34           H3*        C  34   8.123  26.020 -28.249
  364    H2*    C  34           H2*        C  34  10.280  26.288 -27.221
  365   2HO*    C  34          2HO*        C  34   9.292  28.314 -26.001
  366    H1*    C  34           H1*        C  34   9.508  25.149 -24.847
  367   1H4     C  34          H41         C  34  11.515  20.575 -28.607
  368   2H4     C  34          H42         C  34  10.034  19.875 -28.929
  369    H5     C  34           H5         C  34   7.877  21.338 -28.113
  370    H6     C  34           H6         C  34   7.341  23.377 -26.921
  371   1H5*    C  35          H5*         C  35  11.796  28.520 -27.641
  372   2H5*    C  35          H5**        C  35  10.894  29.856 -28.371
  373    H4*    C  35           H4*        C  35  12.978  29.908 -29.408
  374    H3*    C  35           H3*        C  35  11.093  28.447 -31.281
  375    H2*    C  35           H2*        C  35  12.885  28.511 -32.851
  376   2HO*    C  35          2HO*        C  35  13.686  30.647 -31.760
  377    H1*    C  35           H1*        C  35  14.692  27.461 -31.029
  378   1H4     C  35          H42         C  35  11.831  22.508 -33.781
  379   2H4     C  35          H41         C  35  10.627  22.454 -32.498
  380    H5     C  35           H5         C  35  10.511  24.154 -30.781
  381    H6     C  35           H6         C  35  11.520  26.202 -29.961
  382    H3T    C  35           H3T        C  35  10.515  30.516 -30.888
  Start of MODEL    4
    1   1H5*    G   1          H5*         G   1   8.047  -6.914 -15.927
    2   2H5*    G   1          H5**        G   1   6.864  -6.173 -14.851
    3    H4*    G   1           H4*        G   1   8.534  -7.048 -13.532
    4    H3*    G   1           H3*        G   1   7.908  -4.392 -13.224
    5    H2*    G   1           H2*        G   1   9.899  -3.370 -13.802
    6   2HO*    G   1          2HO*        G   1  10.008  -3.899 -11.294
    7    H1*    G   1           H1*        G   1  11.705  -5.732 -13.273
    8    H8     G   1           H8         G   1  10.223  -4.110 -16.420
    9    H1     G   1           H1         G   1  16.555  -3.442 -15.772
   10   1H2     G   1          H22         G   1  17.244  -4.263 -13.919
   11   2H2     G   1          H21         G   1  16.132  -5.014 -12.772
   12    H5T    G   1           H5T        G   1   7.370  -4.904 -16.731
   13   1H5*    G   2          H5*         G   2   9.431  -5.172  -8.767
   14   2H5*    G   2          H5**        G   2   8.215  -4.217  -7.909
   15    H4*    G   2           H4*        G   2  10.636  -3.613  -7.543
   16    H3*    G   2           H3*        G   2   8.727  -1.403  -8.355
   17    H2*    G   2           H2*        G   2  10.600   0.047  -8.003
   18   2HO*    G   2          2HO*        G   2  11.245  -1.618  -6.134
   19    H1*    G   2           H1*        G   2  12.462  -1.758  -9.161
   20    H8     G   2           H8         G   2   9.290  -1.282 -11.199
   21    H1     G   2           H1         G   2  13.916   3.090 -12.134
   22   1H2     G   2          H22         G   2  15.481   2.859 -10.692
   23   2H2     G   2          H21         G   2  15.361   1.624  -9.449
   24   1H5*    A   3          H5*         A   3  10.603  -0.334  -4.512
   25   2H5*    A   3          H5**        A   3   9.513   0.778  -3.678
   26    H4*    A   3           H4*        A   3  11.822   1.630  -4.163
   27    H3*    A   3           H3*        A   3   9.495   3.294  -5.167
   28    H2*    A   3           H2*        A   3  11.189   4.906  -5.715
   29   2HO*    A   3          2HO*        A   3  12.448   4.031  -3.663
   30    H1*    A   3           H1*        A   3  12.958   2.980  -6.747
   31    H8     A   3           H8         A   3   9.628   2.071  -8.115
   32   1H6     A   3          H61         A   3  10.520   6.706 -12.202
   33   2H6     A   3          H62         A   3   9.505   5.348 -12.001
   34    H2     A   3           H2         A   3  13.530   7.074  -9.122
   35   1H5*    C   4          H5*         C   4  11.979   5.898  -2.751
   36   2H5*    C   4          H5**        C   4  10.876   7.024  -1.949
   37    H4*    C   4           H4*        C   4  12.650   8.086  -3.328
   38    H3*    C   4           H3*        C   4   9.769   8.776  -3.937
   39    H2*    C   4           H2*        C   4  10.667  10.347  -5.520
   40   2HO*    C   4          2HO*        C   4  12.639  10.539  -3.869
   41    H1*    C   4           H1*        C   4  12.595   8.580  -6.550
   42   1H4     C   4          H41         C   4   7.660   8.430 -10.442
   43   2H4     C   4          H42         C   4   6.926   7.066  -9.814
   44    H5     C   4           H5         C   4   7.924   6.177  -7.479
   45    H6     C   4           H6         C   4   9.730   6.566  -5.890
   46   1H5*    C   5          H5*         C   5  11.026  12.509  -3.845
   47   2H5*    C   5          H5**        C   5  10.096  13.366  -2.605
   48    H4*    C   5           H4*        C   5   9.816  14.549  -4.605
   49    H3*    C   5           H3*        C   5   7.292  12.975  -4.076
   50    H2*    C   5           H2*        C   5   6.378  14.182  -5.908
   51   2HO*    C   5          2HO*        C   5   7.644  16.184  -5.175
   52    H1*    C   5           H1*        C   5   8.770  14.028  -7.424
   53   1H4     C   5          H42         C   5   4.869   9.689 -10.078
   54   2H4     C   5          H41         C   5   5.135   8.671  -8.690
   55    H5     C   5           H5         C   5   6.376   9.240  -6.771
   56    H6     C   5           H6         C   5   7.710  10.966  -5.690
   57   1H5*    C   6          H5*         C   6   6.059  17.411  -3.232
   58   2H5*    C   6          H5**        C   6   5.103  17.177  -1.761
   59    H4*    C   6           H4*        C   6   3.909  18.561  -3.278
   60    H3*    C   6           H3*        C   6   2.594  15.855  -2.988
   61    H2*    C   6           H2*        C   6   0.836  16.783  -4.322
   62   2HO*    C   6          2HO*        C   6   1.033  18.911  -3.173
   63    H1*    C   6           H1*        C   6   2.620  18.199  -6.034
   64   1H4     C   6          H41         C   6   0.927  13.251  -9.530
   65   2H4     C   6          H42         C   6   2.025  12.173  -8.675
   66    H5     C   6           H5         C   6   3.284  12.917  -6.741
   67    H6     C   6           H6         C   6   3.734  14.818  -5.271
   68   1H5*    G   7          H5*         G   7  -0.167  18.858  -0.247
   69   2H5*    G   7          H5**        G   7  -0.756  17.632   0.884
   70    H4*    G   7           H4*        G   7  -2.600  18.890   0.021
   71    H3*    G   7           H3*        G   7  -2.568  16.033  -0.966
   72    H2*    G   7           H2*        G   7  -4.622  16.526  -2.049
   73   2HO*    G   7          2HO*        G   7  -5.496  17.753  -0.188
   74    H1*    G   7           H1*        G   7  -3.882  19.194  -2.750
   75    H8     G   7           H8         G   7  -1.665  16.105  -3.449
   76    H1     G   7           H1         G   7  -4.975  18.431  -8.433
   77   1H2     G   7          H22         G   7  -6.305  20.068  -7.741
   78   2H2     G   7          H21         G   7  -6.330  20.535  -6.051
   79   1H5*    C   8          H5*         C   8  -5.729  18.120   1.994
   80   2H5*    C   8          H5**        C   8  -6.220  16.717   2.967
   81    H4*    C   8           H4*        C   8  -8.078  18.248   2.626
   82    H3*    C   8           H3*        C   8  -8.332  15.491   1.396
   83    H2*    C   8           H2*        C   8 -10.511  16.139   0.678
   84   2HO*    C   8          2HO*        C   8 -10.598  17.447   2.861
   85    H1*    C   8           H1*        C   8  -9.798  18.793  -0.034
   86   1H4     C   8          H41         C   8  -9.945  15.863  -5.595
   87   2H4     C   8          H42         C   8  -8.424  15.033  -5.295
   88    H5     C   8           H5         C   8  -7.282  15.208  -3.163
   89    H6     C   8           H6         C   8  -7.380  16.205  -0.941
   90   1H5*    C   9          H5*         C   9 -12.085  14.491   3.032
   91   2H5*    C   9          H5**        C   9 -11.490  13.634   4.461
   92    H4*    C   9           H4*        C   9 -13.185  12.442   3.015
   93    H3*    C   9           H3*        C   9 -10.606  11.032   3.721
   94    H2*    C   9           H2*        C   9 -11.634   9.113   2.738
   95   2HO*    C   9          2HO*        C   9 -13.768   8.980   2.735
   96    H1*    C   9           H1*        C   9 -12.436  10.506   0.462
   97   1H4     C   9          H42         C   9  -6.853   7.756  -0.600
   98   2H4     C   9          H41         C   9  -5.994   9.225  -0.128
   99    H5     C   9           H5         C   9  -7.168  11.137   0.812
  100    H6     C   9           H6         C   9  -9.353  11.986   1.457
  101   1H5*    A  10          H5*         A  10 -14.442   9.381   5.010
  102   2H5*    A  10          H5**        A  10 -14.421   8.026   6.144
  103    H4*    A  10           H4*        A  10 -15.453   7.829   3.699
  104    H3*    A  10           H3*        A  10 -13.975   5.634   5.149
  105    H2*    A  10           H2*        A  10 -14.435   4.279   3.261
  106   2HO*    A  10          2HO*        A  10 -15.908   4.885   1.632
  107    H1*    A  10           H1*        A  10 -14.004   6.360   1.384
  108    H8     A  10           H8         A  10 -10.980   6.623   3.338
  109   1H6     A  10          H62         A  10  -9.013   1.364   0.622
  110   2H6     A  10          H61         A  10  -8.478   2.749   1.578
  111    H2     A  10           H2         A  10 -13.324   1.757  -0.132
  112   1H5*    C  11          H5*         C  11 -16.251   3.255   4.236
  113   2H5*    C  11          H5**        C  11 -16.831   2.287   5.599
  114    H4*    C  11           H4*        C  11 -15.532   0.847   4.239
  115    H3*    C  11           H3*        C  11 -14.009   1.580   6.733
  116    H2*    C  11           H2*        C  11 -12.433  -0.076   5.968
  117   2HO*    C  11          2HO*        C  11 -14.224  -1.453   5.065
  118    H1*    C  11           H1*        C  11 -12.454   0.871   3.314
  119   1H4     C  11          H42         C  11  -7.536   3.702   6.030
  120   2H4     C  11          H41         C  11  -8.546   5.012   6.645
  121    H5     C  11           H5         C  11 -10.971   4.958   6.404
  122    H6     C  11           H6         C  11 -12.836   3.636   5.558
  123   1H5*    U  12          H5*         U  12 -15.538  -2.776   6.335
  124   2H5*    U  12          H5**        U  12 -16.006  -3.208   7.987
  125    H4*    U  12           H4*        U  12 -14.886  -5.048   6.907
  126    H3*    U  12           H3*        U  12 -13.352  -3.867   9.224
  127    H2*    U  12           H2*        U  12 -11.769  -5.597   8.872
  128   2HO*    U  12          2HO*        U  12 -12.727  -7.490   8.426
  129    H1*    U  12           H1*        U  12 -12.018  -5.577   6.038
  130    H3     U  12           H3         U  12  -7.655  -4.819   7.353
  131    H5     U  12           H5         U  12  -9.441  -1.058   6.897
  132    H6     U  12           H6         U  12 -11.578  -2.160   6.726
  133   1H5*    G  13          H5*         G  13 -14.547  -8.125   9.418
  134   2H5*    G  13          H5**        G  13 -14.647  -8.716  11.081
  135    H4*    G  13           H4*        G  13 -13.219 -10.055   9.504
  136    H3*    G  13           H3*        G  13 -12.055  -9.098  12.125
  137    H2*    G  13           H2*        G  13 -10.113 -10.361  11.531
  138   2HO*    G  13          2HO*        G  13 -11.683 -12.030  10.497
  139    H1*    G  13           H1*        G  13 -10.131  -9.595   8.820
  140    H8     G  13           H8         G  13 -10.834  -6.808  11.315
  141    H1     G  13           H1         G  13  -4.650  -7.819  10.028
  142   1H2     G  13          H21         G  13  -4.334  -9.328   8.998
  143   2H2     G  13          H22         G  13  -5.333 -10.479   8.292
  144   1H5*    C  14          H5*         C  14 -11.671 -13.408  11.886
  145   2H5*    C  14          H5**        C  14 -11.739 -14.066  13.523
  146    H4*    C  14           H4*        C  14  -9.675 -14.618  12.245
  147    H3*    C  14           H3*        C  14  -9.432 -13.318  14.937
  148    H2*    C  14           H2*        C  14  -7.111 -13.309  14.678
  149   2HO*    C  14          2HO*        C  14  -6.306 -15.159  13.923
  150    H1*    C  14           H1*        C  14  -7.108 -13.001  11.823
  151   1H4     C  14          H42         C  14  -4.716  -7.505  14.032
  152   2H4     C  14          H41         C  14  -6.324  -7.052  14.526
  153    H5     C  14           H5         C  14  -8.244  -8.430  14.404
  154    H6     C  14           H6         C  14  -9.089 -10.631  13.755
  155   1H5*    A  15          H5*         A  15  -7.441 -17.141  14.329
  156   2H5*    A  15          H5**        A  15  -7.316 -18.111  15.802
  157    H4*    A  15           H4*        A  15  -5.164 -17.814  14.637
  158    H3*    A  15           H3*        A  15  -5.357 -16.770  17.472
  159    H2*    A  15           H2*        A  15  -3.042 -16.265  17.281
  160   2HO*    A  15          2HO*        A  15  -2.865 -18.401  15.908
  161    H1*    A  15           H1*        A  15  -3.181 -15.383  14.587
  162    H8     A  15           H8         A  15  -5.815 -14.090  17.059
  163   1H6     A  15          H62         A  15  -1.967  -9.240  17.769
  164   2H6     A  15          H61         A  15  -3.553  -9.876  18.177
  165    H2     A  15           H2         A  15   0.072 -12.253  15.260
  166   1H5*    G  16          H5*         G  16  -2.533 -19.762  17.803
  167   2H5*    G  16          H5**        G  16  -2.613 -20.551  19.386
  168    H4*    G  16           H4*        G  16  -0.534 -19.412  19.167
  169    H3*    G  16           H3*        G  16  -2.376 -18.048  21.179
  170    H2*    G  16           H2*        G  16  -0.333 -16.699  21.630
  171   2HO*    G  16          2HO*        G  16   0.930 -18.795  20.761
  172    H1*    G  16           H1*        G  16   0.076 -16.147  18.976
  173    H8     G  16           H8         G  16  -3.594 -16.596  19.930
  174    H1     G  16           H1         G  16  -1.468 -10.558  20.201
  175   1H2     G  16          H22         G  16   0.686 -10.502  19.909
  176   2H2     G  16          H21         G  16   1.617 -11.962  19.649
  177   1H5*    A  17          H5*         A  17  -1.705 -16.789  24.631
  178   2H5*    A  17          H5**        A  17  -0.534 -17.361  23.455
  179    H4*    A  17           H4*        A  17  -0.947 -18.865  26.001
  180    H3*    A  17           H3*        A  17   0.727 -16.405  25.549
  181    H2*    A  17           H2*        A  17   2.399 -17.261  26.908
  182   2HO*    A  17          2HO*        A  17   0.991 -18.431  28.426
  183    H1*    A  17           H1*        A  17   2.469 -19.623  25.506
  184    H8     A  17           H8         A  17   1.615 -18.089  22.626
  185   1H6     A  17          H62         A  17   6.861 -14.759  22.475
  186   2H6     A  17          H61         A  17   5.503 -15.301  21.488
  187    H2     A  17           H2         A  17   6.353 -16.306  26.553
  188   1H5*    G  18          H5*         G  18   2.436 -13.619  28.670
  189   2H5*    G  18          H5**        G  18   1.079 -13.427  27.546
  190    H4*    G  18           H4*        G  18   3.932 -14.154  26.879
  191    H3*    G  18           H3*        G  18   2.158 -11.780  26.399
  192    H2*    G  18           H2*        G  18   3.095 -11.454  24.260
  193   2HO*    G  18          2HO*        G  18   5.167 -12.213  24.114
  194    H1*    G  18           H1*        G  18   2.472 -13.986  23.422
  195    H8     G  18           H8         G  18  -0.045 -14.583  25.508
  196    H1     G  18           H1         G  18  -1.539  -9.121  22.463
  197   1H2     G  18          H21         G  18   0.264  -8.246  21.577
  198   2H2     G  18          H22         G  18   1.832  -9.011  21.736
  199   1H5*    A  19          H5*         A  19   6.841 -10.496  25.713
  200   2H5*    A  19          H5**        A  19   6.636  -8.776  25.360
  201    H4*    A  19           H4*        A  19   7.869  -9.798  23.609
  202    H3*    A  19           H3*        A  19   5.097  -9.101  22.623
  203    H2*    A  19           H2*        A  19   5.934  -9.736  20.505
  204   2HO*    A  19          2HO*        A  19   8.184  -8.777  21.308
  205    H1*    A  19           H1*        A  19   7.402 -11.915  21.480
  206    H8     A  19           H8         A  19   3.651 -11.189  22.294
  207   1H6     A  19          H62         A  19   2.428 -15.312  17.877
  208   2H6     A  19          H61         A  19   1.714 -14.275  19.102
  209    H2     A  19           H2         A  19   6.828 -14.752  18.005
  210   1H5*    U  20          H5*         U  20   7.397  -7.320  19.596
  211   2H5*    U  20          H5**        U  20   6.323  -6.152  18.827
  212    H4*    U  20           H4*        U  20   7.085  -8.491  17.769
  213    H3*    U  20           H3*        U  20   4.656  -6.911  17.007
  214    H2*    U  20           H2*        U  20   4.093  -8.715  15.535
  215   2HO*    U  20          2HO*        U  20   6.631  -9.142  15.380
  216    H1*    U  20           H1*        U  20   4.444 -10.715  17.358
  217    H3     U  20           H3         U  20  -0.046  -9.932  17.107
  218    H5     U  20           H5         U  20   1.468  -7.093  19.829
  219    H6     U  20           H6         U  20   3.616  -7.780  19.238
  220   1H5*    G  21          H5*         G  21   6.264  -8.482  13.494
  221   2H5*    G  21          H5**        G  21   6.079  -7.303  12.193
  222    H4*    G  21           H4*        G  21   4.980  -9.545  11.840
  223    H3*    G  21           H3*        G  21   3.392  -7.004  11.538
  224    H2*    G  21           H2*        G  21   1.581  -8.386  10.833
  225   2HO*    G  21          2HO*        G  21   2.174 -10.110   9.677
  226    H1*    G  21           H1*        G  21   1.994 -10.363  12.773
  227    H8     G  21           H8         G  21   2.323  -6.801  14.047
  228    H1     G  21           H1         G  21  -3.644  -9.145  13.970
  229   1H2     G  21          H21         G  21  -3.774 -10.773  13.094
  230   2H2     G  21          H22         G  21  -2.664 -11.771  12.328
  231   1H5*    C  22          H5*         C  22   3.706  -9.695   8.157
  232   2H5*    C  22          H5**        C  22   3.630  -8.901   6.578
  233    H4*    C  22           H4*        C  22   2.095 -10.861   6.897
  234    H3*    C  22           H3*        C  22   0.948  -8.217   5.992
  235    H2*    C  22           H2*        C  22  -1.135  -9.336   5.856
  236   2HO*    C  22          2HO*        C  22   0.102 -11.351   5.041
  237    H1*    C  22           H1*        C  22  -0.825 -10.845   8.204
  238   1H4     C  22          H41         C  22  -4.741  -6.064   9.259
  239   2H4     C  22          H42         C  22  -3.665  -5.115  10.166
  240    H5     C  22           H5         C  22  -1.086  -5.924  10.081
  241    H6     C  22           H6         C  22   0.320  -7.726   9.257
  242   1H5*    A  23          H5*         A  23   0.333 -10.696   2.457
  243   2H5*    A  23          H5**        A  23  -0.107  -9.676   1.089
  244    H4*    A  23           H4*        A  23  -1.849 -11.119   2.438
  245    H3*    A  23           H3*        A  23  -2.254  -9.043   0.613
  246    H2*    A  23           H2*        A  23  -3.106  -7.464   2.067
  247   2HO*    A  23          2HO*        A  23  -5.351  -8.175   2.893
  248    H1*    A  23           H1*        A  23  -3.994  -9.519   4.134
  249    H8     A  23           H8         A  23  -1.198  -6.938   4.473
  250   1H6     A  23          H62         A  23  -5.400  -3.575   7.632
  251   2H6     A  23          H61         A  23  -3.692  -3.659   7.189
  252    H2     A  23           H2         A  23  -7.447  -7.075   5.922
  253   1H5*    A  24          H5*         A  24  -6.521 -11.149   0.861
  254   2H5*    A  24          H5**        A  24  -6.958 -11.242  -0.849
  255    H4*    A  24           H4*        A  24  -8.737 -10.322   0.561
  256    H3*    A  24           H3*        A  24  -7.708  -8.383  -1.524
  257    H2*    A  24           H2*        A  24  -9.531  -7.031  -0.859
  258   2HO*    A  24          2HO*        A  24 -11.209  -7.764   0.447
  259    H1*    A  24           H1*        A  24  -9.140  -7.563   1.895
  260    H8     A  24           H8         A  24  -5.801  -6.826   0.462
  261   1H6     A  24          H61         A  24  -7.340  -0.821   0.813
  262   2H6     A  24          H62         A  24  -6.009  -1.946   0.547
  263    H2     A  24           H2         A  24 -11.006  -3.199   1.474
  264   1H5*    U  25          H5*         U  25 -11.757  -8.298  -2.238
  265   2H5*    U  25          H5**        U  25 -12.012  -8.090  -3.973
  266    H4*    U  25           H4*        U  25 -12.972  -6.284  -2.639
  267    H3*    U  25           H3*        U  25 -10.804  -5.380  -4.545
  268    H2*    U  25           H2*        U  25 -11.560  -3.161  -3.947
  269   2HO*    U  25          2HO*        U  25 -13.872  -4.025  -3.614
  270    H1*    U  25           H1*        U  25 -11.502  -3.743  -1.224
  271    H3     U  25           H3         U  25  -7.989  -1.002  -2.358
  272    H5     U  25           H5         U  25  -6.584  -4.915  -2.869
  273    H6     U  25           H6         U  25  -8.842  -5.692  -2.578
  274   1H5*    C  26          H5*         C  26 -14.647  -3.375  -5.590
  275   2H5*    C  26          H5**        C  26 -14.731  -3.457  -7.355
  276    H4*    C  26           H4*        C  26 -15.283  -1.259  -6.628
  277    H3*    C  26           H3*        C  26 -12.598  -1.290  -8.078
  278    H2*    C  26           H2*        C  26 -12.781   1.104  -7.877
  279   2HO*    C  26          2HO*        C  26 -15.315   0.727  -8.072
  280    H1*    C  26           H1*        C  26 -13.664   1.045  -5.229
  281   1H4     C  26          H42         C  26  -7.498   2.257  -4.944
  282   2H4     C  26          H41         C  26  -7.085   0.556  -5.121
  283    H5     C  26           H5         C  26  -8.766  -1.132  -5.542
  284    H6     C  26           H6         C  26 -11.159  -1.506  -5.882
  285   1H5*    C  27          H5*         C  27 -11.367   0.854 -10.827
  286   2H5*    C  27          H5**        C  27 -12.845   1.029  -9.908
  287    H4*    C  27           H4*        C  27 -12.915   0.540 -12.867
  288    H3*    C  27           H3*        C  27 -12.423   3.137 -11.428
  289    H2*    C  27           H2*        C  27 -13.890   4.251 -12.918
  290   2HO*    C  27          2HO*        C  27 -13.088   2.461 -14.633
  291    H1*    C  27           H1*        C  27 -15.877   2.275 -12.881
  292   1H4     C  27          H41         C  27 -17.781   6.177  -8.285
  293   2H4     C  27          H42         C  27 -16.679   5.415  -7.137
  294    H5     C  27           H5         C  27 -15.078   3.709  -7.810
  295    H6     C  27           H6         C  27 -14.250   2.464  -9.677
  296   1H5*    A  28          H5*         A  28 -11.566   3.492 -15.814
  297   2H5*    A  28          H5**        A  28  -9.904   4.098 -15.853
  298    H4*    A  28           H4*        A  28 -11.209   5.159 -17.546
  299    H3*    A  28           H3*        A  28 -10.417   7.085 -15.352
  300    H2*    A  28           H2*        A  28 -11.325   8.773 -16.778
  301   2HO*    A  28          2HO*        A  28 -10.456   7.377 -18.713
  302    H1*    A  28           H1*        A  28 -13.533   7.176 -17.563
  303    H8     A  28           H8         A  28 -13.712   6.660 -13.994
  304   1H6     A  28          H62         A  28 -15.957  12.419 -13.384
  305   2H6     A  28          H61         A  28 -15.738  10.873 -12.568
  306    H2     A  28           H2         A  28 -14.240  12.060 -17.445
  307   1H5*    G  29          H5*         G  29  -8.991   8.484 -19.254
  308   2H5*    G  29          H5**        G  29  -7.255   8.205 -19.080
  309    H4*    G  29           H4*        G  29  -7.644  10.092 -20.453
  310    H3*    G  29           H3*        G  29  -5.699  10.199 -18.659
  311    H2*    G  29           H2*        G  29  -7.222  11.089 -16.898
  312   2HO*    G  29          2HO*        G  29  -5.300  12.691 -17.947
  313    H1*    G  29           H1*        G  29  -8.005  13.017 -19.159
  314    H8     G  29           H8         G  29  -9.864  11.149 -16.308
  315    H1     G  29           H1         G  29 -10.722  17.503 -16.572
  316   1H2     G  29          H22         G  29  -9.465  18.362 -18.180
  317   2H2     G  29          H21         G  29  -8.438  17.332 -19.158
  318   1H5*    U  30          H5*         U  30  -3.575  14.163 -17.753
  319   2H5*    U  30          H5**        U  30  -4.323  14.420 -19.334
  320    H4*    U  30           H4*        U  30  -2.277  13.952 -20.463
  321    H3*    U  30           H3*        U  30  -1.328  12.320 -18.589
  322    H2*    U  30           H2*        U  30  -1.223  14.148 -16.929
  323   2HO*    U  30          2HO*        U  30   1.241  13.402 -18.091
  324    H1*    U  30           H1*        U  30   0.161  15.654 -19.222
  325    H3     U  30           H3         U  30   1.505  19.035 -16.553
  326    H5     U  30           H5         U  30  -2.400  18.318 -15.237
  327    H6     U  30           H6         U  30  -2.498  16.452 -16.767
  328   1H5*    G  31          H5*         G  31   2.619  14.132 -20.162
  329   2H5*    G  31          H5**        G  31   3.639  12.732 -20.521
  330    H4*    G  31           H4*        G  31   4.474  14.709 -19.018
  331    H3*    G  31           H3*        G  31   5.174  11.804 -18.549
  332    H2*    G  31           H2*        G  31   6.605  12.640 -16.822
  333   2HO*    G  31          2HO*        G  31   6.830  14.740 -18.336
  334    H1*    G  31           H1*        G  31   4.682  14.445 -15.829
  335    H8     G  31           H8         G  31   3.278  11.073 -16.898
  336    H1     G  31           H1         G  31   5.473  11.322 -10.884
  337   1H2     G  31          H21         G  31   6.376  12.896 -10.476
  338   2H2     G  31          H22         G  31   6.730  14.267 -11.390
  339   1H5*    G  32          H5*         G  32   8.723  13.901 -18.851
  340   2H5*    G  32          H5**        G  32   9.901  13.000 -19.818
  341    H4*    G  32           H4*        G  32  10.856  13.532 -17.686
  342    H3*    G  32           H3*        G  32  10.245  10.582 -17.931
  343    H2*    G  32           H2*        G  32  11.418  10.392 -15.867
  344   2HO*    G  32          2HO*        G  32  13.138  11.781 -16.020
  345    H1*    G  32           H1*        G  32  10.231  12.668 -14.739
  346    H8     G  32           H8         G  32   7.615  10.634 -16.479
  347    H1     G  32           H1         G  32   9.452   8.251 -10.823
  348   1H2     G  32          H21         G  32  10.926   9.047 -10.117
  349   2H2     G  32          H22         G  32  11.918  10.304 -10.635
  350   1H5*    U  33          H5*         U  33  14.816  11.109 -18.747
  351   2H5*    U  33          H5**        U  33  15.613   9.549 -18.831
  352    H4*    U  33           H4*        U  33  15.934  11.089 -16.777
  353    H3*    U  33           H3*        U  33  15.626   8.100 -16.656
  354    H2*    U  33           H2*        U  33  15.859   8.349 -14.227
  355   2HO*    U  33          2HO*        U  33  17.339  10.383 -14.836
  356    H1*    U  33           H1*        U  33  14.121  10.455 -14.015
  357    H3     U  33           H3         U  33  12.170   6.619 -12.345
  358    H5     U  33           H5         U  33  10.972   6.929 -16.374
  359    H6     U  33           H6         U  33  12.599   8.649 -16.631
  360   1H5*    C  34          H5*         C  34  19.792   8.664 -15.057
  361   2H5*    C  34          H5**        C  34  20.794   7.405 -15.802
  362    H4*    C  34           H4*        C  34  20.844   7.259 -13.372
  363    H3*    C  34           H3*        C  34  19.574   4.903 -14.774
  364    H2*    C  34           H2*        C  34  19.277   3.916 -12.606
  365   2HO*    C  34          2HO*        C  34  21.366   5.253 -11.912
  366    H1*    C  34           H1*        C  34  18.166   6.158 -11.470
  367   1H4     C  34          H41         C  34  13.531   2.755 -13.979
  368   2H4     C  34          H42         C  34  13.151   3.817 -15.214
  369    H5     C  34           H5         C  34  14.927   5.824 -15.601
  370    H6     C  34           H6         C  34  16.958   6.749 -14.648
  371   1H5*    C  35          H5*         C  35  21.137   2.355 -11.469
  372   2H5*    C  35          H5**        C  35  22.714   2.410 -12.272
  373    H4*    C  35           H4*        C  35  22.431   0.170 -11.732
  374    H3*    C  35           H3*        C  35  21.555   0.471 -14.621
  375    H2*    C  35           H2*        C  35  21.375  -1.902 -14.636
  376   2HO*    C  35          2HO*        C  35  23.206  -1.995 -12.899
  377    H1*    C  35           H1*        C  35  19.833  -1.931 -12.328
  378   1H4     C  35          H42         C  35  15.789  -1.168 -17.154
  379   2H4     C  35          H41         C  35  15.877   0.585 -16.993
  380    H5     C  35           H5         C  35  17.429   1.652 -15.471
  381    H6     C  35           H6         C  35  19.165   1.255 -13.822
  382    H3T    C  35           H3T        C  35  23.660   0.956 -14.271
  Start of MODEL    5
    1   1H5*    G   1          H5*         G   1  13.265  -2.868 -20.086
    2   2H5*    G   1          H5**        G   1  12.001  -2.530 -18.907
    3    H4*    G   1           H4*        G   1  14.102  -2.370 -17.890
    4    H3*    G   1           H3*        G   1  12.277  -0.278 -17.655
    5    H2*    G   1           H2*        G   1  13.530   1.488 -18.386
    6   2HO*    G   1          2HO*        G   1  14.069   1.338 -15.951
    7    H1*    G   1           H1*        G   1  16.227   0.136 -18.078
    8    H8     G   1           H8         G   1  13.911   0.923 -21.036
    9    H1     G   1           H1         G   1  19.346   4.325 -20.844
   10   1H2     G   1          H22         G   1  20.474   3.887 -19.078
   11   2H2     G   1          H21         G   1  19.890   2.734 -17.883
   12    H5T    G   1           H5T        G   1  11.643  -1.534 -20.963
   13   1H5*    G   2          H5*         G   2  14.153  -0.018 -13.254
   14   2H5*    G   2          H5**        G   2  12.702   0.478 -12.382
   15    H4*    G   2           H4*        G   2  14.713   1.977 -12.231
   16    H3*    G   2           H3*        G   2  12.092   3.256 -13.053
   17    H2*    G   2           H2*        G   2  13.317   5.312 -12.874
   18   2HO*    G   2          2HO*        G   2  14.613   4.109 -10.981
   19    H1*    G   2           H1*        G   2  15.657   4.227 -14.061
   20    H8     G   2           H8         G   2  12.405   3.392 -15.859
   21    H1     G   2           H1         G   2  15.173   8.951 -17.516
   22   1H2     G   2          H22         G   2  16.829   9.410 -16.188
   23   2H2     G   2          H21         G   2  17.204   8.333 -14.857
   24   1H5*    A   3          H5*         A   3  13.614   5.167  -9.375
   25   2H5*    A   3          H5**        A   3  12.258   5.950  -8.556
   26    H4*    A   3           H4*        A   3  14.186   7.421  -9.274
   27    H3*    A   3           H3*        A   3  11.391   8.216 -10.138
   28    H2*    A   3           H2*        A   3  12.456  10.227 -10.910
   29   2HO*    A   3          2HO*        A   3  14.091   9.917  -8.960
   30    H1*    A   3           H1*        A   3  14.627   8.862 -12.048
   31    H8     A   3           H8         A   3  11.548   6.916 -12.891
   32   1H6     A   3          H61         A   3  10.689  11.167 -17.390
   33   2H6     A   3          H62         A   3  10.100   9.619 -16.963
   34    H2     A   3           H2         A   3  13.808  12.624 -14.791
   35   1H5*    C   4          H5*         C   4  13.068  11.615  -8.237
   36   2H5*    C   4          H5**        C   4  11.782  12.397  -7.303
   37    H4*    C   4           H4*        C   4  12.912  13.848  -8.994
   38    H3*    C   4           H3*        C   4   9.911  13.552  -9.020
   39    H2*    C   4           H2*        C   4   9.861  15.019 -10.890
   40   2HO*    C   4          2HO*        C   4  11.831  16.176  -9.684
   41    H1*    C   4           H1*        C   4  12.244  14.066 -12.109
   42   1H4     C   4          H41         C   4   7.487  11.951 -15.560
   43   2H4     C   4          H42         C   4   7.350  10.419 -14.883
   44    H5     C   4           H5         C   4   8.771  10.064 -12.601
   45    H6     C   4           H6         C   4  10.409  11.169 -11.169
   46   1H5*    C   5          H5*         C   5   9.943  17.566  -9.473
   47   2H5*    C   5          H5**        C   5   9.028  18.210  -8.102
   48    H4*    C   5           H4*        C   5   8.007  19.052 -10.006
   49    H3*    C   5           H3*        C   5   6.287  16.829  -8.914
   50    H2*    C   5           H2*        C   5   4.736  17.407 -10.618
   51   2HO*    C   5          2HO*        C   5   5.395  19.799 -10.179
   52    H1*    C   5           H1*        C   5   6.747  18.027 -12.554
   53   1H4     C   5          H42         C   5   4.501  12.400 -14.651
   54   2H4     C   5          H41         C   5   5.205  11.647 -13.248
   55    H5     C   5           H5         C   5   6.295  12.754 -11.477
   56    H6     C   5           H6         C   5   7.005  14.922 -10.605
   57   1H5*    C   6          H5*         C   6   4.028  20.602  -8.305
   58   2H5*    C   6          H5**        C   6   3.587  20.619  -6.592
   59    H4*    C   6           H4*        C   6   1.670  21.220  -7.744
   60    H3*    C   6           H3*        C   6   1.359  18.306  -6.985
   61    H2*    C   6           H2*        C   6  -0.906  18.630  -7.704
   62   2HO*    C   6          2HO*        C   6  -1.292  20.772  -6.957
   63    H1*    C   6           H1*        C   6  -0.088  20.029 -10.025
   64   1H4     C   6          H41         C   6  -1.289  14.082 -11.708
   65   2H4     C   6          H42         C   6   0.364  13.589 -11.354
   66    H5     C   6           H5         C   6   1.950  15.112 -10.319
   67    H6     C   6           H6         C   6   2.243  17.371  -9.430
   68   1H5*    G   7          H5*         G   7  -1.680  20.967  -4.201
   69   2H5*    G   7          H5**        G   7  -1.653  19.852  -2.823
   70    H4*    G   7           H4*        G   7  -3.919  20.420  -3.345
   71    H3*    G   7           H3*        G   7  -3.255  17.555  -4.029
   72    H2*    G   7           H2*        G   7  -5.557  17.311  -4.592
   73   2HO*    G   7          2HO*        G   7  -6.072  18.782  -2.648
   74    H1*    G   7           H1*        G   7  -5.776  19.912  -5.739
   75    H8     G   7           H8         G   7  -2.995  17.352  -6.625
   76    H1     G   7           H1         G   7  -7.978  17.703 -10.648
   77   1H2     G   7          H22         G   7  -9.493  19.092  -9.849
   78   2H2     G   7          H21         G   7  -9.238  19.911  -8.320
   79   1H5*    C   8          H5*         C   8  -6.643  17.999  -1.070
   80   2H5*    C   8          H5**        C   8  -6.200  16.890   0.239
   81    H4*    C   8           H4*        C   8  -8.602  16.847  -0.318
   82    H3*    C   8           H3*        C   8  -7.005  14.305  -0.550
   83    H2*    C   8           H2*        C   8  -9.045  13.206  -1.184
   84   2HO*    C   8          2HO*        C   8 -10.103  14.785   0.540
   85    H1*    C   8           H1*        C   8 -10.102  15.444  -2.632
   86   1H4     C   8          H41         C   8  -8.588  11.477  -7.242
   87   2H4     C   8          H42         C   8  -6.859  11.743  -7.030
   88    H5     C   8           H5         C   8  -6.000  13.125  -5.229
   89    H6     C   8           H6         C   8  -6.628  14.498  -3.301
   90   1H5*    C   9          H5*         C   9 -10.291  11.895   0.778
   91   2H5*    C   9          H5**        C   9 -10.026  12.386   2.463
   92    H4*    C   9           H4*        C   9 -10.383   9.979   2.183
   93    H3*    C   9           H3*        C   9  -7.638  10.737   3.220
   94    H2*    C   9           H2*        C   9  -7.517   8.387   3.763
   95   2HO*    C   9          2HO*        C   9  -9.398   7.347   4.055
   96    H1*    C   9           H1*        C   9  -8.280   7.708   1.165
   97   1H4     C   9          H42         C   9  -1.962   8.053   1.381
   98   2H4     C   9          H41         C   9  -2.005   9.774   1.010
   99    H5     C   9           H5         C   9  -4.072  11.006   0.878
  100    H6     C   9           H6         C   9  -6.494  10.833   1.070
  101   1H5*    A  10          H5*         A  10 -10.532   8.738   5.690
  102   2H5*    A  10          H5**        A  10 -10.232   8.742   7.432
  103    H4*    A  10           H4*        A  10 -10.669   6.501   6.516
  104    H3*    A  10           H3*        A  10  -7.962   6.900   7.798
  105    H2*    A  10           H2*        A  10  -7.721   4.524   7.552
  106   2HO*    A  10          2HO*        A  10  -9.565   3.382   7.739
  107    H1*    A  10           H1*        A  10  -8.850   4.508   4.969
  108    H8     A  10           H8         A  10  -6.219   7.207   5.864
  109   1H6     A  10          H62         A  10  -2.234   3.257   3.173
  110   2H6     A  10          H61         A  10  -2.377   4.864   3.884
  111    H2     A  10           H2         A  10  -6.158   1.272   3.349
  112   1H5*    C  11          H5*         C  11 -11.027   4.190   9.225
  113   2H5*    C  11          H5**        C  11 -10.957   3.826  10.952
  114    H4*    C  11           H4*        C  11 -11.277   1.830   9.506
  115    H3*    C  11           H3*        C  11  -8.917   1.932  11.368
  116    H2*    C  11           H2*        C  11  -8.440  -0.307  10.671
  117   2HO*    C  11          2HO*        C  11 -10.471  -1.285  10.529
  118    H1*    C  11           H1*        C  11  -9.020   0.165   7.940
  119   1H4     C  11          H42         C  11  -2.747   0.642   7.988
  120   2H4     C  11          H41         C  11  -2.808   2.265   8.670
  121    H5     C  11           H5         C  11  -4.898   3.280   9.364
  122    H6     C  11           H6         C  11  -7.296   2.920   9.548
  123   1H5*    U  12          H5*         U  12 -12.438  -0.790  11.930
  124   2H5*    U  12          H5**        U  12 -12.668  -1.253  13.618
  125    H4*    U  12           H4*        U  12 -12.972  -3.095  11.997
  126    H3*    U  12           H3*        U  12 -10.910  -3.482  14.167
  127    H2*    U  12           H2*        U  12 -10.581  -5.659  13.249
  128   2HO*    U  12          2HO*        U  12 -12.409  -6.611  12.661
  129    H1*    U  12           H1*        U  12 -10.972  -4.869  10.535
  130    H3     U  12           H3         U  12  -6.789  -6.793  10.964
  131    H5     U  12           H5         U  12  -6.311  -2.674  11.672
  132    H6     U  12           H6         U  12  -8.698  -2.488  11.764
  133   1H5*    G  13          H5*         G  13 -14.266  -6.324  13.888
  134   2H5*    G  13          H5**        G  13 -14.555  -7.252  15.364
  135    H4*    G  13           H4*        G  13 -14.067  -8.548  13.218
  136    H3*    G  13           H3*        G  13 -12.635  -9.157  15.797
  137    H2*    G  13           H2*        G  13 -11.571 -10.942  14.639
  138   2HO*    G  13          2HO*        G  13 -12.208 -11.513  12.475
  139    H1*    G  13           H1*        G  13 -11.152  -9.470  12.254
  140    H8     G  13           H8         G  13 -10.388  -7.466  15.359
  141    H1     G  13           H1         G  13  -5.511 -11.003  13.203
  142   1H2     G  13          H21         G  13  -5.959 -12.189  11.870
  143   2H2     G  13          H22         G  13  -7.381 -12.564  11.078
  144   1H5*    C  14          H5*         C  14 -13.651 -12.576  14.715
  145   2H5*    C  14          H5**        C  14 -14.566 -13.463  15.938
  146    H4*    C  14           H4*        C  14 -12.732 -14.791  15.408
  147    H3*    C  14           H3*        C  14 -12.248 -13.460  18.062
  148    H2*    C  14           H2*        C  14 -10.355 -14.845  18.235
  149   2HO*    C  14          2HO*        C  14 -10.510 -16.832  17.426
  150    H1*    C  14           H1*        C  14  -9.717 -14.627  15.464
  151   1H4     C  14          H42         C  14  -5.324 -11.311  18.715
  152   2H4     C  14          H41         C  14  -6.358  -9.907  18.559
  153    H5     C  14           H5         C  14  -8.577  -9.925  17.664
  154    H6     C  14           H6         C  14 -10.319 -11.334  16.699
  155   1H5*    A  15          H5*         A  15 -12.546 -17.758  17.892
  156   2H5*    A  15          H5**        A  15 -13.120 -18.465  19.409
  157    H4*    A  15           H4*        A  15 -11.096 -19.559  18.686
  158    H3*    A  15           H3*        A  15 -10.773 -17.920  21.217
  159    H2*    A  15           H2*        A  15  -8.598 -18.901  21.342
  160   2HO*    A  15          2HO*        A  15  -9.494 -21.025  20.477
  161    H1*    A  15           H1*        A  15  -8.086 -18.636  18.589
  162    H8     A  15           H8         A  15  -9.703 -15.655  20.413
  163   1H6     A  15          H62         A  15  -3.874 -13.520  20.929
  164   2H6     A  15          H61         A  15  -5.567 -13.132  21.193
  165    H2     A  15           H2         A  15  -3.690 -17.588  19.234
  166   1H5*    G  16          H5*         G  16 -10.390 -21.835  22.685
  167   2H5*    G  16          H5**        G  16 -10.807 -21.867  24.397
  168    H4*    G  16           H4*        G  16  -8.491 -22.346  24.033
  169    H3*    G  16           H3*        G  16  -8.831 -19.698  25.469
  170    H2*    G  16           H2*        G  16  -6.442 -20.094  25.985
  171   2HO*    G  16          2HO*        G  16  -5.624 -22.101  25.504
  172    H1*    G  16           H1*        G  16  -6.012 -20.143  23.237
  173    H8     G  16           H8         G  16  -9.289 -18.354  23.962
  174    H1     G  16           H1         G  16  -4.267 -14.406  23.631
  175   1H2     G  16          H22         G  16  -2.432 -15.502  23.528
  176   2H2     G  16          H21         G  16  -2.379 -17.253  23.553
  177   1H5*    A  17          H5*         A  17  -6.496 -19.151  28.772
  178   2H5*    A  17          H5**        A  17  -6.679 -20.642  27.871
  179    H4*    A  17           H4*        A  17  -8.002 -20.499  30.509
  180    H3*    A  17           H3*        A  17  -5.134 -20.095  30.116
  181    H2*    A  17           H2*        A  17  -4.325 -22.081  30.869
  182   2HO*    A  17          2HO*        A  17  -5.811 -21.718  32.844
  183    H1*    A  17           H1*        A  17  -6.527 -23.809  30.315
  184    H8     A  17           H8         A  17  -6.632 -22.768  27.129
  185   1H6     A  17          H62         A  17  -1.130 -25.333  25.785
  186   2H6     A  17          H61         A  17  -2.612 -24.685  25.095
  187    H2     A  17           H2         A  17  -1.453 -25.011  30.191
  188   1H5*    G  18          H5*         G  18  -3.941 -16.585  30.128
  189   2H5*    G  18          H5**        G  18  -4.694 -18.085  29.614
  190    H4*    G  18           H4*        G  18  -2.441 -18.308  31.499
  191    H3*    G  18           H3*        G  18  -1.770 -17.647  28.636
  192    H2*    G  18           H2*        G  18   0.146 -18.996  29.101
  193   2HO*    G  18          2HO*        G  18  -0.027 -18.038  31.492
  194    H1*    G  18           H1*        G  18  -1.433 -20.833  30.648
  195    H8     G  18           H8         G  18  -3.184 -20.631  27.491
  196    H1     G  18           H1         G  18   2.435 -23.691  26.912
  197   1H2     G  18          H21         G  18   3.678 -23.321  28.707
  198   2H2     G  18          H22         G  18   3.073 -22.317  30.012
  199   1H5*    A  19          H5*         A  19   1.903 -17.072  29.615
  200   2H5*    A  19          H5**        A  19   2.482 -15.669  28.708
  201    H4*    A  19           H4*        A  19   3.580 -17.729  28.023
  202    H3*    A  19           H3*        A  19   1.958 -16.374  25.860
  203    H2*    A  19           H2*        A  19   2.776 -18.096  24.399
  204   2HO*    A  19          2HO*        A  19   4.880 -18.071  25.853
  205    H1*    A  19           H1*        A  19   2.278 -20.180  26.127
  206    H8     A  19           H8         A  19  -0.371 -17.446  26.400
  207   1H6     A  19          H62         A  19  -3.413 -20.534  21.965
  208   2H6     A  19          H61         A  19  -3.547 -19.199  23.096
  209    H2     A  19           H2         A  19   0.573 -22.382  22.410
  210   1H5*    U  20          H5*         U  20   4.814 -16.896  23.589
  211   2H5*    U  20          H5**        U  20   5.029 -15.530  22.490
  212    H4*    U  20           H4*        U  20   4.097 -17.745  21.636
  213    H3*    U  20           H3*        U  20   2.926 -15.154  20.688
  214    H2*    U  20           H2*        U  20   1.559 -16.534  19.264
  215   2HO*    U  20          2HO*        U  20   3.474 -18.217  19.254
  216    H1*    U  20           H1*        U  20   0.739 -18.230  21.273
  217    H3     U  20           H3         U  20  -2.591 -15.169  20.487
  218    H5     U  20           H5         U  20   0.035 -13.395  23.263
  219    H6     U  20           H6         U  20   1.490 -15.156  22.902
  220   1H5*    G  21          H5*         G  21   3.600 -17.519  17.251
  221   2H5*    G  21          H5**        G  21   4.112 -16.452  15.939
  222    H4*    G  21           H4*        G  21   2.061 -17.758  15.462
  223    H3*    G  21           H3*        G  21   1.862 -14.750  15.291
  224    H2*    G  21           H2*        G  21  -0.392 -15.105  14.524
  225   2HO*    G  21          2HO*        G  21   0.521 -17.330  13.562
  226    H1*    G  21           H1*        G  21  -1.009 -17.019  16.445
  227    H8     G  21           H8         G  21   1.172 -14.282  17.886
  228    H1     G  21           H1         G  21  -5.093 -12.982  17.742
  229   1H2     G  21          H21         G  21  -6.056 -14.189  16.774
  230   2H2     G  21          H22         G  21  -5.676 -15.603  15.957
  231   1H5*    C  22          H5*         C  22   0.549 -17.061  11.684
  232   2H5*    C  22          H5**        C  22   1.076 -16.148  10.269
  233    H4*    C  22           H4*        C  22  -1.260 -17.004  10.213
  234    H3*    C  22           H3*        C  22  -0.796 -14.058   9.719
  235    H2*    C  22           H2*        C  22  -3.128 -14.007   9.163
  236   2HO*    C  22          2HO*        C  22  -2.805 -16.452   8.406
  237    H1*    C  22           H1*        C  22  -3.908 -15.532  11.385
  238   1H4     C  22          H41         C  22  -4.489  -9.422  12.791
  239   2H4     C  22          H42         C  22  -3.248  -9.427  13.964
  240    H5     C  22           H5         C  22  -1.683 -11.578  13.993
  241    H6     C  22           H6         C  22  -1.459 -13.789  13.012
  242   1H5*    A  23          H5*         A  23  -2.687 -15.759   6.406
  243   2H5*    A  23          H5**        A  23  -2.360 -14.948   4.877
  244    H4*    A  23           H4*        A  23  -4.736 -15.081   5.724
  245    H3*    A  23           H3*        A  23  -3.628 -13.130   4.093
  246    H2*    A  23           H2*        A  23  -3.982 -11.241   5.382
  247   2HO*    A  23          2HO*        A  23  -6.263 -11.764   4.182
  248    H1*    A  23           H1*        A  23  -6.089 -12.448   7.189
  249    H8     A  23           H8         A  23  -2.351 -11.741   7.716
  250   1H6     A  23          H62         A  23  -4.198  -6.911  11.120
  251   2H6     A  23          H61         A  23  -2.815  -7.860  10.585
  252    H2     A  23           H2         A  23  -7.813  -8.768   9.316
  253   1H5*    A  24          H5*         A  24  -8.309 -13.221   3.545
  254   2H5*    A  24          H5**        A  24  -8.520 -12.998   1.802
  255    H4*    A  24           H4*        A  24 -10.038 -11.618   3.136
  256    H3*    A  24           H3*        A  24  -8.067 -10.081   1.434
  257    H2*    A  24           H2*        A  24  -9.349  -8.143   2.104
  258   2HO*    A  24          2HO*        A  24 -11.367  -9.712   2.041
  259    H1*    A  24           H1*        A  24  -9.597  -9.043   4.768
  260    H8     A  24           H8         A  24  -6.033  -9.401   3.611
  261   1H6     A  24          H61         A  24  -5.425  -3.383   5.047
  262   2H6     A  24          H62         A  24  -4.540  -4.848   4.604
  263    H2     A  24           H2         A  24  -9.724  -4.398   5.199
  264   1H5*    U  25          H5*         U  25 -10.858  -7.643   0.375
  265   2H5*    U  25          H5**        U  25 -10.681  -7.481  -1.373
  266    H4*    U  25           H4*        U  25 -10.294  -5.397  -0.295
  267    H3*    U  25           H3*        U  25  -7.763  -6.454  -1.577
  268    H2*    U  25           H2*        U  25  -6.915  -4.235  -1.102
  269   2HO*    U  25          2HO*        U  25  -9.378  -3.471  -1.241
  270    H1*    U  25           H1*        U  25  -7.697  -4.334   1.539
  271    H3     U  25           H3         U  25  -3.190  -5.180   1.289
  272    H5     U  25           H5         U  25  -5.036  -8.905   0.815
  273    H6     U  25           H6         U  25  -7.137  -7.759   0.634
  274   1H5*    C  26          H5*         C  26  -8.977  -2.631  -2.868
  275   2H5*    C  26          H5**        C  26  -8.870  -2.500  -4.624
  276    H4*    C  26           H4*        C  26  -7.991  -0.538  -3.558
  277    H3*    C  26           H3*        C  26  -5.897  -2.154  -5.019
  278    H2*    C  26           H2*        C  26  -4.533  -0.183  -4.681
  279   2HO*    C  26          2HO*        C  26  -6.528   1.240  -4.828
  280    H1*    C  26           H1*        C  26  -5.164  -0.083  -1.942
  281   1H4     C  26          H42         C  26   0.072  -3.563  -2.762
  282   2H4     C  26          H41         C  26  -0.868  -5.048  -2.636
  283    H5     C  26           H5         C  26  -3.305  -4.994  -2.545
  284    H6     C  26           H6         C  26  -5.250  -3.542  -2.563
  285   1H5*    C  27          H5*         C  27  -7.007   2.011  -6.512
  286   2H5*    C  27          H5**        C  27  -7.512   1.608  -8.163
  287    H4*    C  27           H4*        C  27  -6.502   3.832  -8.015
  288    H3*    C  27           H3*        C  27  -5.199   1.759  -9.768
  289    H2*    C  27           H2*        C  27  -3.534   3.334 -10.349
  290   2HO*    C  27          2HO*        C  27  -5.509   5.057 -10.076
  291    H1*    C  27           H1*        C  27  -3.323   4.528  -7.792
  292   1H4     C  27          H41         C  27   1.739   0.786  -8.251
  293   2H4     C  27          H42         C  27   0.871  -0.523  -7.453
  294    H5     C  27           H5         C  27  -1.492  -0.365  -6.953
  295    H6     C  27           H6         C  27  -3.460   1.056  -7.120
  296   1H5*    A  28          H5*         A  28  -4.968   4.467 -12.288
  297   2H5*    A  28          H5**        A  28  -6.196   4.270 -13.546
  298    H4*    A  28           H4*        A  28  -4.091   4.754 -14.551
  299    H3*    A  28           H3*        A  28  -4.990   1.915 -15.059
  300    H2*    A  28           H2*        A  28  -3.142   1.801 -16.564
  301   2HO*    A  28          2HO*        A  28  -3.150   3.863 -17.558
  302    H1*    A  28           H1*        A  28  -1.402   3.197 -14.823
  303    H8     A  28           H8         A  28  -3.000   0.843 -12.545
  304   1H6     A  28          H62         A  28   0.716  -3.599 -14.832
  305   2H6     A  28          H61         A  28  -0.394  -3.199 -13.523
  306    H2     A  28           H2         A  28   0.942  -0.113 -17.529
  307   1H5*    G  29          H5*         G  29  -6.740   3.772 -19.698
  308   2H5*    G  29          H5**        G  29  -5.438   2.875 -20.479
  309    H4*    G  29           H4*        G  29  -5.107   5.134 -18.509
  310    H3*    G  29           H3*        G  29  -5.596   5.739 -21.014
  311    H2*    G  29           H2*        G  29  -4.147   3.974 -21.883
  312   2HO*    G  29          2HO*        G  29  -2.205   5.122 -22.651
  313    H1*    G  29           H1*        G  29  -1.913   5.042 -20.081
  314    H8     G  29           H8         G  29  -2.292   1.763 -19.050
  315    H1     G  29           H1         G  29   0.601   1.672 -24.771
  316   1H2     G  29          H22         G  29   0.324   3.614 -25.777
  317   2H2     G  29          H21         G  29  -0.573   4.912 -25.016
  318   1H5*    U  30          H5*         U  30  -1.894   8.864 -21.312
  319   2H5*    U  30          H5**        U  30  -2.882  10.133 -20.571
  320    H4*    U  30           H4*        U  30  -2.403   9.760 -23.517
  321    H3*    U  30           H3*        U  30  -0.401  10.804 -22.187
  322    H2*    U  30           H2*        U  30  -1.929  12.188 -20.769
  323   2HO*    U  30          2HO*        U  30  -0.159  13.407 -22.352
  324    H1*    U  30           H1*        U  30  -3.043  13.189 -23.448
  325    H3     U  30           H3         U  30  -5.435  16.280 -21.154
  326    H5     U  30           H5         U  30  -6.420  12.676 -19.272
  327    H6     U  30           H6         U  30  -4.753  11.594 -20.641
  328   1H5*    G  31          H5*         G  31   0.032  14.573 -24.199
  329   2H5*    G  31          H5**        G  31   1.427  14.230 -25.239
  330    H4*    G  31           H4*        G  31   1.831  16.180 -23.848
  331    H3*    G  31           H3*        G  31   3.560  13.768 -23.312
  332    H2*    G  31           H2*        G  31   4.741  15.036 -21.753
  333   2HO*    G  31          2HO*        G  31   5.021  17.128 -22.111
  334    H1*    G  31           H1*        G  31   2.467  16.296 -20.649
  335    H8     G  31           H8         G  31   2.215  12.567 -21.406
  336    H1     G  31           H1         G  31   4.566  14.039 -15.634
  337   1H2     G  31          H21         G  31   4.900  15.852 -15.391
  338   2H2     G  31          H22         G  31   4.698  17.185 -16.402
  339   1H5*    G  32          H5*         G  32   5.970  16.889 -24.128
  340   2H5*    G  32          H5**        G  32   7.360  16.466 -25.141
  341    H4*    G  32           H4*        G  32   8.162  17.433 -23.122
  342    H3*    G  32           H3*        G  32   8.636  14.439 -23.133
  343    H2*    G  32           H2*        G  32  10.001  14.920 -21.217
  344   2HO*    G  32          2HO*        G  32  10.772  17.029 -22.047
  345    H1*    G  32           H1*        G  32   8.065  16.553 -20.070
  346    H8     G  32           H8         G  32   6.329  13.615 -21.630
  347    H1     G  32           H1         G  32   9.251  12.297 -16.086
  348   1H2     G  32          H21         G  32  10.373  13.651 -15.491
  349   2H2     G  32          H22         G  32  10.750  15.173 -16.106
  350   1H5*    U  33          H5*         U  33  12.958  15.785 -24.781
  351   2H5*    U  33          H5**        U  33  13.833  14.306 -24.497
  352    H4*    U  33           H4*        U  33  13.823  16.459 -22.873
  353    H3*    U  33           H3*        U  33  14.664  13.618 -22.348
  354    H2*    U  33           H2*        U  33  14.890  14.246 -20.012
  355   2HO*    U  33          2HO*        U  33  15.439  16.589 -20.997
  356    H1*    U  33           H1*        U  33  12.510  15.620 -19.818
  357    H3     U  33           H3         U  33  12.312  11.417 -17.778
  358    H5     U  33           H5         U  33  10.358  11.167 -21.502
  359    H6     U  33           H6         U  33  11.288  13.288 -22.040
  360   1H5*    C  34          H5*         C  34  18.258  15.957 -21.201
  361   2H5*    C  34          H5**        C  34  19.670  15.172 -21.932
  362    H4*    C  34           H4*        C  34  19.854  15.321 -19.499
  363    H3*    C  34           H3*        C  34  19.794  12.546 -20.674
  364    H2*    C  34           H2*        C  34  19.987  11.684 -18.451
  365   2HO*    C  34          2HO*        C  34  21.252  13.882 -17.947
  366    H1*    C  34           H1*        C  34  18.038  13.315 -17.350
  367   1H4     C  34          H41         C  34  15.253   8.042 -19.239
  368   2H4     C  34          H42         C  34  14.340   8.743 -20.490
  369    H5     C  34           H5         C  34  15.033  11.291 -21.141
  370    H6     C  34           H6         C  34  16.501  13.065 -20.411
  371   1H5*    C  35          H5*         C  35  22.959  11.551 -17.588
  372   2H5*    C  35          H5**        C  35  24.270  11.719 -18.770
  373    H4*    C  35           H4*        C  35  24.649   9.701 -17.671
  374    H3*    C  35           H3*        C  35  23.454   9.125 -20.388
  375    H2*    C  35           H2*        C  35  23.906   6.822 -19.910
  376   2HO*    C  35          2HO*        C  35  25.387   6.298 -18.387
  377    H1*    C  35           H1*        C  35  22.612   6.933 -17.462
  378   1H4     C  35          H42         C  35  18.136   5.879 -21.901
  379   2H4     C  35          H41         C  35  17.734   7.585 -21.836
  380    H5     C  35           H5         C  35  19.001   9.183 -20.607
  381    H6     C  35           H6         C  35  20.922   9.504 -19.162
  382    H3T    C  35           H3T        C  35  26.072   8.806 -19.446
  Start of MODEL    6
    1   1H5*    G   1          H5*         G   1  19.937   0.932 -21.507
    2   2H5*    G   1          H5**        G   1  18.723   1.026 -20.233
    3    H4*    G   1           H4*        G   1  20.879   1.885 -19.576
    4    H3*    G   1           H3*        G   1  18.468   3.155 -18.983
    5    H2*    G   1           H2*        G   1  18.841   5.239 -19.859
    6   2HO*    G   1          2HO*        G   1  19.812   5.333 -17.538
    7    H1*    G   1           H1*        G   1  21.860   4.976 -20.018
    8    H8     G   1           H8         G   1  18.994   4.796 -22.574
    9    H1     G   1           H1         G   1  22.811   9.911 -23.141
   10   1H2     G   1          H22         G   1  24.276   9.974 -21.574
   11   2H2     G   1          H21         G   1  24.328   8.726 -20.330
   12    H5T    G   1           H5T        G   1  19.007   2.804 -22.436
   13   1H5*    G   2          H5*         G   2  20.846   4.230 -14.970
   14   2H5*    G   2          H5**        G   2  19.494   4.137 -13.836
   15    H4*    G   2           H4*        G   2  20.740   6.312 -13.937
   16    H3*    G   2           H3*        G   2  17.732   6.411 -14.309
   17    H2*    G   2           H2*        G   2  18.029   8.790 -14.283
   18   2HO*    G   2          2HO*        G   2  19.959   8.280 -12.626
   19    H1*    G   2           H1*        G   2  20.426   8.695 -15.814
   20    H8     G   2           H8         G   2  17.599   6.569 -17.199
   21    H1     G   2           H1         G   2  17.613  12.733 -19.019
   22   1H2     G   2          H22         G   2  19.083  13.865 -17.888
   23   2H2     G   2          H21         G   2  20.030  13.065 -16.646
   24   1H5*    A   3          H5*         A   3  18.865   8.952 -10.890
   25   2H5*    A   3          H5**        A   3  17.456   9.085  -9.833
   26    H4*    A   3           H4*        A   3  18.383  11.233 -10.763
   27    H3*    A   3           H3*        A   3  15.437  10.667 -11.203
   28    H2*    A   3           H2*        A   3  15.374  12.915 -12.048
   29   2HO*    A   3          2HO*        A   3  17.193  13.445 -10.339
   30    H1*    A   3           H1*        A   3  17.757  12.640 -13.505
   31    H8     A   3           H8         A   3  15.798   9.508 -14.045
   32   1H6     A   3          H61         A   3  12.511  12.847 -18.180
   33   2H6     A   3          H62         A   3  12.747  11.205 -17.761
   34    H2     A   3           H2         A   3  14.955  15.592 -15.928
   35   1H5*    C   4          H5*         C   4  15.689  14.543  -9.215
   36   2H5*    C   4          H5**        C   4  14.254  14.646  -8.183
   37    H4*    C   4           H4*        C   4  14.525  16.474  -9.874
   38    H3*    C   4           H3*        C   4  11.934  14.926  -9.765
   39    H2*    C   4           H2*        C   4  11.159  16.397 -11.495
   40   2HO*    C   4          2HO*        C   4  12.659  18.145 -10.334
   41    H1*    C   4           H1*        C   4  13.564  16.383 -12.966
   42   1H4     C   4          H41         C   4   9.639  12.377 -15.818
   43   2H4     C   4          H42         C   4  10.292  10.976 -15.176
   44    H5     C   4           H5         C   4  12.029  11.303 -13.168
   45    H6     C   4           H6         C   4  13.236  13.020 -11.927
   46   1H5*    C   5          H5*         C   5  10.202  18.251 -10.031
   47   2H5*    C   5          H5**        C   5   9.204  18.538  -8.602
   48    H4*    C   5           H4*        C   5   7.739  18.728 -10.337
   49    H3*    C   5           H3*        C   5   7.340  15.914  -9.333
   50    H2*    C   5           H2*        C   5   5.468  15.880 -10.830
   51   2HO*    C   5          2HO*        C   5   5.144  18.325 -10.271
   52    H1*    C   5           H1*        C   5   6.868  17.310 -12.841
   53   1H4     C   5          H42         C   5   6.873  11.257 -14.957
   54   2H4     C   5          H41         C   5   8.044  10.881 -13.725
   55    H5     C   5           H5         C   5   8.830  12.345 -12.060
   56    H6     C   5           H6         C   5   8.686  14.600 -11.148
   57   1H5*    C   6          H5*         C   6   3.640  18.603  -8.702
   58   2H5*    C   6          H5**        C   6   3.269  18.239  -7.011
   59    H4*    C   6           H4*        C   6   1.249  18.452  -8.286
   60    H3*    C   6           H3*        C   6   1.731  15.617  -7.344
   61    H2*    C   6           H2*        C   6  -0.504  15.219  -8.109
   62   2HO*    C   6          2HO*        C   6  -1.622  17.139  -7.681
   63    H1*    C   6           H1*        C   6  -0.022  16.418 -10.573
   64   1H4     C   6          H41         C   6   1.284  10.251 -11.092
   65   2H4     C   6          H42         C   6   2.970  10.530 -10.671
   66    H5     C   6           H5         C   6   3.757  12.710  -9.963
   67    H6     C   6           H6         C   6   3.081  15.017  -9.523
   68   1H5*    G   7          H5*         G   7  -1.550  18.477  -5.493
   69   2H5*    G   7          H5**        G   7  -2.047  17.738  -3.964
   70    H4*    G   7           H4*        G   7  -3.837  18.794  -5.422
   71    H3*    G   7           H3*        G   7  -4.274  15.999  -4.351
   72    H2*    G   7           H2*        G   7  -6.454  16.205  -5.297
   73   2HO*    G   7          2HO*        G   7  -6.328  18.655  -4.627
   74    H1*    G   7           H1*        G   7  -5.516  17.541  -7.640
   75    H8     G   7           H8         G   7  -3.590  14.422  -6.609
   76    H1     G   7           H1         G   7  -8.699  13.369 -10.353
   77   1H2     G   7          H22         G   7  -9.871  15.232 -10.566
   78   2H2     G   7          H21         G   7  -9.354  16.705  -9.770
   79   1H5*    C   8          H5*         C   8  -7.815  17.793  -2.465
   80   2H5*    C   8          H5**        C   8  -7.570  17.271  -0.795
   81    H4*    C   8           H4*        C   8  -9.653  16.546  -1.243
   82    H3*    C   8           H3*        C   8  -7.931  14.103  -1.650
   83    H2*    C   8           H2*        C   8  -9.968  12.953  -2.077
   84   2HO*    C   8          2HO*        C   8 -10.898  14.445  -0.226
   85    H1*    C   8           H1*        C   8 -11.249  15.190  -3.338
   86   1H4     C   8          H41         C   8 -10.277  11.530  -8.360
   87   2H4     C   8          H42         C   8  -8.540  11.446  -8.105
   88    H5     C   8           H5         C   8  -7.482  12.510  -6.190
   89    H6     C   8           H6         C   8  -7.888  13.850  -4.177
   90   1H5*    C   9          H5*         C   9 -10.536  12.261   0.848
   91   2H5*    C   9          H5**        C   9  -9.791  12.539   2.429
   92    H4*    C   9           H4*        C   9 -10.722  10.403   2.473
   93    H3*    C   9           H3*        C   9  -7.727  10.151   2.237
   94    H2*    C   9           H2*        C   9  -8.069   7.823   2.525
   95   2HO*    C   9          2HO*        C   9  -9.635   7.301   3.924
   96    H1*    C   9           H1*        C   9 -10.475   7.804   0.992
   97   1H4     C   9          H42         C   9  -6.317   5.026  -2.845
   98   2H4     C   9          H41         C   9  -5.494   6.552  -3.149
   99    H5     C   9           H5         C   9  -6.086   8.589  -2.024
  100    H6     C   9           H6         C   9  -7.593   9.591  -0.370
  101   1H5*    A  10          H5*         A  10  -9.932   8.584   5.754
  102   2H5*    A  10          H5**        A  10  -8.891   8.417   7.168
  103    H4*    A  10           H4*        A  10 -10.343   6.445   6.542
  104    H3*    A  10           H3*        A  10  -7.395   6.032   7.035
  105    H2*    A  10           H2*        A  10  -7.940   3.695   6.943
  106   2HO*    A  10          2HO*        A  10  -9.916   3.238   7.749
  107    H1*    A  10           H1*        A  10  -9.639   4.017   4.708
  108    H8     A  10           H8         A  10  -6.472   6.014   4.342
  109   1H6     A  10          H62         A  10  -3.989   0.798   1.966
  110   2H6     A  10          H61         A  10  -3.689   2.520   2.205
  111    H2     A  10           H2         A  10  -7.906  -0.211   3.651
  112   1H5*    C  11          H5*         C  11 -10.514   4.429   9.544
  113   2H5*    C  11          H5**        C  11 -10.075   4.214  11.245
  114    H4*    C  11           H4*        C  11 -11.252   2.251  10.381
  115    H3*    C  11           H3*        C  11  -8.398   1.862  11.240
  116    H2*    C  11           H2*        C  11  -8.657  -0.440  10.702
  117   2HO*    C  11          2HO*        C  11 -10.778  -0.684  11.657
  118    H1*    C  11           H1*        C  11 -10.330  -0.007   8.438
  119   1H4     C  11          H42         C  11  -4.912  -1.425   5.598
  120   2H4     C  11          H41         C  11  -4.137   0.061   6.133
  121    H5     C  11           H5         C  11  -5.251   1.623   7.608
  122    H6     C  11           H6         C  11  -7.311   2.057   8.845
  123   1H5*    U  12          H5*         U  12 -12.171   0.055  13.167
  124   2H5*    U  12          H5**        U  12 -11.826  -0.249  14.877
  125    H4*    U  12           H4*        U  12 -13.205  -1.990  13.715
  126    H3*    U  12           H3*        U  12 -10.695  -2.805  15.179
  127    H2*    U  12           H2*        U  12 -11.225  -5.048  14.581
  128   2HO*    U  12          2HO*        U  12 -13.299  -5.546  14.626
  129    H1*    U  12           H1*        U  12 -12.260  -4.402  12.016
  130    H3     U  12           H3         U  12  -8.700  -7.292  11.472
  131    H5     U  12           H5         U  12  -7.119  -3.405  11.390
  132    H6     U  12           H6         U  12  -9.239  -2.592  12.144
  133   1H5*    G  13          H5*         G  13 -14.478  -4.827  16.370
  134   2H5*    G  13          H5**        G  13 -14.367  -5.475  18.009
  135    H4*    G  13           H4*        G  13 -14.898  -7.100  16.101
  136    H3*    G  13           H3*        G  13 -12.785  -7.714  18.158
  137    H2*    G  13           H2*        G  13 -12.465  -9.788  17.063
  138   2HO*    G  13          2HO*        G  13 -13.922 -10.599  15.527
  139    H1*    G  13           H1*        G  13 -12.711  -8.762  14.447
  140    H8     G  13           H8         G  13 -10.505  -6.695  16.746
  141    H1     G  13           H1         G  13  -7.638 -11.575  13.748
  142   1H2     G  13          H21         G  13  -8.774 -12.676  12.847
  143   2H2     G  13          H22         G  13 -10.437 -12.686  12.625
  144   1H5*    C  14          H5*         C  14 -15.431 -11.336  18.397
  145   2H5*    C  14          H5**        C  14 -15.651 -11.484  20.140
  146    H4*    C  14           H4*        C  14 -14.972 -13.560  19.122
  147    H3*    C  14           H3*        C  14 -13.001 -12.533  21.139
  148    H2*    C  14           H2*        C  14 -11.800 -14.490  20.775
  149   2HO*    C  14          2HO*        C  14 -12.832 -16.322  20.481
  150    H1*    C  14           H1*        C  14 -12.423 -14.699  17.987
  151   1H4     C  14          H41         C  14  -6.356 -13.741  18.825
  152   2H4     C  14          H42         C  14  -6.316 -12.049  18.622
  153    H5     C  14           H5         C  14  -8.793 -10.867  18.596
  154    H6     C  14           H6         C  14 -11.160 -11.443  18.603
  155   1H5*    A  15          H5*         A  15 -14.559 -16.675  21.929
  156   2H5*    A  15          H5**        A  15 -14.349 -17.023  23.651
  157    H4*    A  15           H4*        A  15 -13.276 -18.662  22.112
  158    H3*    A  15           H3*        A  15 -11.554 -17.264  24.168
  159    H2*    A  15           H2*        A  15  -9.772 -18.657  23.421
  160   2HO*    A  15          2HO*        A  15 -11.659 -20.402  23.053
  161    H1*    A  15           H1*        A  15 -10.514 -18.549  20.679
  162    H8     A  15           H8         A  15 -10.306 -15.281  22.703
  163   1H6     A  15          H62         A  15  -4.576 -14.837  20.285
  164   2H6     A  15          H61         A  15  -5.792 -14.007  21.247
  165    H2     A  15           H2         A  15  -6.246 -18.759  19.155
  166   1H5*    G  16          H5*         G  16 -10.717 -21.062  25.123
  167   2H5*    G  16          H5**        G  16 -10.746 -21.206  26.887
  168    H4*    G  16           H4*        G  16  -8.590 -21.794  26.215
  169    H3*    G  16           H3*        G  16  -8.500 -18.953  27.270
  170    H2*    G  16           H2*        G  16  -6.088 -19.343  27.246
  171   2HO*    G  16          2HO*        G  16  -5.238 -21.338  26.594
  172    H1*    G  16           H1*        G  16  -6.260 -20.054  24.557
  173    H8     G  16           H8         G  16  -8.937 -17.606  25.868
  174    H1     G  16           H1         G  16  -3.887 -14.887  23.003
  175   1H2     G  16          H22         G  16  -2.395 -16.355  22.530
  176   2H2     G  16          H21         G  16  -2.620 -18.051  22.930
  177   1H5*    A  17          H5*         A  17  -5.827 -17.902  29.098
  178   2H5*    A  17          H5**        A  17  -6.186 -19.631  29.136
  179    H4*    A  17           H4*        A  17  -6.210 -18.180  31.695
  180    H3*    A  17           H3*        A  17  -3.917 -18.654  29.900
  181    H2*    A  17           H2*        A  17  -2.699 -20.019  31.333
  182   2HO*    A  17          2HO*        A  17  -2.931 -18.792  33.271
  183    H1*    A  17           H1*        A  17  -4.884 -21.375  32.461
  184    H8     A  17           H8         A  17  -6.135 -21.809  29.221
  185   1H6     A  17          H62         A  17  -1.678 -25.985  28.050
  186   2H6     A  17          H61         A  17  -3.233 -25.369  27.501
  187    H2     A  17           H2         A  17  -0.481 -23.692  31.629
  188   1H5*    G  18          H5*         G  18  -1.477 -15.433  28.612
  189   2H5*    G  18          H5**        G  18  -2.847 -16.533  28.777
  190    H4*    G  18           H4*        G  18  -0.252 -17.376  29.963
  191    H3*    G  18           H3*        G  18  -0.726 -17.516  26.969
  192    H2*    G  18           H2*        G  18   0.454 -19.590  27.095
  193   2HO*    G  18          2HO*        G  18   1.792 -18.413  28.998
  194    H1*    G  18           H1*        G  18  -0.777 -20.324  29.578
  195    H8     G  18           H8         G  18  -3.662 -19.403  27.681
  196    H1     G  18           H1         G  18  -0.972 -24.748  25.372
  197   1H2     G  18          H21         G  18   1.077 -24.970  26.181
  198   2H2     G  18          H22         G  18   1.733 -23.771  27.280
  199   1H5*    A  19          H5*         A  19   3.245 -18.614  26.638
  200   2H5*    A  19          H5**        A  19   3.830 -17.708  25.235
  201    H4*    A  19           H4*        A  19   4.010 -20.058  24.823
  202    H3*    A  19           H3*        A  19   1.962 -18.699  23.062
  203    H2*    A  19           H2*        A  19   1.683 -20.822  21.994
  204   2HO*    A  19          2HO*        A  19   4.146 -21.235  22.503
  205    H1*    A  19           H1*        A  19   1.456 -22.274  24.319
  206    H8     A  19           H8         A  19  -0.014 -18.837  24.793
  207   1H6     A  19          H62         A  19  -5.229 -21.052  22.301
  208   2H6     A  19          H61         A  19  -4.518 -19.677  23.139
  209    H2     A  19           H2         A  19  -2.057 -24.108  21.773
  210   1H5*    U  20          H5*         U  20   3.102 -20.735  20.118
  211   2H5*    U  20          H5**        U  20   3.307 -19.642  18.747
  212    H4*    U  20           H4*        U  20   1.465 -21.390  18.686
  213    H3*    U  20           H3*        U  20   0.955 -18.606  17.760
  214    H2*    U  20           H2*        U  20  -1.226 -19.287  17.233
  215   2HO*    U  20          2HO*        U  20  -1.799 -21.331  16.869
  216    H1*    U  20           H1*        U  20  -1.725 -20.670  19.579
  217    H3     U  20           H3         U  20  -4.065 -16.749  19.503
  218    H5     U  20           H5         U  20  -0.157 -15.780  20.778
  219    H6     U  20           H6         U  20   0.471 -17.949  20.271
  220   1H5*    G  21          H5*         G  21  -0.618 -21.348  14.925
  221   2H5*    G  21          H5**        G  21  -0.591 -20.605  13.328
  222    H4*    G  21           H4*        G  21  -2.839 -21.280  14.258
  223    H3*    G  21           H3*        G  21  -2.445 -18.518  13.114
  224    H2*    G  21           H2*        G  21  -4.821 -18.284  13.399
  225   2HO*    G  21          2HO*        G  21  -4.925 -20.812  12.954
  226    H1*    G  21           H1*        G  21  -4.869 -19.419  15.948
  227    H8     G  21           H8         G  21  -1.904 -17.147  15.305
  228    H1     G  21           H1         G  21  -7.256 -14.191  17.199
  229   1H2     G  21          H21         G  21  -8.734 -15.300  17.279
  230   2H2     G  21          H22         G  21  -8.969 -16.942  16.999
  231   1H5*    C  22          H5*         C  22  -5.539 -19.847  11.293
  232   2H5*    C  22          H5**        C  22  -5.473 -19.636   9.550
  233    H4*    C  22           H4*        C  22  -7.448 -18.713  10.375
  234    H3*    C  22           H3*        C  22  -5.663 -16.496   9.404
  235    H2*    C  22           H2*        C  22  -7.645 -15.188   9.618
  236   2HO*    C  22          2HO*        C  22  -8.942 -17.268   8.974
  237    H1*    C  22           H1*        C  22  -8.381 -16.440  12.070
  238   1H4     C  22          H41         C  22  -6.183 -10.587  13.121
  239   2H4     C  22          H42         C  22  -4.820 -11.111  13.973
  240    H5     C  22           H5         C  22  -4.261 -13.767  13.808
  241    H6     C  22           H6         C  22  -5.162 -15.845  12.947
  242   1H5*    A  23          H5*         A  23  -8.853 -17.210   6.436
  243   2H5*    A  23          H5**        A  23  -8.732 -16.174   5.018
  244    H4*    A  23           H4*        A  23 -10.531 -15.873   6.928
  245    H3*    A  23           H3*        A  23  -9.788 -14.190   4.820
  246    H2*    A  23           H2*        A  23  -8.967 -12.428   6.026
  247   2HO*    A  23          2HO*        A  23 -10.678 -11.234   7.231
  248    H1*    A  23           H1*        A  23 -10.392 -13.179   8.604
  249    H8     A  23           H8         A  23  -6.674 -13.424   7.798
  250   1H6     A  23          H62         A  23  -6.112  -8.038  10.849
  251   2H6     A  23          H61         A  23  -5.215  -9.355  10.094
  252    H2     A  23           H2         A  23 -10.424  -8.945  10.445
  253   1H5*    A  24          H5*         A  24 -14.093 -12.435   5.711
  254   2H5*    A  24          H5**        A  24 -14.721 -12.406   4.053
  255    H4*    A  24           H4*        A  24 -15.020 -10.236   4.911
  256    H3*    A  24           H3*        A  24 -12.636 -10.302   3.049
  257    H2*    A  24           H2*        A  24 -12.440  -7.963   3.410
  258   2HO*    A  24          2HO*        A  24 -15.024  -8.018   3.484
  259    H1*    A  24           H1*        A  24 -13.158  -8.080   6.159
  260    H8     A  24           H8         A  24 -10.539 -10.405   4.597
  261   1H6     A  24          H61         A  24  -6.393  -6.576   7.176
  262   2H6     A  24          H62         A  24  -6.585  -8.088   6.288
  263    H2     A  24           H2         A  24 -10.421  -4.865   7.822
  264   1H5*    U  25          H5*         U  25 -14.128  -7.090   1.357
  265   2H5*    U  25          H5**        U  25 -13.887  -7.269  -0.383
  266    H4*    U  25           H4*        U  25 -12.654  -5.407   0.493
  267    H3*    U  25           H3*        U  25 -10.807  -7.587  -0.505
  268    H2*    U  25           H2*        U  25  -9.114  -5.850  -0.250
  269   2HO*    U  25          2HO*        U  25 -10.931  -4.132   1.094
  270    H1*    U  25           H1*        U  25  -9.846  -5.436   2.364
  271    H3     U  25           H3         U  25  -6.149  -8.177   2.171
  272    H5     U  25           H5         U  25  -9.472 -10.734   2.167
  273    H6     U  25           H6         U  25 -10.857  -8.807   1.840
  274   1H5*    C  26          H5*         C  26 -10.351  -3.848  -2.078
  275   2H5*    C  26          H5**        C  26  -9.929  -3.754  -3.784
  276    H4*    C  26           H4*        C  26  -8.491  -2.378  -2.358
  277    H3*    C  26           H3*        C  26  -7.124  -4.592  -3.886
  278    H2*    C  26           H2*        C  26  -5.101  -3.472  -3.259
  279   2HO*    C  26          2HO*        C  26  -5.872  -1.273  -3.400
  280    H1*    C  26           H1*        C  26  -5.959  -3.195  -0.574
  281   1H4     C  26          H42         C  26  -2.371  -8.421  -1.049
  282   2H4     C  26          H41         C  26  -3.833  -9.405  -1.082
  283    H5     C  26           H5         C  26  -6.033  -8.415  -1.236
  284    H6     C  26           H6         C  26  -7.257  -6.330  -1.386
  285   1H5*    C  27          H5*         C  27  -6.515  -0.040  -5.131
  286   2H5*    C  27          H5**        C  27  -6.774  -0.285  -6.870
  287    H4*    C  27           H4*        C  27  -5.154   1.469  -6.469
  288    H3*    C  27           H3*        C  27  -4.167  -1.008  -7.877
  289    H2*    C  27           H2*        C  27  -2.001  -0.063  -7.963
  290   2HO*    C  27          2HO*        C  27  -3.369   2.181  -8.208
  291    H1*    C  27           H1*        C  27  -2.124   1.253  -5.451
  292   1H4     C  27          H41         C  27   1.440  -3.656  -3.807
  293   2H4     C  27          H42         C  27   0.124  -4.801  -4.042
  294    H5     C  27           H5         C  27  -2.030  -4.118  -4.902
  295    H6     C  27           H6         C  27  -3.332  -2.221  -5.698
  296   1H5*    A  28          H5*         A  28  -2.836   1.865 -10.518
  297   2H5*    A  28          H5**        A  28  -4.029   1.837 -11.825
  298    H4*    A  28           H4*        A  28  -1.916   2.086 -12.803
  299    H3*    A  28           H3*        A  28  -2.883  -0.749 -13.238
  300    H2*    A  28           H2*        A  28  -1.013  -0.902 -14.731
  301   2HO*    A  28          2HO*        A  28  -0.959   1.171 -15.701
  302    H1*    A  28           H1*        A  28   0.713   0.426 -12.930
  303    H8     A  28           H8         A  28  -0.774  -1.747 -10.520
  304   1H6     A  28          H62         A  28   2.258  -6.555 -13.101
  305   2H6     A  28          H61         A  28   1.368  -6.047 -11.668
  306    H2     A  28           H2         A  28   2.398  -3.184 -15.923
  307   1H5*    G  29          H5*         G  29  -4.249   0.550 -18.205
  308   2H5*    G  29          H5**        G  29  -2.713  -0.195 -18.641
  309    H4*    G  29           H4*        G  29  -2.990   2.244 -16.885
  310    H3*    G  29           H3*        G  29  -3.453   2.545 -19.441
  311    H2*    G  29           H2*        G  29  -1.641   1.135 -20.230
  312   2HO*    G  29          2HO*        G  29  -1.259   3.847 -20.445
  313    H1*    G  29           H1*        G  29   0.323   2.529 -18.356
  314    H8     G  29           H8         G  29   0.300  -0.615 -17.013
  315    H1     G  29           H1         G  29   3.310  -1.017 -22.665
  316   1H2     G  29          H22         G  29   2.822   0.764 -23.895
  317   2H2     G  29          H21         G  29   1.756   2.013 -23.275
  318   1H5*    U  30          H5*         U  30   0.011   6.005 -20.356
  319   2H5*    U  30          H5**        U  30  -1.103   7.036 -19.446
  320    H4*    U  30           H4*        U  30  -1.028   6.753 -22.438
  321    H3*    U  30           H3*        U  30   0.986   8.108 -21.401
  322    H2*    U  30           H2*        U  30  -0.530   9.333 -19.848
  323   2HO*    U  30          2HO*        U  30   0.858  10.764 -21.520
  324    H1*    U  30           H1*        U  30  -2.085   9.923 -22.429
  325    H3     U  30           H3         U  30  -4.848  12.861 -20.420
  326    H5     U  30           H5         U  30  -4.572   9.781 -17.602
  327    H6     U  30           H6         U  30  -2.959   8.711 -19.040
  328   1H5*    G  31          H5*         G  31   0.553  11.538 -23.842
  329   2H5*    G  31          H5**        G  31   1.965  11.568 -24.907
  330    H4*    G  31           H4*        G  31   1.671  13.587 -23.494
  331    H3*    G  31           H3*        G  31   4.284  12.081 -23.254
  332    H2*    G  31           H2*        G  31   4.988  13.873 -21.835
  333   2HO*    G  31          2HO*        G  31   3.443  15.358 -23.281
  334    H1*    G  31           H1*        G  31   2.581  13.971 -20.396
  335    H8     G  31           H8         G  31   3.799  10.451 -21.319
  336    H1     G  31           H1         G  31   5.977  12.749 -15.752
  337   1H2     G  31          H21         G  31   5.547  14.529 -15.450
  338   2H2     G  31          H22         G  31   4.700  15.663 -16.358
  339   1H5*    G  32          H5*         G  32   5.126  15.969 -24.128
  340   2H5*    G  32          H5**        G  32   6.435  16.112 -25.309
  341    H4*    G  32           H4*        G  32   6.993  17.381 -23.377
  342    H3*    G  32           H3*        G  32   8.692  14.879 -23.534
  343    H2*    G  32           H2*        G  32   9.938  15.948 -21.781
  344   2HO*    G  32          2HO*        G  32   9.668  18.149 -22.651
  345    H1*    G  32           H1*        G  32   7.639  16.671 -20.378
  346    H8     G  32           H8         G  32   7.257  13.196 -21.776
  347    H1     G  32           H1         G  32  10.881  13.568 -16.502
  348   1H2     G  32          H21         G  32  11.303  15.280 -16.007
  349   2H2     G  32          H22         G  32  10.927  16.791 -16.636
  350   1H5*    U  33          H5*         U  33  11.819  17.874 -25.655
  351   2H5*    U  33          H5**        U  33  13.248  16.886 -25.529
  352    H4*    U  33           H4*        U  33  12.571  18.878 -23.843
  353    H3*    U  33           H3*        U  33  14.538  16.624 -23.530
  354    H2*    U  33           H2*        U  33  14.785  17.324 -21.216
  355   2HO*    U  33          2HO*        U  33  14.211  19.678 -22.184
  356    H1*    U  33           H1*        U  33  12.101  17.636 -20.683
  357    H3     U  33           H3         U  33  13.846  13.748 -18.767
  358    H5     U  33           H5         U  33  11.731  12.657 -22.242
  359    H6     U  33           H6         U  33  11.660  14.964 -22.821
  360   1H5*    C  34          H5*         C  34  17.019  20.285 -22.868
  361   2H5*    C  34          H5**        C  34  18.542  20.091 -23.756
  362    H4*    C  34           H4*        C  34  18.901  20.402 -21.351
  363    H3*    C  34           H3*        C  34  19.798  17.744 -22.475
  364    H2*    C  34           H2*        C  34  20.586  17.211 -20.276
  365   2HO*    C  34          2HO*        C  34  20.906  19.734 -19.951
  366    H1*    C  34           H1*        C  34  18.235  17.919 -19.020
  367   1H4     C  34          H41         C  34  17.863  11.902 -20.767
  368   2H4     C  34          H42         C  34  16.599  12.125 -21.883
  369    H5     C  34           H5         C  34  16.036  14.698 -22.514
  370    H6     C  34           H6         C  34  16.655  16.949 -21.891
  371   1H5*    C  35          H5*         C  35  23.148  17.632 -19.578
  372   2H5*    C  35          H5**        C  35  24.064  18.690 -20.660
  373    H4*    C  35           H4*        C  35  25.596  17.052 -20.171
  374    H3*    C  35           H3*        C  35  24.279  16.142 -22.740
  375    H2*    C  35           H2*        C  35  25.846  14.357 -22.746
  376   2HO*    C  35          2HO*        C  35  27.508  15.794 -21.550
  377    H1*    C  35           H1*        C  35  25.220  13.605 -20.162
  378   1H4     C  35          H42         C  35  20.855  10.863 -23.931
  379   2H4     C  35          H41         C  35  19.782  12.221 -23.643
  380    H5     C  35           H5         C  35  20.445  14.176 -22.450
  381    H6     C  35           H6         C  35  22.264  15.249 -21.266
  382    H3T    C  35           H3T        C  35  25.424  18.009 -22.896
  Start of MODEL    7
    1   1H5*    G   1          H5*         G   1   9.225  -3.737 -16.656
    2   2H5*    G   1          H5**        G   1   8.134  -3.061 -15.448
    3    H4*    G   1           H4*        G   1  10.288  -3.371 -14.550
    4    H3*    G   1           H3*        G   1   8.964  -0.951 -14.234
    5    H2*    G   1           H2*        G   1  10.507   0.531 -15.111
    6   2HO*    G   1          2HO*        G   1  11.227   0.028 -12.681
    7    H1*    G   1           H1*        G   1  12.886  -1.325 -14.967
    8    H8     G   1           H8         G   1  10.777  -0.674 -18.044
    9    H1     G   1           H1         G   1  16.116   2.870 -17.728
   10   1H2     G   1          H22         G   1  17.074   2.623 -15.785
   11   2H2     G   1          H21         G   1  16.386   1.572 -14.553
   12    H5T    G   1           H5T        G   1   7.973  -2.129 -17.596
   13   1H5*    G   2          H5*         G   2  11.377  -1.087 -10.080
   14   2H5*    G   2          H5**        G   2  10.185  -0.290  -9.049
   15    H4*    G   2           H4*        G   2  12.452   0.753  -9.129
   16    H3*    G   2           H3*        G   2  10.074   2.521  -9.731
   17    H2*    G   2           H2*        G   2  11.646   4.302  -9.920
   18   2HO*    G   2          2HO*        G   2  12.840   3.101  -7.992
   19    H1*    G   2           H1*        G   2  13.699   2.673 -11.087
   20    H8     G   2           H8         G   2  10.400   2.367 -12.884
   21    H1     G   2           H1         G   2  14.059   7.308 -14.755
   22   1H2     G   2          H22         G   2  15.739   7.578 -13.407
   23   2H2     G   2          H21         G   2  15.921   6.534 -12.005
   24   1H5*    A   3          H5*         A   3  12.075   4.655  -6.507
   25   2H5*    A   3          H5**        A   3  10.779   5.462  -5.619
   26    H4*    A   3           H4*        A   3  12.500   6.963  -6.587
   27    H3*    A   3           H3*        A   3   9.658   7.504  -7.432
   28    H2*    A   3           H2*        A   3  10.528   9.414  -8.499
   29   2HO*    A   3          2HO*        A   3  12.036  10.401  -7.306
   30    H1*    A   3           H1*        A   3  12.903   8.139  -9.353
   31    H8     A   3           H8         A   3   9.744   6.233 -10.252
   32   1H6     A   3          H61         A   3   9.551  10.171 -15.108
   33   2H6     A   3          H62         A   3   8.800   8.716 -14.604
   34    H2     A   3           H2         A   3  12.626  11.545 -12.429
   35   1H5*    C   4          H5*         C   4  11.687  11.223  -5.457
   36   2H5*    C   4          H5**        C   4  10.285  12.168  -4.934
   37    H4*    C   4           H4*        C   4  12.005  13.248  -6.505
   38    H3*    C   4           H3*        C   4   9.031  13.511  -6.990
   39    H2*    C   4           H2*        C   4   9.662  15.015  -8.760
   40   2HO*    C   4          2HO*        C   4  11.670  15.618  -7.301
   41    H1*    C   4           H1*        C   4  11.683  13.340  -9.742
   42   1H4     C   4          H41         C   4   6.494  12.397 -13.148
   43   2H4     C   4          H42         C   4   6.014  10.952 -12.403
   44    H5     C   4           H5         C   4   7.328  10.333 -10.140
   45    H6     C   4           H6         C   4   9.185  11.051  -8.749
   46   1H5*    C   5          H5*         C   5   9.593  17.251  -7.493
   47   2H5*    C   5          H5**        C   5   8.753  18.104  -6.189
   48    H4*    C   5           H4*        C   5   7.947  19.060  -8.114
   49    H3*    C   5           H3*        C   5   5.855  17.052  -7.272
   50    H2*    C   5           H2*        C   5   4.518  18.087  -8.979
   51   2HO*    C   5          2HO*        C   5   5.446  20.280  -8.481
   52    H1*    C   5           H1*        C   5   6.714  18.214 -10.781
   53   1H4     C   5          H42         C   5   3.477  13.075 -12.785
   54   2H4     C   5          H41         C   5   4.122  12.185 -11.429
   55    H5     C   5           H5         C   5   5.459  13.086  -9.699
   56    H6     C   5           H6         C   5   6.526  15.096  -8.848
   57   1H5*    C   6          H5*         C   6   4.406  21.407  -6.477
   58   2H5*    C   6          H5**        C   6   3.645  21.228  -4.887
   59    H4*    C   6           H4*        C   6   2.319  22.609  -6.349
   60    H3*    C   6           H3*        C   6   0.971  20.000  -5.596
   61    H2*    C   6           H2*        C   6  -0.929  20.901  -6.728
   62   2HO*    C   6          2HO*        C   6  -0.217  23.147  -5.816
   63    H1*    C   6           H1*        C   6   0.620  22.038  -8.841
   64   1H4     C   6          H41         C   6  -2.058  16.854 -11.223
   65   2H4     C   6          H42         C   6  -0.703  15.867 -10.690
   66    H5     C   6           H5         C   6   1.059  16.767  -9.308
   67    H6     C   6           H6         C   6   1.873  18.769  -8.171
   68   1H5*    G   7          H5*         G   7  -1.548  22.918  -2.803
   69   2H5*    G   7          H5**        G   7  -1.781  21.790  -1.464
   70    H4*    G   7           H4*        G   7  -3.906  22.440  -2.053
   71    H3*    G   7           H3*        G   7  -3.480  19.719  -3.288
   72    H2*    G   7           H2*        G   7  -5.737  19.878  -4.014
   73   2HO*    G   7          2HO*        G   7  -6.131  21.047  -1.770
   74    H1*    G   7           H1*        G   7  -5.627  22.679  -4.515
   75    H8     G   7           H8         G   7  -3.188  19.985  -5.900
   76    H1     G   7           H1         G   7  -7.654  22.210  -9.929
   77   1H2     G   7          H22         G   7  -8.982  23.630  -8.863
   78   2H2     G   7          H21         G   7  -8.717  23.990  -7.167
   79   1H5*    C   8          H5*         C   8  -7.255  19.230  -0.789
   80   2H5*    C   8          H5**        C   8  -6.584  18.094   0.396
   81    H4*    C   8           H4*        C   8  -8.766  17.374  -0.227
   82    H3*    C   8           H3*        C   8  -6.529  15.598  -1.144
   83    H2*    C   8           H2*        C   8  -8.114  14.179  -2.202
   84   2HO*    C   8          2HO*        C   8  -9.532  14.696  -0.116
   85    H1*    C   8           H1*        C   8  -9.981  16.297  -2.843
   86   1H4     C   8          H41         C   8  -7.952  14.883  -8.600
   87   2H4     C   8          H42         C   8  -6.358  15.564  -8.303
   88    H5     C   8           H5         C   8  -5.719  16.406  -6.120
   89    H6     C   8           H6         C   8  -6.478  16.753  -3.816
   90   1H5*    C   9          H5*         C   9  -9.005  12.003  -0.688
   91   2H5*    C   9          H5**        C   9  -8.872  12.203   1.072
   92    H4*    C   9           H4*        C   9  -8.517   9.896   0.346
   93    H3*    C   9           H3*        C   9  -6.104  11.244   1.593
   94    H2*    C   9           H2*        C   9  -5.114   9.066   1.544
   95   2HO*    C   9          2HO*        C   9  -7.015   7.772   1.998
   96    H1*    C   9           H1*        C   9  -5.958   8.600  -1.107
   97   1H4     C   9          H42         C   9  -0.132  10.879  -1.825
   98   2H4     C   9          H41         C   9  -0.631  12.525  -1.427
   99    H5     C   9           H5         C   9  -2.902  13.021  -0.718
  100    H6     C   9           H6         C   9  -5.087  12.017  -0.254
  101   1H5*    A  10          H5*         A  10  -8.970   8.018   3.027
  102   2H5*    A  10          H5**        A  10  -8.873   7.916   4.793
  103    H4*    A  10           H4*        A  10  -9.256   5.734   3.946
  104    H3*    A  10           H3*        A  10  -6.391   6.043   4.882
  105    H2*    A  10           H2*        A  10  -6.260   3.669   4.573
  106   2HO*    A  10          2HO*        A  10  -8.147   2.630   4.984
  107    H1*    A  10           H1*        A  10  -7.584   3.779   2.094
  108    H8     A  10           H8         A  10  -5.086   6.629   2.564
  109   1H6     A  10          H62         A  10  -0.942   2.708   0.093
  110   2H6     A  10          H61         A  10  -1.208   4.373   0.609
  111    H2     A  10           H2         A  10  -4.673   0.441   0.835
  112   1H5*    C  11          H5*         C  11  -9.293   3.441   6.788
  113   2H5*    C  11          H5**        C  11  -8.965   3.072   8.486
  114    H4*    C  11           H4*        C  11  -9.578   1.097   7.165
  115    H3*    C  11           H3*        C  11  -6.809   1.053   8.391
  116    H2*    C  11           H2*        C  11  -6.753  -1.227   7.664
  117   2HO*    C  11          2HO*        C  11  -9.002  -1.747   8.114
  118    H1*    C  11           H1*        C  11  -7.839  -0.644   5.130
  119   1H4     C  11          H42         C  11  -1.575  -0.921   4.371
  120   2H4     C  11          H41         C  11  -1.382   0.729   4.963
  121    H5     C  11           H5         C  11  -3.222   1.993   5.834
  122    H6     C  11           H6         C  11  -5.601   1.951   6.313
  123   1H5*    U  12          H5*         U  12 -10.538  -1.152   9.334
  124   2H5*    U  12          H5**        U  12 -10.574  -1.517  11.071
  125    H4*    U  12           H4*        U  12 -11.706  -3.207   9.607
  126    H3*    U  12           H3*        U  12  -9.579  -3.941  11.578
  127    H2*    U  12           H2*        U  12  -9.591  -6.179  10.816
  128   2HO*    U  12          2HO*        U  12 -11.611  -6.865  10.478
  129    H1*    U  12           H1*        U  12 -10.031  -5.626   8.085
  130    H3     U  12           H3         U  12  -5.977  -7.786   8.762
  131    H5     U  12           H5         U  12  -5.184  -3.675   8.464
  132    H6     U  12           H6         U  12  -7.531  -3.284   8.646
  133   1H5*    G  13          H5*         G  13 -13.301  -5.992  11.714
  134   2H5*    G  13          H5**        G  13 -13.916  -6.583  13.267
  135    H4*    G  13           H4*        G  13 -13.726  -8.355  11.551
  136    H3*    G  13           H3*        G  13 -12.185  -8.632  14.122
  137    H2*    G  13           H2*        G  13 -11.306 -10.693  13.328
  138   2HO*    G  13          2HO*        G  13 -13.633 -10.876  12.125
  139    H1*    G  13           H1*        G  13 -10.956  -9.883  10.655
  140    H8     G  13           H8         G  13  -9.818  -7.387  13.321
  141    H1     G  13           H1         G  13  -5.357 -11.431  11.188
  142   1H2     G  13          H21         G  13  -6.017 -12.763  10.066
  143   2H2     G  13          H22         G  13  -7.538 -13.151   9.491
  144   1H5*    C  14          H5*         C  14 -13.453 -12.144  13.920
  145   2H5*    C  14          H5**        C  14 -14.261 -12.608  15.412
  146    H4*    C  14           H4*        C  14 -12.571 -14.123  15.108
  147    H3*    C  14           H3*        C  14 -11.623 -12.237  17.246
  148    H2*    C  14           H2*        C  14  -9.914 -13.849  17.561
  149   2HO*    C  14          2HO*        C  14 -10.318 -15.898  17.162
  150    H1*    C  14           H1*        C  14  -9.623 -14.304  14.781
  151   1H4     C  14          H41         C  14  -4.645 -11.335  16.993
  152   2H4     C  14          H42         C  14  -5.029  -9.754  16.519
  153    H5     C  14           H5         C  14  -7.630  -9.452  15.669
  154    H6     C  14           H6         C  14  -9.626 -10.770  15.159
  155   1H5*    A  15          H5*         A  15 -12.299 -16.290  18.343
  156   2H5*    A  15          H5**        A  15 -12.473 -16.622  20.069
  157    H4*    A  15           H4*        A  15 -10.622 -17.850  18.913
  158    H3*    A  15           H3*        A  15  -9.992 -16.187  21.355
  159    H2*    A  15           H2*        A  15  -7.760 -16.979  21.167
  160   2HO*    A  15          2HO*        A  15  -8.834 -19.162  20.347
  161    H1*    A  15           H1*        A  15  -7.667 -16.862  18.348
  162    H8     A  15           H8         A  15  -9.059 -13.827  20.263
  163   1H6     A  15          H62         A  15  -3.168 -11.732  19.901
  164   2H6     A  15          H61         A  15  -4.799 -11.282  20.394
  165    H2     A  15           H2         A  15  -3.285 -15.845  18.337
  166   1H5*    G  16          H5*         G  16  -8.897 -19.951  22.955
  167   2H5*    G  16          H5**        G  16  -9.267 -19.859  24.686
  168    H4*    G  16           H4*        G  16  -6.874 -20.053  24.226
  169    H3*    G  16           H3*        G  16  -7.681 -17.421  25.538
  170    H2*    G  16           H2*        G  16  -5.209 -17.233  25.809
  171   2HO*    G  16          2HO*        G  16  -3.891 -18.937  25.338
  172    H1*    G  16           H1*        G  16  -4.852 -17.732  23.114
  173    H8     G  16           H8         G  16  -8.167 -15.975  23.790
  174    H1     G  16           H1         G  16  -3.197 -12.088  22.573
  175   1H2     G  16          H22         G  16  -1.339 -13.270  22.518
  176   2H2     G  16          H21         G  16  -1.378 -15.009  22.785
  177   1H5*    A  17          H5*         A  17  -5.994 -15.840  28.730
  178   2H5*    A  17          H5**        A  17  -5.478 -17.222  27.777
  179    H4*    A  17           H4*        A  17  -6.378 -17.552  30.618
  180    H3*    A  17           H3*        A  17  -3.641 -16.863  29.574
  181    H2*    A  17           H2*        A  17  -2.639 -18.261  31.096
  182   2HO*    A  17          2HO*        A  17  -4.129 -17.973  32.895
  183    H1*    A  17           H1*        A  17  -4.245 -20.381  30.378
  184    H8     A  17           H8         A  17  -4.500 -19.331  27.220
  185   1H6     A  17          H62         A  17   1.592 -20.063  26.133
  186   2H6     A  17          H61         A  17   0.033 -19.866  25.330
  187    H2     A  17           H2         A  17   0.962 -20.014  30.473
  188   1H5*    G  18          H5*         G  18  -0.107 -15.124  31.698
  189   2H5*    G  18          H5**        G  18  -1.326 -14.421  30.618
  190    H4*    G  18           H4*        G  18   0.338 -16.899  30.124
  191    H3*    G  18           H3*        G  18   0.401 -14.100  29.033
  192    H2*    G  18           H2*        G  18   0.749 -14.930  26.816
  193   2HO*    G  18          2HO*        G  18   1.941 -16.813  27.097
  194    H1*    G  18           H1*        G  18  -1.429 -16.557  26.836
  195    H8     G  18           H8         G  18  -3.280 -14.987  29.079
  196    H1     G  18           H1         G  18  -1.852 -10.543  24.658
  197   1H2     G  18          H21         G  18  -0.115 -11.185  23.470
  198   2H2     G  18          H22         G  18   0.680 -12.717  23.783
  199   1H5*    A  19          H5*         A  19   4.113 -17.105  27.725
  200   2H5*    A  19          H5**        A  19   5.194 -15.937  26.956
  201    H4*    A  19           H4*        A  19   4.970 -17.709  25.489
  202    H3*    A  19           H3*        A  19   3.203 -15.518  24.365
  203    H2*    A  19           H2*        A  19   3.176 -16.948  22.457
  204   2HO*    A  19          2HO*        A  19   5.539 -17.681  23.145
  205    H1*    A  19           H1*        A  19   2.738 -19.228  23.985
  206    H8     A  19           H8         A  19   0.756 -16.075  24.983
  207   1H6     A  19          H62         A  19  -3.493 -18.051  20.890
  208   2H6     A  19          H61         A  19  -3.185 -16.837  22.127
  209    H2     A  19           H2         A  19   0.023 -20.648  20.534
  210   1H5*    U  20          H5*         U  20   5.542 -16.259  21.326
  211   2H5*    U  20          H5**        U  20   5.731 -14.899  20.219
  212    H4*    U  20           H4*        U  20   4.424 -17.038  19.554
  213    H3*    U  20           H3*        U  20   3.596 -14.316  18.643
  214    H2*    U  20           H2*        U  20   1.826 -15.395  17.476
  215   2HO*    U  20          2HO*        U  20   1.971 -17.451  16.875
  216    H1*    U  20           H1*        U  20   1.026 -16.990  19.590
  217    H3     U  20           H3         U  20  -1.946 -13.546  19.211
  218    H5     U  20           H5         U  20   1.288 -12.067  21.472
  219    H6     U  20           H6         U  20   2.436 -14.024  20.979
  220   1H5*    G  21          H5*         G  21   3.765 -17.261  15.481
  221   2H5*    G  21          H5**        G  21   4.039 -16.484  13.921
  222    H4*    G  21           H4*        G  21   1.946 -17.890  14.184
  223    H3*    G  21           H3*        G  21   1.797 -15.118  13.016
  224    H2*    G  21           H2*        G  21  -0.521 -15.600  12.615
  225   2HO*    G  21          2HO*        G  21   0.280 -18.064  12.414
  226    H1*    G  21           H1*        G  21  -0.991 -16.693  15.125
  227    H8     G  21           H8         G  21   1.376 -13.703  15.172
  228    H1     G  21           H1         G  21  -4.834 -12.193  15.337
  229   1H2     G  21          H21         G  21  -5.958 -13.629  15.096
  230   2H2     G  21          H22         G  21  -5.711 -15.283  14.884
  231   1H5*    C  22          H5*         C  22   0.044 -18.140  10.367
  232   2H5*    C  22          H5**        C  22   0.511 -17.742   8.710
  233    H4*    C  22           H4*        C  22  -1.912 -18.220   9.085
  234    H3*    C  22           H3*        C  22  -1.110 -15.654   7.706
  235    H2*    C  22           H2*        C  22  -3.450 -15.233   7.458
  236   2HO*    C  22          2HO*        C  22  -3.617 -17.790   7.206
  237    H1*    C  22           H1*        C  22  -4.176 -16.255  10.008
  238   1H4     C  22          H41         C  22  -4.370  -9.978  10.389
  239   2H4     C  22          H42         C  22  -3.010  -9.870  11.422
  240    H5     C  22           H5         C  22  -1.551 -12.047  11.663
  241    H6     C  22           H6         C  22  -1.500 -14.407  11.061
  242   1H5*    A  23          H5*         A  23  -3.816 -17.611   5.185
  243   2H5*    A  23          H5**        A  23  -3.471 -17.314   3.483
  244    H4*    A  23           H4*        A  23  -5.699 -16.612   4.336
  245    H3*    A  23           H3*        A  23  -4.377 -15.464   2.262
  246    H2*    A  23           H2*        A  23  -3.581 -13.602   3.529
  247   2HO*    A  23          2HO*        A  23  -6.081 -13.013   2.354
  248    H1*    A  23           H1*        A  23  -6.231 -13.535   5.052
  249    H8     A  23           H8         A  23  -2.396 -13.338   5.677
  250   1H6     A  23          H62         A  23  -3.723  -7.985   8.573
  251   2H6     A  23          H61         A  23  -2.420  -9.095   8.162
  252    H2     A  23           H2         A  23  -7.489  -9.661   7.017
  253   1H5*    A  24          H5*         A  24  -8.849 -13.862   2.569
  254   2H5*    A  24          H5**        A  24  -9.340 -13.333   0.960
  255    H4*    A  24           H4*        A  24  -9.804 -11.771   2.846
  256    H3*    A  24           H3*        A  24  -8.276 -10.641   0.489
  257    H2*    A  24           H2*        A  24  -8.653  -8.534   1.594
  258   2HO*    A  24          2HO*        A  24 -10.858  -9.578   2.403
  259    H1*    A  24           H1*        A  24  -8.080  -9.584   4.136
  260    H8     A  24           H8         A  24  -5.703 -10.659   1.361
  261   1H6     A  24          H61         A  24  -2.377  -5.670   2.970
  262   2H6     A  24          H62         A  24  -2.377  -7.115   1.960
  263    H2     A  24           H2         A  24  -6.174  -5.530   5.204
  264   1H5*    U  25          H5*         U  25 -11.069  -7.911   0.321
  265   2H5*    U  25          H5**        U  25 -11.490  -7.679  -1.377
  266    H4*    U  25           H4*        U  25 -10.613  -5.669  -0.456
  267    H3*    U  25           H3*        U  25  -8.683  -6.808  -2.504
  268    H2*    U  25           H2*        U  25  -7.585  -4.673  -2.230
  269   2HO*    U  25          2HO*        U  25  -9.960  -3.778  -1.789
  270    H1*    U  25           H1*        U  25  -7.818  -4.716   0.582
  271    H3     U  25           H3         U  25  -3.392  -5.147  -0.325
  272    H5     U  25           H5         U  25  -4.963  -8.967  -0.994
  273    H6     U  25           H6         U  25  -7.163  -8.036  -0.734
  274   1H5*    C  26          H5*         C  26  -9.244  -3.114  -3.650
  275   2H5*    C  26          H5**        C  26  -9.796  -2.996  -5.316
  276    H4*    C  26           H4*        C  26  -8.075  -1.495  -5.107
  277    H3*    C  26           H3*        C  26  -7.037  -3.861  -6.643
  278    H2*    C  26           H2*        C  26  -5.070  -2.565  -6.956
  279   2HO*    C  26          2HO*        C  26  -6.185  -0.561  -7.422
  280    H1*    C  26           H1*        C  26  -5.195  -1.375  -4.352
  281   1H4     C  26          H42         C  26  -0.264  -5.324  -4.198
  282   2H4     C  26          H41         C  26  -1.290  -6.626  -3.601
  283    H5     C  26           H5         C  26  -3.701  -6.379  -3.466
  284    H6     C  26           H6         C  26  -5.575  -4.866  -3.867
  285   1H5*    C  27          H5*         C  27  -7.560   0.791  -8.173
  286   2H5*    C  27          H5**        C  27  -8.284   0.312  -9.721
  287    H4*    C  27           H4*        C  27  -6.876   2.292  -9.946
  288    H3*    C  27           H3*        C  27  -6.054  -0.182 -11.453
  289    H2*    C  27           H2*        C  27  -4.252   1.052 -12.369
  290   2HO*    C  27          2HO*        C  27  -5.178   3.049 -12.837
  291    H1*    C  27           H1*        C  27  -3.637   2.435  -9.981
  292   1H4     C  27          H41         C  27   0.691  -2.164 -10.139
  293   2H4     C  27          H42         C  27  -0.398  -3.245  -9.272
  294    H5     C  27           H5         C  27  -2.681  -2.652  -8.796
  295    H6     C  27           H6         C  27  -4.374  -0.924  -9.056
  296   1H5*    A  28          H5*         A  28  -6.729   2.932 -14.088
  297   2H5*    A  28          H5**        A  28  -7.565   2.514 -15.581
  298    H4*    A  28           H4*        A  28  -5.213   3.652 -15.608
  299    H3*    A  28           H3*        A  28  -6.006   1.466 -17.536
  300    H2*    A  28           H2*        A  28  -3.931   1.990 -18.609
  301   2HO*    A  28          2HO*        A  28  -3.783   4.267 -18.347
  302    H1*    A  28           H1*        A  28  -2.534   2.159 -16.151
  303    H8     A  28           H8         A  28  -3.866  -0.781 -15.063
  304   1H6     A  28          H62         A  28  -1.059  -4.037 -19.570
  305   2H6     A  28          H61         A  28  -1.865  -4.156 -18.005
  306    H2     A  28           H2         A  28  -1.031   0.213 -20.754
  307   1H5*    G  29          H5*         G  29  -6.735   5.328 -21.159
  308   2H5*    G  29          H5**        G  29  -5.151   4.894 -21.805
  309    H4*    G  29           H4*        G  29  -5.721   5.954 -19.039
  310    H3*    G  29           H3*        G  29  -5.578   7.722 -20.981
  311    H2*    G  29           H2*        G  29  -3.704   6.464 -22.054
  312   2HO*    G  29          2HO*        G  29  -1.785   7.901 -21.481
  313    H1*    G  29           H1*        G  29  -2.352   6.729 -19.314
  314    H8     G  29           H8         G  29  -2.353   3.303 -20.241
  315    H1     G  29           H1         G  29   2.466   6.321 -23.191
  316   1H2     G  29          H22         G  29   2.163   8.498 -23.122
  317   2H2     G  29          H21         G  29   0.761   9.193 -22.349
  318   1H5*    U  30          H5*         U  30  -2.524  10.313 -19.986
  319   2H5*    U  30          H5**        U  30  -3.364  11.674 -19.232
  320    H4*    U  30           H4*        U  30  -2.963  11.289 -22.195
  321    H3*    U  30           H3*        U  30  -0.820  12.019 -20.876
  322    H2*    U  30           H2*        U  30  -2.124  13.541 -19.389
  323   2HO*    U  30          2HO*        U  30  -0.255  14.586 -21.000
  324    H1*    U  30           H1*        U  30  -3.160  14.786 -21.996
  325    H3     U  30           H3         U  30  -5.173  18.031 -19.583
  326    H5     U  30           H5         U  30  -6.446  14.520 -17.708
  327    H6     U  30           H6         U  30  -4.948  13.292 -19.152
  328   1H5*    G  31          H5*         G  31   0.222  15.873 -22.688
  329   2H5*    G  31          H5**        G  31   1.598  15.308 -23.653
  330    H4*    G  31           H4*        G  31   2.233  17.099 -22.152
  331    H3*    G  31           H3*        G  31   3.530  14.419 -21.595
  332    H2*    G  31           H2*        G  31   4.861  15.571 -19.990
  333   2HO*    G  31          2HO*        G  31   4.679  17.569 -21.597
  334    H1*    G  31           H1*        G  31   2.701  17.084 -18.978
  335    H8     G  31           H8         G  31   1.975  13.403 -19.753
  336    H1     G  31           H1         G  31   4.003  14.632 -13.802
  337   1H2     G  31          H21         G  31   4.564  16.396 -13.549
  338   2H2     G  31          H22         G  31   4.641  17.722 -14.586
  339   1H5*    G  32          H5*         G  32   6.671  16.744 -22.033
  340   2H5*    G  32          H5**        G  32   7.876  15.997 -23.093
  341    H4*    G  32           H4*        G  32   8.932  16.459 -21.065
  342    H3*    G  32           H3*        G  32   8.369  13.490 -21.124
  343    H2*    G  32           H2*        G  32   9.840  13.476 -19.228
  344   2HO*    G  32          2HO*        G  32  11.411  14.989 -19.546
  345    H1*    G  32           H1*        G  32   8.628  15.706 -18.114
  346    H8     G  32           H8         G  32   6.200  13.115 -19.550
  347    H1     G  32           H1         G  32   8.306  12.048 -13.597
  348   1H2     G  32          H21         G  32   9.673  13.234 -13.071
  349   2H2     G  32          H22         G  32  10.432  14.529 -13.833
  350   1H5*    U  33          H5*         U  33  12.971  13.691 -22.597
  351   2H5*    U  33          H5**        U  33  13.581  12.117 -22.169
  352    H4*    U  33           H4*        U  33  13.886  14.374 -20.709
  353    H3*    U  33           H3*        U  33  14.259  11.492 -19.955
  354    H2*    U  33           H2*        U  33  14.513  12.252 -17.646
  355   2HO*    U  33          2HO*        U  33  15.407  14.441 -18.824
  356    H1*    U  33           H1*        U  33  12.386  13.976 -17.634
  357    H3     U  33           H3         U  33  11.409  10.025 -15.339
  358    H5     U  33           H5         U  33   9.646   9.802 -19.153
  359    H6     U  33           H6         U  33  10.924  11.688 -19.769
  360   1H5*    C  34          H5*         C  34  17.653  13.624 -18.880
  361   2H5*    C  34          H5**        C  34  19.224  12.974 -19.385
  362    H4*    C  34           H4*        C  34  19.193  13.251 -17.001
  363    H3*    C  34           H3*        C  34  19.375  10.435 -18.023
  364    H2*    C  34           H2*        C  34  19.215   9.606 -15.783
  365   2HO*    C  34          2HO*        C  34  20.466  11.813 -15.197
  366    H1*    C  34           H1*        C  34  17.282  11.374 -14.863
  367   1H4     C  34          H41         C  34  14.133   6.191 -16.372
  368   2H4     C  34          H42         C  34  13.381   6.834 -17.755
  369    H5     C  34           H5         C  34  14.355   9.207 -18.629
  370    H6     C  34           H6         C  34  15.941  10.907 -18.004
  371   1H5*    C  35          H5*         C  35  21.789   9.565 -15.549
  372   2H5*    C  35          H5**        C  35  23.218   8.763 -16.221
  373    H4*    C  35           H4*        C  35  21.807   7.235 -14.912
  374    H3*    C  35           H3*        C  35  21.983   6.556 -17.866
  375    H2*    C  35           H2*        C  35  20.753   4.632 -17.331
  376   2HO*    C  35          2HO*        C  35  20.532   3.907 -15.135
  377    H1*    C  35           H1*        C  35  19.287   5.946 -15.172
  378   1H4     C  35          H42         C  35  15.167   4.298 -19.701
  379   2H4     C  35          H41         C  35  15.365   5.877 -20.452
  380    H5     C  35           H5         C  35  17.022   7.463 -19.701
  381    H6     C  35           H6         C  35  18.816   7.847 -18.094
  382    H3T    C  35           H3T        C  35  23.192   5.172 -15.823
  Start of MODEL    8
    1   1H5*    G   1          H5*         G   1  22.960   4.581 -26.371
    2   2H5*    G   1          H5**        G   1  22.028   3.482 -25.358
    3    H4*    G   1           H4*        G   1  23.529   4.479 -23.965
    4    H3*    G   1           H3*        G   1  20.867   4.841 -23.329
    5    H2*    G   1           H2*        G   1  20.686   7.149 -23.376
    6   2HO*    G   1          2HO*        G   1  21.842   6.403 -21.078
    7    H1*    G   1           H1*        G   1  23.636   7.737 -23.049
    8    H8     G   1           H8         G   1  21.268   7.730 -26.068
    9    H1     G   1           H1         G   1  23.261  13.529 -24.192
   10   1H2     G   1          H22         G   1  24.455  13.397 -22.397
   11   2H2     G   1          H21         G   1  24.760  11.841 -21.627
   12    H5T    G   1           H5T        G   1  20.268   4.708 -25.601
   13   1H5*    G   2          H5*         G   2  22.633   4.909 -18.880
   14   2H5*    G   2          H5**        G   2  21.310   4.085 -18.052
   15    H4*    G   2           H4*        G   2  21.931   6.394 -17.254
   16    H3*    G   2           H3*        G   2  19.025   5.814 -17.864
   17    H2*    G   2           H2*        G   2  18.622   8.014 -17.018
   18   2HO*    G   2          2HO*        G   2  20.473   7.524 -15.361
   19    H1*    G   2           H1*        G   2  20.970   9.122 -18.198
   20    H8     G   2           H8         G   2  18.907   7.036 -20.593
   21    H1     G   2           H1         G   2  17.047  13.157 -19.967
   22   1H2     G   2          H22         G   2  18.080  14.117 -18.359
   23   2H2     G   2          H21         G   2  19.225  13.217 -17.380
   24   1H5*    A   3          H5*         A   3  19.215   6.919 -13.443
   25   2H5*    A   3          H5**        A   3  17.639   6.450 -12.802
   26    H4*    A   3           H4*        A   3  18.379   8.946 -12.874
   27    H3*    A   3           H3*        A   3  15.545   8.138 -13.589
   28    H2*    A   3           H2*        A   3  15.171  10.517 -13.651
   29   2HO*    A   3          2HO*        A   3  16.830  10.758 -11.796
   30    H1*    A   3           H1*        A   3  17.529  11.041 -15.046
   31    H8     A   3           H8         A   3  16.167   8.059 -16.750
   32   1H6     A   3          H61         A   3  12.084  11.990 -19.399
   33   2H6     A   3          H62         A   3  12.641  10.392 -19.640
   34    H2     A   3           H2         A   3  14.031  14.098 -16.212
   35   1H5*    C   4          H5*         C   4  15.420  11.340 -10.555
   36   2H5*    C   4          H5**        C   4  13.980  11.013  -9.590
   37    H4*    C   4           H4*        C   4  14.211  13.286 -10.704
   38    H3*    C   4           H3*        C   4  11.616  11.745 -10.874
   39    H2*    C   4           H2*        C   4  10.757  13.756 -11.902
   40   2HO*    C   4          2HO*        C   4  12.580  14.981 -10.517
   41    H1*    C   4           H1*        C   4  12.939  14.030 -13.634
   42   1H4     C   4          H41         C   4   8.430  10.642 -16.570
   43   2H4     C   4          H42         C   4   9.444   9.289 -16.765
   44    H5     C   4           H5         C   4  11.722   9.296 -15.353
   45    H6     C   4           H6         C   4  13.057  10.702 -13.919
   46   1H5*    C   5          H5*         C   5  10.458  15.396  -9.869
   47   2H5*    C   5          H5**        C   5   9.403  15.342  -8.453
   48    H4*    C   5           H4*        C   5   8.384  16.544 -10.286
   49    H3*    C   5           H3*        C   5   6.962  14.027  -9.433
   50    H2*    C   5           H2*        C   5   5.258  14.633 -11.009
   51   2HO*    C   5          2HO*        C   5   5.459  16.959 -10.366
   52    H1*    C   5           H1*        C   5   7.108  15.675 -12.929
   53   1H4     C   5          H42         C   5   5.469  10.060 -15.541
   54   2H4     C   5          H41         C   5   6.619   9.303 -14.472
   55    H5     C   5           H5         C   5   7.822  10.383 -12.754
   56    H6     C   5           H6         C   5   8.220  12.504 -11.617
   57   1H5*    C   6          H5*         C   6   4.854  17.909  -8.901
   58   2H5*    C   6          H5**        C   6   4.424  17.954  -7.180
   59    H4*    C   6           H4*        C   6   2.656  18.945  -8.400
   60    H3*    C   6           H3*        C   6   1.894  16.195  -7.379
   61    H2*    C   6           H2*        C   6  -0.319  16.765  -8.095
   62   2HO*    C   6          2HO*        C   6  -0.044  19.103  -7.582
   63    H1*    C   6           H1*        C   6   0.606  17.630 -10.620
   64   1H4     C   6          H41         C   6  -0.615  11.512 -11.518
   65   2H4     C   6          H42         C   6   1.006  11.056 -11.002
   66    H5     C   6           H5         C   6   2.559  12.694 -10.102
   67    H6     C   6           H6         C   6   2.826  15.050  -9.531
   68   1H5*    G   7          H5*         G   7  -0.009  19.173  -4.116
   69   2H5*    G   7          H5**        G   7   0.000  18.065  -2.738
   70    H4*    G   7           H4*        G   7  -2.163  18.892  -2.931
   71    H3*    G   7           H3*        G   7  -2.158  16.056  -3.957
   72    H2*    G   7           H2*        G   7  -4.525  16.317  -4.105
   73   2HO*    G   7          2HO*        G   7  -4.359  17.663  -1.971
   74    H1*    G   7           H1*        G   7  -4.314  19.053  -4.897
   75    H8     G   7           H8         G   7  -2.518  16.160  -6.737
   76    H1     G   7           H1         G   7  -7.976  18.348  -9.320
   77   1H2     G   7          H22         G   7  -8.886  19.853  -7.984
   78   2H2     G   7          H21         G   7  -8.116  20.283  -6.468
   79   1H5*    C   8          H5*         C   8  -4.978  16.760  -0.635
   80   2H5*    C   8          H5**        C   8  -4.446  15.606   0.597
   81    H4*    C   8           H4*        C   8  -6.873  15.776   0.485
   82    H3*    C   8           H3*        C   8  -5.619  13.101  -0.153
   83    H2*    C   8           H2*        C   8  -7.863  12.255  -0.273
   84   2HO*    C   8          2HO*        C   8  -8.374  13.934   1.571
   85    H1*    C   8           H1*        C   8  -8.897  14.502  -1.661
   86   1H4     C   8          H41         C   8  -7.999  10.181  -6.165
   87   2H4     C   8          H42         C   8  -6.274  10.508  -6.227
   88    H5     C   8           H5         C   8  -5.205  12.033  -4.680
   89    H6     C   8           H6         C   8  -5.574  13.527  -2.785
   90   1H5*    C   9          H5*         C   9  -8.057  11.306   2.499
   91   2H5*    C   9          H5**        C   9  -7.129  11.478   4.004
   92    H4*    C   9           H4*        C   9  -8.189   9.292   3.786
   93    H3*    C   9           H3*        C   9  -5.165   9.245   3.816
   94    H2*    C   9           H2*        C   9  -5.461   6.876   4.149
   95   2HO*    C   9          2HO*        C   9  -7.330   6.157   4.966
   96    H1*    C   9           H1*        C   9  -7.207   6.720   1.991
   97   1H4     C   9          H42         C   9  -1.342   5.702  -0.145
   98   2H4     C   9          H41         C   9  -1.143   7.414  -0.504
   99    H5     C   9           H5         C   9  -2.797   9.060   0.135
  100    H6     C   9           H6         C   9  -4.947   9.366   1.246
  101   1H5*    A  10          H5*         A  10  -7.525   7.434   6.909
  102   2H5*    A  10          H5**        A  10  -6.675   7.097   8.417
  103    H4*    A  10           H4*        A  10  -7.944   5.192   7.510
  104    H3*    A  10           H3*        A  10  -4.976   4.742   7.848
  105    H2*    A  10           H2*        A  10  -5.565   2.425   7.509
  106   2HO*    A  10          2HO*        A  10  -7.573   1.882   8.197
  107    H1*    A  10           H1*        A  10  -7.200   3.059   5.315
  108    H8     A  10           H8         A  10  -3.986   5.098   5.428
  109   1H6     A  10          H62         A  10  -1.458   0.354   2.277
  110   2H6     A  10          H61         A  10  -1.161   1.995   2.850
  111    H2     A  10           H2         A  10  -5.483  -0.868   3.536
  112   1H5*    C  11          H5*         C  11  -8.053   3.016  10.202
  113   2H5*    C  11          H5**        C  11  -7.656   2.428  11.820
  114    H4*    C  11           H4*        C  11  -9.043   0.863  10.529
  115    H3*    C  11           H3*        C  11  -6.332  -0.104  11.435
  116    H2*    C  11           H2*        C  11  -6.962  -2.236  10.556
  117   2HO*    C  11          2HO*        C  11  -9.207  -2.198  11.257
  118    H1*    C  11           H1*        C  11  -8.224  -1.175   8.253
  119   1H4     C  11          H42         C  11  -2.607  -3.019   6.061
  120   2H4     C  11          H41         C  11  -1.809  -1.619   6.764
  121    H5     C  11           H5         C  11  -2.976  -0.049   8.160
  122    H6     C  11           H6         C  11  -5.132   0.491   9.167
  123   1H5*    U  12          H5*         U  12 -10.555  -1.187  12.402
  124   2H5*    U  12          H5**        U  12 -10.685  -1.714  14.092
  125    H4*    U  12           H4*        U  12 -12.215  -2.857  12.439
  126    H3*    U  12           H3*        U  12 -10.526  -4.267  14.444
  127    H2*    U  12           H2*        U  12 -10.960  -6.369  13.496
  128   2HO*    U  12          2HO*        U  12 -13.081  -6.570  13.151
  129    H1*    U  12           H1*        U  12 -11.232  -5.565  10.782
  130    H3     U  12           H3         U  12  -7.875  -8.739  11.079
  131    H5     U  12           H5         U  12  -6.042  -4.989  11.503
  132    H6     U  12           H6         U  12  -8.210  -4.033  11.722
  133   1H5*    G  13          H5*         G  13 -14.588  -5.624  14.438
  134   2H5*    G  13          H5**        G  13 -15.162  -6.163  16.021
  135    H4*    G  13           H4*        G  13 -15.247  -7.892  14.225
  136    H3*    G  13           H3*        G  13 -13.748  -8.467  16.777
  137    H2*    G  13           H2*        G  13 -13.291 -10.628  15.910
  138   2HO*    G  13          2HO*        G  13 -15.659 -10.416  14.872
  139    H1*    G  13           H1*        G  13 -12.928  -9.793  13.212
  140    H8     G  13           H8         G  13 -11.099  -7.746  15.837
  141    H1     G  13           H1         G  13  -7.881 -12.850  13.640
  142   1H2     G  13          H22         G  13  -9.147 -14.089  12.365
  143   2H2     G  13          H21         G  13 -10.823 -13.640  12.114
  144   1H5*    C  14          H5*         C  14 -15.753 -11.593  16.794
  145   2H5*    C  14          H5**        C  14 -16.608 -11.818  18.320
  146    H4*    C  14           H4*        C  14 -15.250 -13.654  18.093
  147    H3*    C  14           H3*        C  14 -13.858 -11.846  20.061
  148    H2*    C  14           H2*        C  14 -12.438 -13.750  20.413
  149   2HO*    C  14          2HO*        C  14 -13.400 -15.669  20.235
  150    H1*    C  14           H1*        C  14 -12.408 -14.386  17.641
  151   1H4     C  14          H42         C  14  -6.722 -11.959  18.805
  152   2H4     C  14          H41         C  14  -7.312 -10.307  18.600
  153    H5     C  14           H5         C  14  -9.696  -9.824  18.289
  154    H6     C  14           H6         C  14 -11.916 -10.847  18.127
  155   1H5*    A  15          H5*         A  15 -15.594 -15.610  21.209
  156   2H5*    A  15          H5**        A  15 -15.967 -15.872  22.919
  157    H4*    A  15           H4*        A  15 -14.674 -17.710  21.946
  158    H3*    A  15           H3*        A  15 -13.349 -16.181  24.203
  159    H2*    A  15           H2*        A  15 -11.583 -17.777  24.037
  160   2HO*    A  15          2HO*        A  15 -13.447 -19.452  23.468
  161    H1*    A  15           H1*        A  15 -11.575 -17.897  21.219
  162    H8     A  15           H8         A  15 -11.779 -14.457  22.967
  163   1H6     A  15          H62         A  15  -5.616 -14.281  22.167
  164   2H6     A  15          H61         A  15  -7.014 -13.370  22.712
  165    H2     A  15           H2         A  15  -7.040 -18.265  20.875
  166   1H5*    G  16          H5*         G  16 -13.304 -19.715  26.133
  167   2H5*    G  16          H5**        G  16 -13.560 -19.382  27.851
  168    H4*    G  16           H4*        G  16 -11.318 -20.190  27.380
  169    H3*    G  16           H3*        G  16 -11.400 -17.353  28.458
  170    H2*    G  16           H2*        G  16  -9.000 -17.639  28.593
  171   2HO*    G  16          2HO*        G  16  -8.593 -19.707  29.201
  172    H1*    G  16           H1*        G  16  -8.838 -18.762  25.982
  173    H8     G  16           H8         G  16 -11.343 -16.115  26.382
  174    H1     G  16           H1         G  16  -5.437 -13.901  25.188
  175   1H2     G  16          H22         G  16  -4.020 -15.501  25.340
  176   2H2     G  16          H21         G  16  -4.470 -17.143  25.753
  177   1H5*    A  17          H5*         A  17  -8.373 -17.172  32.250
  178   2H5*    A  17          H5**        A  17  -8.795 -16.750  30.587
  179    H4*    A  17           H4*        A  17  -6.779 -18.031  31.757
  180    H3*    A  17           H3*        A  17  -6.907 -16.827  29.072
  181    H2*    A  17           H2*        A  17  -5.161 -17.911  28.383
  182   2HO*    A  17          2HO*        A  17  -3.934 -17.185  30.489
  183    H1*    A  17           H1*        A  17  -5.414 -19.812  30.512
  184    H8     A  17           H8         A  17  -7.278 -20.709  27.289
  185   1H6     A  17          H62         A  17  -2.424 -24.664  26.893
  186   2H6     A  17          H61         A  17  -3.969 -24.264  26.142
  187    H2     A  17           H2         A  17  -1.740 -21.822  30.262
  188   1H5*    G  18          H5*         G  18  -3.162 -13.762  31.105
  189   2H5*    G  18          H5**        G  18  -1.907 -14.246  29.978
  190    H4*    G  18           H4*        G  18  -1.777 -15.039  32.365
  191    H3*    G  18           H3*        G  18  -1.256 -16.862  30.051
  192    H2*    G  18           H2*        G  18  -0.708 -18.519  31.645
  193   2HO*    G  18          2HO*        G  18   0.412 -16.637  32.918
  194    H1*    G  18           H1*        G  18  -2.664 -17.243  33.484
  195    H8     G  18           H8         G  18  -5.130 -18.174  32.381
  196    H1     G  18           H1         G  18  -1.975 -23.705  33.185
  197   1H2     G  18          H21         G  18   0.183 -23.281  33.224
  198   2H2     G  18          H22         G  18   0.790 -21.646  33.051
  199   1H5*    A  19          H5*         A  19   1.339 -18.911  30.222
  200   2H5*    A  19          H5**        A  19   2.612 -18.229  29.188
  201    H4*    A  19           H4*        A  19   2.073 -20.225  28.178
  202    H3*    A  19           H3*        A  19   0.431 -18.152  26.674
  203    H2*    A  19           H2*        A  19   0.071 -19.952  25.156
  204   2HO*    A  19          2HO*        A  19   2.384 -20.854  25.858
  205    H1*    A  19           H1*        A  19  -0.591 -21.710  27.190
  206    H8     A  19           H8         A  19  -1.933 -18.345  28.044
  207   1H6     A  19          H62         A  19  -6.509 -19.478  23.988
  208   2H6     A  19          H61         A  19  -6.020 -18.364  25.250
  209    H2     A  19           H2         A  19  -3.451 -22.584  23.477
  210   1H5*    U  20          H5*         U  20   2.139 -19.872  23.658
  211   2H5*    U  20          H5**        U  20   2.475 -18.719  22.367
  212    H4*    U  20           H4*        U  20   0.818 -20.605  21.994
  213    H3*    U  20           H3*        U  20   0.232 -17.859  20.961
  214    H2*    U  20           H2*        U  20  -1.735 -18.864  19.991
  215   2HO*    U  20          2HO*        U  20  -0.404 -21.005  19.784
  216    H1*    U  20           H1*        U  20  -2.536 -20.119  22.321
  217    H3     U  20           H3         U  20  -5.020 -16.289  21.793
  218    H5     U  20           H5         U  20  -1.481 -15.173  23.799
  219    H6     U  20           H6         U  20  -0.660 -17.295  23.383
  220   1H5*    G  21          H5*         G  21  -0.310 -20.862  17.766
  221   2H5*    G  21          H5**        G  21   0.344 -20.108  16.306
  222    H4*    G  21           H4*        G  21  -1.966 -20.950  16.058
  223    H3*    G  21           H3*        G  21  -1.470 -18.021  15.534
  224    H2*    G  21           H2*        G  21  -3.785 -17.865  14.940
  225   2HO*    G  21          2HO*        G  21  -3.508 -20.308  14.129
  226    H1*    G  21           H1*        G  21  -4.719 -19.413  17.053
  227    H8     G  21           H8         G  21  -1.870 -17.072  18.025
  228    H1     G  21           H1         G  21  -7.747 -14.534  18.387
  229   1H2     G  21          H22         G  21  -9.197 -15.883  17.534
  230   2H2     G  21          H21         G  21  -8.736 -17.428  16.832
  231   1H5*    C  22          H5*         C  22  -3.456 -20.365  12.307
  232   2H5*    C  22          H5**        C  22  -2.950 -19.718  10.746
  233    H4*    C  22           H4*        C  22  -5.437 -20.070  11.161
  234    H3*    C  22           H3*        C  22  -4.304 -17.580   9.907
  235    H2*    C  22           H2*        C  22  -6.513 -16.754   9.747
  236   2HO*    C  22          2HO*        C  22  -7.135 -19.224   9.323
  237    H1*    C  22           H1*        C  22  -7.441 -17.803  12.208
  238   1H4     C  22          H41         C  22  -6.582 -11.619  12.865
  239   2H4     C  22          H42         C  22  -5.224 -11.780  13.900
  240    H5     C  22           H5         C  22  -4.169 -14.184  14.073
  241    H6     C  22           H6         C  22  -4.502 -16.485  13.376
  242   1H5*    A  23          H5*         A  23  -7.335 -18.956   7.286
  243   2H5*    A  23          H5**        A  23  -6.972 -18.461   5.636
  244    H4*    A  23           H4*        A  23  -9.061 -17.580   6.799
  245    H3*    A  23           H3*        A  23  -7.624 -16.404   4.721
  246    H2*    A  23           H2*        A  23  -6.972 -14.445   5.791
  247   2HO*    A  23          2HO*        A  23  -9.384 -14.059   4.843
  248    H1*    A  23           H1*        A  23  -9.180 -14.618   7.877
  249    H8     A  23           H8         A  23  -5.350 -14.956   8.081
  250   1H6     A  23          H62         A  23  -5.543  -9.434  10.939
  251   2H6     A  23          H61         A  23  -4.485 -10.760  10.466
  252    H2     A  23           H2         A  23  -9.634 -10.425   9.603
  253   1H5*    A  24          H5*         A  24 -11.964 -14.192   4.384
  254   2H5*    A  24          H5**        A  24 -12.005 -14.046   2.625
  255    H4*    A  24           H4*        A  24 -12.493 -11.942   3.632
  256    H3*    A  24           H3*        A  24  -9.834 -11.876   2.182
  257    H2*    A  24           H2*        A  24  -9.817  -9.539   2.744
  258   2HO*    A  24          2HO*        A  24 -12.311  -9.608   2.357
  259    H1*    A  24           H1*        A  24 -10.868  -9.889   5.321
  260    H8     A  24           H8         A  24  -8.029 -12.176   4.070
  261   1H6     A  24          H61         A  24  -4.259  -8.371   7.133
  262   2H6     A  24          H62         A  24  -4.366  -9.874   6.215
  263    H2     A  24           H2         A  24  -8.346  -6.649   7.322
  264   1H5*    U  25          H5*         U  25 -12.055  -8.588   0.548
  265   2H5*    U  25          H5**        U  25 -11.652  -8.488  -1.168
  266    H4*    U  25           H4*        U  25 -11.232  -6.446   0.184
  267    H3*    U  25           H3*        U  25  -8.986  -7.529  -1.519
  268    H2*    U  25           H2*        U  25  -7.791  -5.525  -0.814
  269   2HO*    U  25          2HO*        U  25 -10.187  -4.561  -0.474
  270    H1*    U  25           H1*        U  25  -8.203  -5.986   1.856
  271    H3     U  25           H3         U  25  -4.114  -7.741   0.179
  272    H5     U  25           H5         U  25  -6.744 -10.909   0.983
  273    H6     U  25           H6         U  25  -8.473  -9.315   1.207
  274   1H5*    C  26          H5*         C  26  -9.125  -3.402  -2.014
  275   2H5*    C  26          H5**        C  26  -9.248  -3.043  -3.737
  276    H4*    C  26           H4*        C  26  -7.543  -1.703  -2.726
  277    H3*    C  26           H3*        C  26  -6.471  -3.737  -4.678
  278    H2*    C  26           H2*        C  26  -4.380  -2.562  -4.427
  279   2HO*    C  26          2HO*        C  26  -5.607  -0.437  -4.042
  280    H1*    C  26           H1*        C  26  -4.521  -2.634  -1.636
  281   1H4     C  26          H42         C  26  -1.564  -7.943  -3.530
  282   2H4     C  26          H41         C  26  -3.057  -8.844  -3.299
  283    H5     C  26           H5         C  26  -5.143  -7.751  -2.793
  284    H6     C  26           H6         C  26  -6.211  -5.601  -2.403
  285   1H5*    C  27          H5*         C  27  -5.869   0.702  -5.927
  286   2H5*    C  27          H5**        C  27  -6.771   0.641  -7.452
  287    H4*    C  27           H4*        C  27  -4.910   2.143  -7.656
  288    H3*    C  27           H3*        C  27  -4.820  -0.331  -9.363
  289    H2*    C  27           H2*        C  27  -2.697   0.307 -10.176
  290   2HO*    C  27          2HO*        C  27  -3.719   2.735  -9.954
  291    H1*    C  27           H1*        C  27  -1.764   1.542  -7.794
  292   1H4     C  27          H41         C  27   1.544  -3.802  -7.616
  293   2H4     C  27          H42         C  27   0.113  -4.759  -7.254
  294    H5     C  27           H5         C  27  -2.092  -3.797  -7.194
  295    H6     C  27           H6         C  27  -3.367  -1.734  -7.465
  296   1H5*    A  28          H5*         A  28  -3.966   2.386 -12.200
  297   2H5*    A  28          H5**        A  28  -5.481   2.670 -13.067
  298    H4*    A  28           H4*        A  28  -3.776   2.605 -14.650
  299    H3*    A  28           H3*        A  28  -5.318   0.005 -14.817
  300    H2*    A  28           H2*        A  28  -4.055  -0.275 -16.862
  301   2HO*    A  28          2HO*        A  28  -3.883   1.853 -17.694
  302    H1*    A  28           H1*        A  28  -1.660   0.557 -15.631
  303    H8     A  28           H8         A  28  -2.636  -1.527 -12.933
  304   1H6     A  28          H62         A  28  -1.668  -6.554 -16.503
  305   2H6     A  28          H61         A  28  -1.897  -6.017 -14.840
  306    H2     A  28           H2         A  28  -1.850  -3.034 -19.136
  307   1H5*    G  29          H5*         G  29  -7.846   2.274 -18.957
  308   2H5*    G  29          H5**        G  29  -6.756   1.369 -20.013
  309    H4*    G  29           H4*        G  29  -5.907   3.439 -17.985
  310    H3*    G  29           H3*        G  29  -6.928   4.309 -20.237
  311    H2*    G  29           H2*        G  29  -5.772   2.724 -21.692
  312   2HO*    G  29          2HO*        G  29  -4.727   5.287 -21.580
  313    H1*    G  29           H1*        G  29  -3.112   3.298 -20.303
  314    H8     G  29           H8         G  29  -4.028  -0.038 -19.526
  315    H1     G  29           H1         G  29  -1.760   0.196 -25.522
  316   1H2     G  29          H22         G  29  -1.738   2.291 -26.226
  317   2H2     G  29          H21         G  29  -2.287   3.596 -25.189
  318   1H5*    U  30          H5*         U  30  -2.941   7.187 -21.000
  319   2H5*    U  30          H5**        U  30  -3.749   8.376 -19.965
  320    H4*    U  30           H4*        U  30  -3.820   8.346 -22.971
  321    H3*    U  30           H3*        U  30  -1.516   9.083 -21.953
  322    H2*    U  30           H2*        U  30  -2.657  10.377 -20.136
  323   2HO*    U  30          2HO*        U  30  -1.050  11.673 -21.806
  324    H1*    U  30           H1*        U  30  -4.094  11.734 -22.485
  325    H3     U  30           H3         U  30  -5.999  14.795 -19.775
  326    H5     U  30           H5         U  30  -6.444  11.240 -17.621
  327    H6     U  30           H6         U  30  -5.165  10.125 -19.336
  328   1H5*    G  31          H5*         G  31  -1.129  12.901 -23.811
  329   2H5*    G  31          H5**        G  31   0.156  12.644 -25.001
  330    H4*    G  31           H4*        G  31   0.622  14.443 -23.356
  331    H3*    G  31           H3*        G  31   2.590  12.153 -23.517
  332    H2*    G  31           H2*        G  31   3.894  13.363 -21.935
  333   2HO*    G  31          2HO*        G  31   3.859  15.495 -22.147
  334    H1*    G  31           H1*        G  31   1.693  14.193 -20.374
  335    H8     G  31           H8         G  31   1.726  10.557 -21.555
  336    H1     G  31           H1         G  31   4.589  11.720 -15.929
  337   1H2     G  31          H21         G  31   4.731  13.536 -15.524
  338   2H2     G  31          H22         G  31   4.252  14.917 -16.355
  339   1H5*    G  32          H5*         G  32   4.112  16.148 -24.303
  340   2H5*    G  32          H5**        G  32   5.557  16.185 -25.317
  341    H4*    G  32           H4*        G  32   5.740  17.372 -23.128
  342    H3*    G  32           H3*        G  32   7.786  15.232 -23.741
  343    H2*    G  32           H2*        G  32   8.844  15.978 -21.706
  344   2HO*    G  32          2HO*        G  32   8.096  18.290 -22.221
  345    H1*    G  32           H1*        G  32   6.509  16.063 -20.248
  346    H8     G  32           H8         G  32   6.603  13.130 -22.654
  347    H1     G  32           H1         G  32   9.515  12.110 -17.050
  348   1H2     G  32          H21         G  32   9.688  13.605 -15.996
  349   2H2     G  32          H22         G  32   9.254  15.210 -16.168
  350   1H5*    U  33          H5*         U  33  10.297  19.149 -24.703
  351   2H5*    U  33          H5**        U  33  11.919  18.529 -24.865
  352    H4*    U  33           H4*        U  33  10.943  19.672 -22.652
  353    H3*    U  33           H3*        U  33  13.292  17.854 -23.043
  354    H2*    U  33           H2*        U  33  13.502  17.715 -20.641
  355   2HO*    U  33          2HO*        U  33  12.488  20.138 -20.746
  356    H1*    U  33           H1*        U  33  10.813  17.400 -20.067
  357    H3     U  33           H3         U  33  13.228  13.375 -19.595
  358    H5     U  33           H5         U  33  10.997  13.246 -23.175
  359    H6     U  33           H6         U  33  10.604  15.560 -22.926
  360   1H5*    C  34          H5*         C  34  14.847  21.355 -21.031
  361   2H5*    C  34          H5**        C  34  16.350  21.951 -21.762
  362    H4*    C  34           H4*        C  34  16.688  21.359 -19.431
  363    H3*    C  34           H3*        C  34  18.206  19.687 -21.428
  364    H2*    C  34           H2*        C  34  19.093  18.424 -19.600
  365   2HO*    C  34          2HO*        C  34  18.839  20.651 -18.282
  366    H1*    C  34           H1*        C  34  16.690  18.145 -18.228
  367   1H4     C  34          H41         C  34  17.368  13.087 -21.862
  368   2H4     C  34          H42         C  34  16.162  13.475 -22.975
  369    H5     C  34           H5         C  34  15.191  16.006 -22.792
  370    H6     C  34           H6         C  34  15.378  17.988 -21.426
  371   1H5*    C  35          H5*         C  35  21.516  19.764 -18.376
  372   2H5*    C  35          H5**        C  35  22.338  21.112 -19.182
  373    H4*    C  35           H4*        C  35  23.891  19.320 -18.681
  374    H3*    C  35           H3*        C  35  23.406  19.720 -21.642
  375    H2*    C  35           H2*        C  35  25.145  18.117 -21.984
  376   2HO*    C  35          2HO*        C  35  26.184  18.968 -19.827
  377    H1*    C  35           H1*        C  35  24.116  16.324 -20.106
  378   1H4     C  35          H42         C  35  21.560  14.619 -25.664
  379   2H4     C  35          H41         C  35  20.246  15.763 -25.426
  380    H5     C  35           H5         C  35  20.184  17.304 -23.595
  381    H6     C  35           H6         C  35  21.350  18.069 -21.617
  382    H3T    C  35           H3T        C  35  24.340  21.447 -20.721
  Start of MODEL    9
    1   1H5*    G   1          H5*         G   1  22.544   7.313 -27.858
    2   2H5*    G   1          H5**        G   1  22.065   6.535 -26.353
    3    H4*    G   1           H4*        G   1  23.619   8.077 -25.754
    4    H3*    G   1           H3*        G   1  21.152   8.357 -24.590
    5    H2*    G   1           H2*        G   1  20.492  10.426 -25.417
    6   2HO*    G   1          2HO*        G   1  22.047  10.798 -23.290
    7    H1*    G   1           H1*        G   1  23.267  11.474 -25.969
    8    H8     G   1           H8         G   1  20.493  10.097 -28.234
    9    H1     G   1           H1         G   1  21.552  16.400 -28.760
   10   1H2     G   1          H22         G   1  23.008  17.068 -27.319
   11   2H2     G   1          H21         G   1  23.744  15.945 -26.182
   12    H5T    G   1           H5T        G   1  20.106   7.461 -26.467
   13   1H5*    G   2          H5*         G   2  23.918  10.181 -21.058
   14   2H5*    G   2          H5**        G   2  22.974   9.659 -19.658
   15    H4*    G   2           H4*        G   2  23.374  12.146 -19.927
   16    H3*    G   2           H3*        G   2  20.526  11.185 -19.570
   17    H2*    G   2           H2*        G   2  19.967  13.490 -19.502
   18   2HO*    G   2          2HO*        G   2  21.393  14.757 -18.516
   19    H1*    G   2           H1*        G   2  21.776  14.202 -21.569
   20    H8     G   2           H8         G   2  19.679  11.152 -22.377
   21    H1     G   2           H1         G   2  16.856  16.828 -23.479
   22   1H2     G   2          H22         G   2  18.004  18.417 -22.677
   23   2H2     G   2          H21         G   2  19.492  18.094 -21.803
   24   1H5*    A   3          H5*         A   3  21.651  14.017 -16.361
   25   2H5*    A   3          H5**        A   3  20.631  13.716 -14.948
   26    H4*    A   3           H4*        A   3  20.537  16.036 -15.892
   27    H3*    A   3           H3*        A   3  17.935  14.513 -15.603
   28    H2*    A   3           H2*        A   3  16.875  16.536 -16.318
   29   2HO*    A   3          2HO*        A   3  18.781  17.724 -15.070
   30    H1*    A   3           H1*        A   3  18.797  17.130 -18.286
   31    H8     A   3           H8         A   3  18.065  13.547 -18.801
   32   1H6     A   3          H61         A   3  12.813  15.408 -21.605
   33   2H6     A   3          H62         A   3  13.782  14.003 -21.491
   34    H2     A   3           H2         A   3  14.471  18.818 -19.538
   35   1H5*    C   4          H5*         C   4  17.102  18.347 -13.586
   36   2H5*    C   4          H5**        C   4  16.144  17.848 -12.187
   37    H4*    C   4           H4*        C   4  15.094  19.532 -13.723
   38    H3*    C   4           H3*        C   4  13.557  17.047 -12.962
   39    H2*    C   4           H2*        C   4  11.764  17.916 -14.296
   40   2HO*    C   4          2HO*        C   4  12.612  20.204 -13.482
   41    H1*    C   4           H1*        C   4  13.404  18.939 -16.356
   42   1H4     C   4          H41         C   4  10.960  13.600 -18.598
   43   2H4     C   4          H42         C   4  12.372  12.682 -18.423
   44    H5     C   4           H5         C   4  14.311  13.779 -16.965
   45    H6     C   4           H6         C   4  14.921  15.847 -15.832
   46   1H5*    C   5          H5*         C   5  10.812  20.155 -12.438
   47   2H5*    C   5          H5**        C   5   9.857  19.812 -10.995
   48    H4*    C   5           H4*        C   5   8.514  20.034 -13.021
   49    H3*    C   5           H3*        C   5   8.297  17.433 -11.529
   50    H2*    C   5           H2*        C   5   6.724  16.745 -13.169
   51   2HO*    C   5          2HO*        C   5   6.015  19.249 -13.054
   52    H1*    C   5           H1*        C   5   7.898  18.208 -15.321
   53   1H4     C   5          H42         C   5   9.168  12.230 -17.107
   54   2H4     C   5          H41         C   5  10.261  12.063 -15.753
   55    H5     C   5           H5         C   5  10.615  13.711 -14.070
   56    H6     C   5           H6         C   5   9.983  15.947 -13.299
   57   1H5*    C   6          H5*         C   6   4.279  18.807 -11.827
   58   2H5*    C   6          H5**        C   6   3.830  19.171 -10.154
   59    H4*    C   6           H4*        C   6   2.020  18.045 -10.999
   60    H3*    C   6           H3*        C   6   3.625  16.096  -9.339
   61    H2*    C   6           H2*        C   6   1.893  14.525  -9.805
   62   2HO*    C   6          2HO*        C   6   0.370  16.631  -9.680
   63    H1*    C   6           H1*        C   6   1.427  15.445 -12.473
   64   1H4     C   6          H41         C   6   4.280   9.881 -13.187
   65   2H4     C   6          H42         C   6   5.872  10.601 -12.968
   66    H5     C   6           H5         C   6   6.145  12.931 -12.357
   67    H6     C   6           H6         C   6   4.963  15.006 -11.845
   68   1H5*    G   7          H5*         G   7   0.410  15.268  -7.609
   69   2H5*    G   7          H5**        G   7   0.422  15.697  -5.884
   70    H4*    G   7           H4*        G   7  -0.086  13.329  -6.283
   71    H3*    G   7           H3*        G   7   2.404  13.945  -4.673
   72    H2*    G   7           H2*        G   7   2.611  11.610  -4.344
   73   2HO*    G   7          2HO*        G   7   0.347  11.097  -4.199
   74    H1*    G   7           H1*        G   7   2.255  10.978  -7.027
   75    H8     G   7           H8         G   7   4.068  14.006  -7.644
   76    H1     G   7           H1         G   7   7.837   9.705  -4.734
   77   1H2     G   7          H22         G   7   6.596   8.108  -3.855
   78   2H2     G   7          H21         G   7   4.849   8.133  -4.005
   79   1H5*    C   8          H5*         C   8   0.672  13.058   0.005
   80   2H5*    C   8          H5**        C   8   1.803  11.751  -0.329
   81    H4*    C   8           H4*        C   8  -0.842  12.218  -1.707
   82    H3*    C   8           H3*        C   8   0.111  10.150   0.273
   83    H2*    C   8           H2*        C   8  -1.475   8.698  -0.733
   84   2HO*    C   8          2HO*        C   8  -2.936  10.676  -1.211
   85    H1*    C   8           H1*        C   8  -0.654   9.285  -3.350
   86   1H4     C   8          H41         C   8   2.469   4.207  -1.217
   87   2H4     C   8          H42         C   8   3.788   5.216  -0.632
   88    H5     C   8           H5         C   8   3.652   7.640  -0.671
   89    H6     C   8           H6         C   8   2.228   9.545  -1.291
   90   1H5*    C   9          H5*         C   9  -3.522   8.718   1.181
   91   2H5*    C   9          H5**        C   9  -3.954   9.685   2.603
   92    H4*    C   9           H4*        C   9  -4.227   7.126   2.661
   93    H3*    C   9           H3*        C   9  -3.093   8.756   4.928
   94    H2*    C   9           H2*        C   9  -3.076   6.712   6.176
   95   2HO*    C   9          2HO*        C   9  -4.877   5.590   5.355
   96    H1*    C   9           H1*        C   9  -1.754   5.293   4.194
   97   1H4     C   9          H42         C   9   2.636   8.181   7.820
   98   2H4     C   9          H41         C   9   2.997   9.241   6.458
   99    H5     C   9           H5         C   9   1.631   9.251   4.432
  100    H6     C   9           H6         C   9  -0.298   8.240   3.382
  101   1H5*    A  10          H5*         A  10  -7.200   6.021   5.053
  102   2H5*    A  10          H5**        A  10  -7.879   6.378   6.648
  103    H4*    A  10           H4*        A  10  -8.012   4.063   6.357
  104    H3*    A  10           H3*        A  10  -5.758   4.667   8.271
  105    H2*    A  10           H2*        A  10  -5.576   2.309   8.550
  106   2HO*    A  10          2HO*        A  10  -7.550   1.354   8.600
  107    H1*    A  10           H1*        A  10  -6.203   1.758   5.846
  108    H8     A  10           H8         A  10  -3.286   4.178   6.760
  109   1H6     A  10          H62         A  10   0.234  -0.834   5.764
  110   2H6     A  10          H61         A  10   0.270   0.889   6.116
  111    H2     A  10           H2         A  10  -4.010  -2.076   5.453
  112   1H5*    C  11          H5*         C  11  -9.427   2.252   9.126
  113   2H5*    C  11          H5**        C  11  -9.867   2.381  10.830
  114    H4*    C  11           H4*        C  11 -10.099   0.106   9.921
  115    H3*    C  11           H3*        C  11  -8.203   0.486  12.236
  116    H2*    C  11           H2*        C  11  -8.150  -1.909  12.327
  117   2HO*    C  11          2HO*        C  11 -10.402  -2.267  11.679
  118    H1*    C  11           H1*        C  11  -7.686  -2.156   9.576
  119   1H4     C  11          H42         C  11  -2.003  -1.887  12.372
  120   2H4     C  11          H41         C  11  -1.982  -0.131  12.227
  121    H5     C  11           H5         C  11  -3.910   1.106  11.413
  122    H6     C  11           H6         C  11  -6.191   0.881  10.627
  123   1H5*    U  12          H5*         U  12 -12.460  -1.302  12.684
  124   2H5*    U  12          H5**        U  12 -12.899  -1.301  14.400
  125    H4*    U  12           H4*        U  12 -13.535  -3.371  13.233
  126    H3*    U  12           H3*        U  12 -11.619  -3.620  15.548
  127    H2*    U  12           H2*        U  12 -11.692  -5.973  15.198
  128   2HO*    U  12          2HO*        U  12 -13.859  -6.410  14.882
  129    H1*    U  12           H1*        U  12 -11.934  -5.787  12.372
  130    H3     U  12           H3         U  12  -8.309  -8.403  13.144
  131    H5     U  12           H5         U  12  -6.879  -4.458  13.362
  132    H6     U  12           H6         U  12  -9.157  -3.706  13.313
  133   1H5*    G  13          H5*         G  13 -15.523  -5.758  15.867
  134   2H5*    G  13          H5**        G  13 -16.007  -5.982  17.556
  135    H4*    G  13           H4*        G  13 -15.997  -8.081  16.214
  136    H3*    G  13           H3*        G  13 -14.236  -7.937  18.657
  137    H2*    G  13           H2*        G  13 -13.569 -10.150  18.229
  138   2HO*    G  13          2HO*        G  13 -15.616 -11.060  17.787
  139    H1*    G  13           H1*        G  13 -13.616  -9.933  15.401
  140    H8     G  13           H8         G  13 -11.747  -7.455  17.674
  141    H1     G  13           H1         G  13  -8.302 -12.268  15.250
  142   1H2     G  13          H21         G  13  -9.280 -13.478  14.265
  143   2H2     G  13          H22         G  13 -10.899 -13.632  13.878
  144   1H5*    C  14          H5*         C  14 -17.250 -11.776  18.671
  145   2H5*    C  14          H5**        C  14 -17.498 -11.819  20.422
  146    H4*    C  14           H4*        C  14 -16.827 -13.988  19.245
  147    H3*    C  14           H3*        C  14 -15.382 -13.081  21.734
  148    H2*    C  14           H2*        C  14 -14.229 -15.131  21.625
  149   2HO*    C  14          2HO*        C  14 -15.183 -16.856  20.817
  150    H1*    C  14           H1*        C  14 -13.880 -15.073  18.828
  151   1H4     C  14          H41         C  14  -8.589 -13.705  21.755
  152   2H4     C  14          H42         C  14  -8.646 -12.003  21.637
  153    H5     C  14           H5         C  14 -11.057 -11.031  20.800
  154    H6     C  14           H6         C  14 -13.216 -11.782  19.963
  155   1H5*    A  15          H5*         A  15 -17.050 -17.103  22.049
  156   2H5*    A  15          H5**        A  15 -17.237 -17.575  23.740
  157    H4*    A  15           H4*        A  15 -15.770 -19.038  22.311
  158    H3*    A  15           H3*        A  15 -14.732 -17.986  24.947
  159    H2*    A  15           H2*        A  15 -12.784 -19.301  24.535
  160   2HO*    A  15          2HO*        A  15 -14.488 -20.882  23.316
  161    H1*    A  15           H1*        A  15 -12.663 -18.736  21.768
  162    H8     A  15           H8         A  15 -13.268 -15.874  24.269
  163   1H6     A  15          H62         A  15  -7.104 -15.012  23.943
  164   2H6     A  15          H61         A  15  -8.611 -14.396  24.593
  165    H2     A  15           H2         A  15  -8.127 -18.680  21.639
  166   1H5*    G  16          H5*         G  16 -14.318 -21.983  25.868
  167   2H5*    G  16          H5**        G  16 -14.732 -22.136  27.574
  168    H4*    G  16           H4*        G  16 -12.471 -22.761  27.227
  169    H3*    G  16           H3*        G  16 -12.558 -20.137  28.733
  170    H2*    G  16           H2*        G  16 -10.238 -20.667  29.166
  171   2HO*    G  16          2HO*        G  16  -9.297 -22.592  28.399
  172    H1*    G  16           H1*        G  16  -9.806 -20.820  26.422
  173    H8     G  16           H8         G  16 -12.842 -18.717  27.272
  174    H1     G  16           H1         G  16  -7.381 -15.360  26.903
  175   1H2     G  16          H22         G  16  -5.686 -16.711  26.700
  176   2H2     G  16          H21         G  16  -5.907 -18.451  26.664
  177   1H5*    A  17          H5*         A  17 -10.039 -20.560  32.402
  178   2H5*    A  17          H5**        A  17 -10.369 -21.465  30.947
  179    H4*    A  17           H4*        A  17 -11.751 -22.267  33.443
  180    H3*    A  17           H3*        A  17  -8.870 -22.440  32.829
  181    H2*    A  17           H2*        A  17  -8.753 -24.703  32.892
  182   2HO*    A  17          2HO*        A  17  -9.767 -24.671  35.098
  183    H1*    A  17           H1*        A  17 -11.618 -25.137  32.405
  184    H8     A  17           H8         A  17 -11.377 -24.296  29.266
  185   1H6     A  17          H62         A  17  -7.893 -29.235  27.768
  186   2H6     A  17          H61         A  17  -8.934 -27.980  27.106
  187    H2     A  17           H2         A  17  -7.639 -28.678  32.130
  188   1H5*    G  18          H5*         G  18  -6.591 -19.655  34.217
  189   2H5*    G  18          H5**        G  18  -7.853 -20.520  33.346
  190    H4*    G  18           H4*        G  18  -5.500 -22.022  34.397
  191    H3*    G  18           H3*        G  18  -5.366 -20.436  31.815
  192    H2*    G  18           H2*        G  18  -4.151 -22.288  30.949
  193   2HO*    G  18          2HO*        G  18  -3.182 -22.411  33.362
  194    H1*    G  18           H1*        G  18  -5.687 -24.225  32.464
  195    H8     G  18           H8         G  18  -7.722 -21.845  30.450
  196    H1     G  18           H1         G  18  -5.924 -27.097  27.215
  197   1H2     G  18          H21         G  18  -4.434 -28.235  28.387
  198   2H2     G  18          H22         G  18  -3.914 -27.654  29.962
  199   1H5*    A  19          H5*         A  19  -1.160 -20.784  32.076
  200   2H5*    A  19          H5**        A  19  -0.562 -19.314  31.300
  201    H4*    A  19           H4*        A  19  -0.102 -21.412  30.067
  202    H3*    A  19           H3*        A  19  -1.676 -19.309  28.546
  203    H2*    A  19           H2*        A  19  -1.394 -20.804  26.685
  204   2HO*    A  19          2HO*        A  19   0.822 -21.495  27.749
  205    H1*    A  19           H1*        A  19  -2.178 -23.044  28.068
  206    H8     A  19           H8         A  19  -4.114 -20.019  29.256
  207   1H6     A  19          H62         A  19  -7.801 -20.965  24.330
  208   2H6     A  19          H61         A  19  -7.639 -20.029  25.814
  209    H2     A  19           H2         A  19  -4.314 -23.633  23.955
  210   1H5*    U  20          H5*         U  20   0.865 -20.087  25.594
  211   2H5*    U  20          H5**        U  20   1.032 -18.604  24.659
  212    H4*    U  20           H4*        U  20  -0.277 -20.713  23.820
  213    H3*    U  20           H3*        U  20  -0.896 -17.907  22.987
  214    H2*    U  20           H2*        U  20  -2.646 -18.859  21.665
  215   2HO*    U  20          2HO*        U  20  -1.203 -20.941  21.446
  216    H1*    U  20           H1*        U  20  -3.718 -20.392  23.625
  217    H3     U  20           H3         U  20  -6.228 -16.611  23.147
  218    H5     U  20           H5         U  20  -3.083 -15.607  25.788
  219    H6     U  20           H6         U  20  -2.121 -17.683  25.306
  220   1H5*    G  21          H5*         G  21  -1.061 -20.451  19.598
  221   2H5*    G  21          H5**        G  21  -0.638 -19.535  18.154
  222    H4*    G  21           H4*        G  21  -2.969 -20.573  18.312
  223    H3*    G  21           H3*        G  21  -2.544 -17.740  17.381
  224    H2*    G  21           H2*        G  21  -4.912 -17.715  16.948
  225   2HO*    G  21          2HO*        G  21  -4.582 -20.245  16.482
  226    H1*    G  21           H1*        G  21  -5.626 -19.010  19.308
  227    H8     G  21           H8         G  21  -2.879 -16.451  19.749
  228    H1     G  21           H1         G  21  -8.834 -14.102  19.897
  229   1H2     G  21          H21         G  21 -10.120 -15.356  19.456
  230   2H2     G  21          H22         G  21 -10.095 -16.986  19.050
  231   1H5*    C  22          H5*         C  22  -4.746 -20.181  14.547
  232   2H5*    C  22          H5**        C  22  -4.211 -19.814  12.905
  233    H4*    C  22           H4*        C  22  -6.683 -19.824  13.286
  234    H3*    C  22           H3*        C  22  -5.373 -17.450  11.964
  235    H2*    C  22           H2*        C  22  -7.561 -16.537  11.732
  236   2HO*    C  22          2HO*        C  22  -8.290 -19.001  11.480
  237    H1*    C  22           H1*        C  22  -8.481 -17.330  14.282
  238   1H4     C  22          H41         C  22  -6.886 -11.212  14.571
  239   2H4     C  22          H42         C  22  -5.577 -11.485  15.616
  240    H5     C  22           H5         C  22  -4.803 -14.031  15.923
  241    H6     C  22           H6         C  22  -5.421 -16.287  15.343
  242   1H5*    A  23          H5*         A  23  -8.394 -18.463   9.432
  243   2H5*    A  23          H5**        A  23  -7.952 -18.270   7.739
  244    H4*    A  23           H4*        A  23  -9.872 -16.936   8.550
  245    H3*    A  23           H3*        A  23  -8.020 -16.103   6.640
  246    H2*    A  23           H2*        A  23  -7.229 -14.228   7.779
  247   2HO*    A  23          2HO*        A  23  -9.566 -13.550   6.552
  248    H1*    A  23           H1*        A  23  -9.752 -13.977   9.461
  249    H8     A  23           H8         A  23  -6.013 -14.651  10.147
  250   1H6     A  23          H62         A  23  -6.076  -9.144  13.010
  251   2H6     A  23          H61         A  23  -5.087 -10.557  12.638
  252    H2     A  23           H2         A  23 -10.072  -9.798  11.244
  253   1H5*    A  24          H5*         A  24 -12.343 -14.004   6.064
  254   2H5*    A  24          H5**        A  24 -12.372 -13.524   4.363
  255    H4*    A  24           H4*        A  24 -13.086 -11.759   5.944
  256    H3*    A  24           H3*        A  24 -10.722 -11.117   4.170
  257    H2*    A  24           H2*        A  24 -10.864  -8.919   5.109
  258   2HO*    A  24          2HO*        A  24 -13.389  -9.319   5.091
  259    H1*    A  24           H1*        A  24 -11.442  -9.867   7.731
  260    H8     A  24           H8         A  24  -8.566 -11.355   5.647
  261   1H6     A  24          H61         A  24  -5.006  -7.381   8.817
  262   2H6     A  24          H62         A  24  -4.947  -8.700   7.645
  263    H2     A  24           H2         A  24  -9.176  -6.576   9.887
  264   1H5*    U  25          H5*         U  25 -12.510  -7.901   3.301
  265   2H5*    U  25          H5**        U  25 -12.443  -7.578   1.563
  266    H4*    U  25           H4*        U  25 -11.250  -5.883   2.754
  267    H3*    U  25           H3*        U  25  -9.397  -7.638   1.123
  268    H2*    U  25           H2*        U  25  -7.680  -6.065   1.772
  269   2HO*    U  25          2HO*        U  25  -9.641  -4.361   1.890
  270    H1*    U  25           H1*        U  25  -8.426  -6.049   4.456
  271    H3     U  25           H3         U  25  -4.590  -8.506   4.346
  272    H5     U  25           H5         U  25  -7.603 -11.182   3.208
  273    H6     U  25           H6         U  25  -9.111  -9.335   3.106
  274   1H5*    C  26          H5*         C  26  -8.434  -4.025   0.170
  275   2H5*    C  26          H5**        C  26  -8.714  -3.653  -1.527
  276    H4*    C  26           H4*        C  26  -6.664  -2.789  -1.132
  277    H3*    C  26           H3*        C  26  -6.118  -5.452  -2.417
  278    H2*    C  26           H2*        C  26  -3.861  -4.710  -2.495
  279   2HO*    C  26          2HO*        C  26  -3.637  -2.580  -2.899
  280    H1*    C  26           H1*        C  26  -4.036  -3.461   0.086
  281   1H4     C  26          H42         C  26  -0.471  -8.628   0.790
  282   2H4     C  26          H41         C  26  -1.886  -9.562   1.272
  283    H5     C  26           H5         C  26  -4.130  -8.636   1.136
  284    H6     C  26           H6         C  26  -5.433  -6.668   0.517
  285   1H5*    C  27          H5*         C  27  -5.222  -1.658  -4.183
  286   2H5*    C  27          H5**        C  27  -5.791  -1.584  -5.854
  287    H4*    C  27           H4*        C  27  -3.747  -0.300  -5.486
  288    H3*    C  27           H3*        C  27  -3.604  -2.591  -7.449
  289    H2*    C  27           H2*        C  27  -1.451  -1.704  -8.038
  290   2HO*    C  27          2HO*        C  27  -2.376   0.580  -7.226
  291    H1*    C  27           H1*        C  27  -0.617  -1.640  -5.396
  292   1H4     C  27          H41         C  27   0.664  -7.433  -7.666
  293   2H4     C  27          H42         C  27  -0.707  -8.084  -6.769
  294    H5     C  27           H5         C  27  -2.272  -6.640  -5.622
  295    H6     C  27           H6         C  27  -2.818  -4.332  -5.108
  296   1H5*    A  28          H5*         A  28  -2.190   0.117  -9.682
  297   2H5*    A  28          H5**        A  28  -3.496   0.691 -10.733
  298    H4*    A  28           H4*        A  28  -1.588   0.629 -12.057
  299    H3*    A  28           H3*        A  28  -3.284  -1.798 -12.706
  300    H2*    A  28           H2*        A  28  -1.730  -2.078 -14.535
  301   2HO*    A  28          2HO*        A  28  -1.242   0.044 -15.199
  302    H1*    A  28           H1*        A  28   0.506  -1.590 -12.902
  303    H8     A  28           H8         A  28  -1.897  -3.658 -10.914
  304   1H6     A  28          H62         A  28   0.581  -8.593 -13.794
  305   2H6     A  28          H61         A  28  -0.482  -8.096 -12.478
  306    H2     A  28           H2         A  28   2.036  -4.958 -15.822
  307   1H5*    G  29          H5*         G  29  -4.980   1.014 -16.883
  308   2H5*    G  29          H5**        G  29  -3.927  -0.006 -17.863
  309    H4*    G  29           H4*        G  29  -3.007   1.841 -15.647
  310    H3*    G  29           H3*        G  29  -3.601   2.969 -17.920
  311    H2*    G  29           H2*        G  29  -2.642   1.136 -19.284
  312   2HO*    G  29          2HO*        G  29  -1.441   3.565 -19.268
  313    H1*    G  29           H1*        G  29  -0.060   1.423 -17.656
  314    H8     G  29           H8         G  29  -1.742  -1.821 -17.398
  315    H1     G  29           H1         G  29   2.218  -1.562 -22.435
  316   1H2     G  29          H22         G  29   2.802   0.523 -22.823
  317   2H2     G  29          H21         G  29   2.197   1.829 -21.822
  318   1H5*    U  30          H5*         U  30   0.192   5.064 -18.931
  319   2H5*    U  30          H5**        U  30  -0.352   6.668 -18.444
  320    H4*    U  30           H4*        U  30  -0.531   5.412 -21.163
  321    H3*    U  30           H3*        U  30   1.620   6.756 -20.482
  322    H2*    U  30           H2*        U  30   0.180   8.495 -19.338
  323   2HO*    U  30          2HO*        U  30   1.622   9.242 -21.611
  324    H1*    U  30           H1*        U  30  -1.068   8.620 -22.117
  325    H3     U  30           H3         U  30  -3.222  12.459 -21.121
  326    H5     U  30           H5         U  30  -4.113  10.000 -17.850
  327    H6     U  30           H6         U  30  -2.596   8.360 -18.776
  328   1H5*    G  31          H5*         G  31   1.142   9.621 -24.008
  329   2H5*    G  31          H5**        G  31   2.728   9.521 -24.783
  330    H4*    G  31           H4*        G  31   1.674  11.757 -23.705
  331    H3*    G  31           H3*        G  31   4.592  11.117 -24.159
  332    H2*    G  31           H2*        G  31   5.002  13.321 -23.279
  333   2HO*    G  31          2HO*        G  31   2.614  13.868 -24.211
  334    H1*    G  31           H1*        G  31   3.315  12.999 -21.098
  335    H8     G  31           H8         G  31   4.921   9.722 -21.915
  336    H1     G  31           H1         G  31   8.599  13.625 -18.367
  337   1H2     G  31          H21         G  31   7.883  15.398 -18.231
  338   2H2     G  31          H22         G  31   6.449  16.046 -18.865
  339   1H5*    G  32          H5*         G  32   3.716  14.863 -25.595
  340   2H5*    G  32          H5**        G  32   4.630  15.280 -27.045
  341    H4*    G  32           H4*        G  32   4.973  16.871 -25.209
  342    H3*    G  32           H3*        G  32   7.423  15.381 -26.127
  343    H2*    G  32           H2*        G  32   8.624  16.834 -24.699
  344   2HO*    G  32          2HO*        G  32   7.839  18.852 -24.735
  345    H1*    G  32           H1*        G  32   6.717  16.727 -22.618
  346    H8     G  32           H8         G  32   7.771  13.474 -24.334
  347    H1     G  32           H1         G  32  11.420  15.258 -19.391
  348   1H2     G  32          H21         G  32  11.011  16.916 -18.711
  349   2H2     G  32          H22         G  32   9.873  18.086 -19.089
  350   1H5*    U  33          H5*         U  33   7.833  19.799 -27.474
  351   2H5*    U  33          H5**        U  33   9.365  19.922 -28.328
  352    H4*    U  33           H4*        U  33   8.989  21.157 -26.080
  353    H3*    U  33           H3*        U  33  11.578  19.829 -26.871
  354    H2*    U  33           H2*        U  33  12.412  20.524 -24.694
  355   2HO*    U  33          2HO*        U  33  10.776  22.516 -25.009
  356    H1*    U  33           H1*        U  33  10.178  19.783 -23.268
  357    H3     U  33           H3         U  33  13.469  16.787 -22.242
  358    H5     U  33           H5         U  33  11.536  15.211 -25.625
  359    H6     U  33           H6         U  33  10.396  17.303 -25.835
  360   1H5*    C  34          H5*         C  34  12.928  24.009 -26.326
  361   2H5*    C  34          H5**        C  34  13.973  24.389 -27.711
  362    H4*    C  34           H4*        C  34  15.147  24.608 -25.570
  363    H3*    C  34           H3*        C  34  16.199  22.612 -27.550
  364    H2*    C  34           H2*        C  34  17.784  21.843 -25.963
  365   2HO*    C  34          2HO*        C  34  17.876  24.314 -25.273
  366    H1*    C  34           H1*        C  34  16.160  22.038 -23.673
  367   1H4     C  34          H41         C  34  16.343  15.980 -25.111
  368   2H4     C  34          H42         C  34  14.870  15.858 -25.876
  369    H5     C  34           H5         C  34  13.657  18.261 -26.400
  370    H6     C  34           H6         C  34  13.956  20.638 -26.029
  371   1H5*    C  35          H5*         C  35  19.758  24.484 -26.059
  372   2H5*    C  35          H5**        C  35  20.490  25.276 -27.465
  373    H4*    C  35           H4*        C  35  22.160  24.006 -26.304
  374    H3*    C  35           H3*        C  35  21.416  22.779 -28.969
  375    H2*    C  35           H2*        C  35  23.257  21.291 -28.597
  376   2HO*    C  35          2HO*        C  35  24.380  23.114 -27.265
  377    H1*    C  35           H1*        C  35  22.382  20.629 -26.048
  378   1H4     C  35          H42         C  35  19.476  16.671 -30.098
  379   2H4     C  35          H41         C  35  18.052  17.701 -30.068
  380    H5     C  35           H5         C  35  18.021  19.834 -28.962
  381    H6     C  35           H6         C  35  19.333  21.404 -27.661
  382    H3T    C  35           H3T        C  35  22.295  24.758 -29.173
  Start of MODEL   10
    1   1H5*    G   1          H5*         G   1  16.910  -0.152 -23.470
    2   2H5*    G   1          H5**        G   1  15.849  -0.246 -22.070
    3    H4*    G   1           H4*        G   1  18.002   0.164 -21.319
    4    H3*    G   1           H3*        G   1  15.976   1.859 -20.508
    5    H2*    G   1           H2*        G   1  16.729   3.890 -21.298
    6   2HO*    G   1          2HO*        G   1  18.045   3.309 -19.039
    7    H1*    G   1           H1*        G   1  19.644   3.120 -21.560
    8    H8     G   1           H8         G   1  16.766   3.483 -24.065
    9    H1     G   1           H1         G   1  21.219   8.076 -24.397
   10   1H2     G   1          H22         G   1  22.688   7.858 -22.856
   11   2H2     G   1          H21         G   1  22.589   6.551 -21.676
   12    H5T    G   1           H5T        G   1  14.952   1.697 -22.612
   13   1H5*    G   2          H5*         G   2  18.673   2.222 -16.580
   14   2H5*    G   2          H5**        G   2  17.381   2.303 -15.380
   15    H4*    G   2           H4*        G   2  19.018   4.214 -15.460
   16    H3*    G   2           H3*        G   2  16.064   4.876 -15.529
   17    H2*    G   2           H2*        G   2  16.804   7.154 -15.387
   18   2HO*    G   2          2HO*        G   2  18.734   6.178 -13.963
   19    H1*    G   2           H1*        G   2  19.005   6.758 -17.144
   20    H8     G   2           H8         G   2  15.751   5.283 -18.422
   21    H1     G   2           H1         G   2  16.648  11.523 -19.694
   22   1H2     G   2          H22         G   2  18.375  12.282 -18.630
   23   2H2     G   2          H21         G   2  19.276  11.222 -17.559
   24   1H5*    A   3          H5*         A   3  17.947   6.787 -12.078
   25   2H5*    A   3          H5**        A   3  16.723   7.160 -10.861
   26    H4*    A   3           H4*        A   3  18.019   9.095 -11.787
   27    H3*    A   3           H3*        A   3  14.996   9.267 -11.965
   28    H2*    A   3           H2*        A   3  15.448  11.563 -12.558
   29   2HO*    A   3          2HO*        A   3  17.476  11.490 -11.074
   30    H1*    A   3           H1*        A   3  17.448  10.842 -14.365
   31    H8     A   3           H8         A   3  14.748   8.309 -14.789
   32   1H6     A   3          H61         A   3  11.725  12.695 -18.040
   33   2H6     A   3          H62         A   3  11.659  11.007 -17.765
   34    H2     A   3           H2         A   3  15.056  14.602 -16.051
   35   1H5*    C   4          H5*         C   4  16.198  12.759 -10.102
   36   2H5*    C   4          H5**        C   4  15.086  13.029  -8.752
   37    H4*    C   4           H4*        C   4  15.164  14.958 -10.175
   38    H3*    C   4           H3*        C   4  12.495  13.529 -10.346
   39    H2*    C   4           H2*        C   4  11.780  15.559 -11.436
   40   2HO*    C   4          2HO*        C   4  13.601  16.791 -10.110
   41    H1*    C   4           H1*        C   4  13.928  15.430 -13.196
   42   1H4     C   4          H41         C   4   9.055  12.340 -15.685
   43   2H4     C   4          H42         C   4   9.604  10.796 -15.330
   44    H5     C   4           H5         C   4  11.676  10.631 -13.659
   45    H6     C   4           H6         C   4  13.319  12.007 -12.488
   46   1H5*    C   5          H5*         C   5  11.064  17.042  -9.437
   47   2H5*    C   5          H5**        C   5  10.234  16.888  -7.883
   48    H4*    C   5           H4*        C   5   8.780  17.990  -9.376
   49    H3*    C   5           H3*        C   5   7.845  15.158  -8.887
   50    H2*    C   5           H2*        C   5   5.897  15.792 -10.136
   51   2HO*    C   5          2HO*        C   5   6.141  18.095  -9.145
   52    H1*    C   5           H1*        C   5   7.362  17.186 -12.094
   53   1H4     C   5          H42         C   5   6.286  11.421 -14.694
   54   2H4     C   5          H41         C   5   7.591  10.810 -13.720
   55    H5     C   5           H5         C   5   8.786  12.007 -12.092
   56    H6     C   5           H6         C   5   9.038  14.147 -10.973
   57   1H5*    C   6          H5*         C   6   4.906  18.317  -7.084
   58   2H5*    C   6          H5**        C   6   4.591  17.602  -5.496
   59    H4*    C   6           H4*        C   6   2.575  18.512  -6.446
   60    H3*    C   6           H3*        C   6   2.515  15.498  -6.225
   61    H2*    C   6           H2*        C   6   0.193  15.721  -6.790
   62   2HO*    C   6          2HO*        C   6  -0.495  17.645  -5.841
   63    H1*    C   6           H1*        C   6   0.748  17.391  -8.955
   64   1H4     C   6          H41         C   6   0.609  11.433 -11.043
   65   2H4     C   6          H42         C   6   2.336  11.240 -10.776
   66    H5     C   6           H5         C   6   3.643  12.972  -9.674
   67    H6     C   6           H6         C   6   3.529  15.182  -8.636
   68   1H5*    G   7          H5*         G   7   0.022  18.260  -3.378
   69   2H5*    G   7          H5**        G   7  -0.426  17.271  -1.982
   70    H4*    G   7           H4*        G   7  -2.148  18.887  -2.848
   71    H3*    G   7           H3*        G   7  -2.970  15.996  -2.482
   72    H2*    G   7           H2*        G   7  -5.166  16.794  -2.984
   73   2HO*    G   7          2HO*        G   7  -4.537  18.898  -1.740
   74    H1*    G   7           H1*        G   7  -4.253  18.538  -5.045
   75    H8     G   7           H8         G   7  -2.830  15.000  -5.051
   76    H1     G   7           H1         G   7  -8.374  15.728  -8.212
   77   1H2     G   7          H22         G   7  -9.198  17.740  -7.833
   78   2H2     G   7          H21         G   7  -8.351  18.868  -6.791
   79   1H5*    C   8          H5*         C   8  -5.838  18.028  -0.032
   80   2H5*    C   8          H5**        C   8  -5.662  17.253   1.548
   81    H4*    C   8           H4*        C   8  -7.890  17.129   1.212
   82    H3*    C   8           H3*        C   8  -6.859  14.448   0.283
   83    H2*    C   8           H2*        C   8  -9.139  13.893  -0.107
   84   2HO*    C   8          2HO*        C   8  -9.533  15.343   2.004
   85    H1*    C   8           H1*        C   8  -9.881  16.534  -0.940
   86   1H4     C   8          H41         C   8 -10.055  13.548  -6.469
   87   2H4     C   8          H42         C   8  -8.321  13.261  -6.481
   88    H5     C   8           H5         C   8  -6.911  13.886  -4.596
   89    H6     C   8           H6         C   8  -6.901  14.897  -2.363
   90   1H5*    C   9          H5*         C   9  -9.664  13.173   2.613
   91   2H5*    C   9          H5**        C   9  -8.972  12.876   4.216
   92    H4*    C   9           H4*        C   9 -10.674  11.264   3.656
   93    H3*    C   9           H3*        C   9  -7.898  10.103   3.958
   94    H2*    C   9           H2*        C   9  -9.030   7.972   3.906
   95   2HO*    C   9          2HO*        C   9 -11.119   9.259   4.763
   96    H1*    C   9           H1*        C   9 -10.318   8.606   1.545
   97   1H4     C   9          H42         C   9  -4.576   6.257   0.191
   98   2H4     C   9          H41         C   9  -3.996   7.879  -0.188
   99    H5     C   9           H5         C   9  -5.353   9.844   0.244
  100    H6     C   9           H6         C   9  -7.494  10.614   1.102
  101   1H5*    A  10          H5*         A  10 -10.773   8.277   6.428
  102   2H5*    A  10          H5**        A  10 -10.112   8.001   8.039
  103    H4*    A  10           H4*        A  10 -11.267   6.051   7.158
  104    H3*    A  10           H3*        A  10  -8.324   5.672   7.709
  105    H2*    A  10           H2*        A  10  -8.766   3.346   7.275
  106   2HO*    A  10          2HO*        A  10 -10.739   2.746   8.013
  107    H1*    A  10           H1*        A  10 -10.414   3.875   5.046
  108    H8     A  10           H8         A  10  -7.388   6.110   5.046
  109   1H6     A  10          H62         A  10  -4.524   1.609   1.868
  110   2H6     A  10          H61         A  10  -4.403   3.281   2.422
  111    H2     A  10           H2         A  10  -8.355  -0.021   3.307
  112   1H5*    C  11          H5*         C  11 -11.372   3.784  10.243
  113   2H5*    C  11          H5**        C  11 -10.865   3.231  11.846
  114    H4*    C  11           H4*        C  11 -12.008   1.476  10.544
  115    H3*    C  11           H3*        C  11  -9.178   0.991  11.427
  116    H2*    C  11           H2*        C  11  -9.176  -1.087  10.268
  117   2HO*    C  11          2HO*        C  11 -11.358  -1.700  10.975
  118    H1*    C  11           H1*        C  11 -10.811  -0.270   8.123
  119   1H4     C  11          H42         C  11  -5.273  -0.213   5.202
  120   2H4     C  11          H41         C  11  -4.655   1.108   6.194
  121    H5     C  11           H5         C  11  -5.927   2.039   8.018
  122    H6     C  11           H6         C  11  -8.029   1.893   9.242
  123   1H5*    U  12          H5*         U  12 -13.030  -1.238  11.932
  124   2H5*    U  12          H5**        U  12 -13.094  -2.057  13.497
  125    H4*    U  12           H4*        U  12 -14.213  -3.197  11.524
  126    H3*    U  12           H3*        U  12 -12.502  -4.512  13.554
  127    H2*    U  12           H2*        U  12 -12.340  -6.503  12.347
  128   2HO*    U  12          2HO*        U  12 -14.227  -7.173  11.594
  129    H1*    U  12           H1*        U  12 -12.469  -5.459   9.716
  130    H3     U  12           H3         U  12  -8.499  -7.823  10.361
  131    H5     U  12           H5         U  12  -7.706  -3.778  11.106
  132    H6     U  12           H6         U  12 -10.043  -3.388  11.078
  133   1H5*    G  13          H5*         G  13 -15.900  -7.010  13.163
  134   2H5*    G  13          H5**        G  13 -16.392  -7.630  14.743
  135    H4*    G  13           H4*        G  13 -15.796  -9.396  13.146
  136    H3*    G  13           H3*        G  13 -14.159  -9.293  15.686
  137    H2*    G  13           H2*        G  13 -13.029 -11.236  14.859
  138   2HO*    G  13          2HO*        G  13 -15.316 -11.858  13.912
  139    H1*    G  13           H1*        G  13 -12.885 -10.386  12.185
  140    H8     G  13           H8         G  13 -12.069  -7.702  14.761
  141    H1     G  13           H1         G  13  -7.156 -11.345  12.882
  142   1H2     G  13          H21         G  13  -7.607 -12.750  11.827
  143   2H2     G  13          H22         G  13  -9.070 -13.316  11.228
  144   1H5*    C  14          H5*         C  14 -15.609 -13.686  15.788
  145   2H5*    C  14          H5**        C  14 -16.149 -13.720  17.465
  146    H4*    C  14           H4*        C  14 -14.636 -15.540  16.859
  147    H3*    C  14           H3*        C  14 -13.729 -13.836  19.157
  148    H2*    C  14           H2*        C  14 -11.919 -15.305  19.357
  149   2HO*    C  14          2HO*        C  14 -12.244 -17.386  19.044
  150    H1*    C  14           H1*        C  14 -11.673 -15.814  16.547
  151   1H4     C  14          H41         C  14  -6.597 -12.792  18.544
  152   2H4     C  14          H42         C  14  -7.045 -11.233  18.041
  153    H5     C  14           H5         C  14  -9.640 -10.987  17.280
  154    H6     C  14           H6         C  14 -11.642 -12.315  16.878
  155   1H5*    A  15          H5*         A  15 -14.108 -18.254  19.978
  156   2H5*    A  15          H5**        A  15 -14.326 -18.467  21.722
  157    H4*    A  15           H4*        A  15 -12.422 -19.743  20.780
  158    H3*    A  15           H3*        A  15 -11.824 -17.730  22.958
  159    H2*    A  15           H2*        A  15  -9.596 -18.577  22.900
  160   2HO*    A  15          2HO*        A  15 -10.489 -20.845  22.543
  161    H1*    A  15           H1*        A  15  -9.516 -18.823  20.084
  162    H8     A  15           H8         A  15 -10.853 -15.600  21.753
  163   1H6     A  15          H62         A  15  -5.132 -13.396  20.680
  164   2H6     A  15          H61         A  15  -6.743 -12.989  21.261
  165    H2     A  15           H2         A  15  -5.183 -17.662  19.551
  166   1H5*    G  16          H5*         G  16 -10.957 -21.324  24.995
  167   2H5*    G  16          H5**        G  16 -11.144 -21.013  26.720
  168    H4*    G  16           H4*        G  16  -8.871 -21.489  26.148
  169    H3*    G  16           H3*        G  16  -9.166 -18.598  27.007
  170    H2*    G  16           H2*        G  16  -6.728 -18.815  27.291
  171   2HO*    G  16          2HO*        G  16  -5.957 -20.909  27.277
  172    H1*    G  16           H1*        G  16  -6.644 -19.483  24.571
  173    H8     G  16           H8         G  16  -9.833 -17.537  25.434
  174    H1     G  16           H1         G  16  -5.020 -13.863  23.359
  175   1H2     G  16          H22         G  16  -3.210 -14.996  23.167
  176   2H2     G  16          H21         G  16  -3.132 -16.701  23.561
  177   1H5*    A  17          H5*         A  17  -6.501 -17.233  29.726
  178   2H5*    A  17          H5**        A  17  -6.714 -18.911  29.267
  179    H4*    A  17           H4*        A  17  -7.712 -18.106  31.929
  180    H3*    A  17           H3*        A  17  -4.933 -17.791  31.078
  181    H2*    A  17           H2*        A  17  -3.956 -19.512  32.207
  182   2HO*    A  17          2HO*        A  17  -5.237 -18.662  34.189
  183    H1*    A  17           H1*        A  17  -6.140 -21.339  32.386
  184    H8     A  17           H8         A  17  -6.695 -21.166  29.090
  185   1H6     A  17          H62         A  17  -1.303 -23.952  27.732
  186   2H6     A  17          H61         A  17  -2.885 -23.523  27.094
  187    H2     A  17           H2         A  17  -1.073 -22.486  31.895
  188   1H5*    G  18          H5*         G  18  -3.981 -14.380  29.973
  189   2H5*    G  18          H5**        G  18  -4.689 -15.986  29.985
  190    H4*    G  18           H4*        G  18  -2.209 -15.607  31.530
  191    H3*    G  18           H3*        G  18  -1.956 -15.769  28.529
  192    H2*    G  18           H2*        G  18   0.084 -16.885  29.077
  193   2HO*    G  18          2HO*        G  18   0.171 -15.290  31.104
  194    H1*    G  18           H1*        G  18  -1.162 -18.247  31.285
  195    H8     G  18           H8         G  18  -3.307 -18.987  28.460
  196    H1     G  18           H1         G  18   2.370 -21.955  27.997
  197   1H2     G  18          H21         G  18   3.803 -21.062  29.433
  198   2H2     G  18          H22         G  18   3.304 -19.742  30.475
  199   1H5*    A  19          H5*         A  19   1.799 -15.028  28.894
  200   2H5*    A  19          H5**        A  19   2.239 -13.869  27.631
  201    H4*    A  19           H4*        A  19   3.345 -15.992  27.298
  202    H3*    A  19           H3*        A  19   1.408 -15.206  25.121
  203    H2*    A  19           H2*        A  19   2.024 -17.233  23.999
  204   2HO*    A  19          2HO*        A  19   4.333 -16.853  25.074
  205    H1*    A  19           H1*        A  19   1.937 -18.863  26.207
  206    H8     A  19           H8         A  19  -0.785 -16.177  26.194
  207   1H6     A  19          H62         A  19  -4.311 -20.388  23.338
  208   2H6     A  19          H61         A  19  -4.324 -18.794  24.076
  209    H2     A  19           H2         A  19  -0.213 -22.018  23.603
  210   1H5*    U  20          H5*         U  20   3.852 -16.384  22.724
  211   2H5*    U  20          H5**        U  20   3.931 -15.366  21.289
  212    H4*    U  20           H4*        U  20   2.858 -17.688  21.206
  213    H3*    U  20           H3*        U  20   1.739 -15.386  19.671
  214    H2*    U  20           H2*        U  20   0.112 -16.944  18.852
  215   2HO*    U  20          2HO*        U  20   1.857 -18.746  19.017
  216    H1*    U  20           H1*        U  20  -0.541 -18.030  21.268
  217    H3     U  20           H3         U  20  -3.808 -15.062  19.971
  218    H5     U  20           H5         U  20  -0.900 -12.847  22.077
  219    H6     U  20           H6         U  20   0.458 -14.731  22.054
  220   1H5*    G  21          H5*         G  21   1.741 -18.739  17.070
  221   2H5*    G  21          H5**        G  21   1.996 -18.140  15.432
  222    H4*    G  21           H4*        G  21  -0.177 -19.339  15.914
  223    H3*    G  21           H3*        G  21  -0.238 -16.655  14.523
  224    H2*    G  21           H2*        G  21  -2.589 -17.085  14.266
  225   2HO*    G  21          2HO*        G  21  -1.923 -19.557  14.122
  226    H1*    G  21           H1*        G  21  -2.949 -18.026  16.868
  227    H8     G  21           H8         G  21  -0.634 -15.037  16.578
  228    H1     G  21           H1         G  21  -6.885 -13.712  16.897
  229   1H2     G  21          H21         G  21  -7.964 -15.222  16.816
  230   2H2     G  21          H22         G  21  -7.636 -16.872  16.720
  231   1H5*    C  22          H5*         C  22  -2.366 -18.912  12.246
  232   2H5*    C  22          H5**        C  22  -1.964 -18.782  10.541
  233    H4*    C  22           H4*        C  22  -4.266 -18.413  10.920
  234    H3*    C  22           H3*        C  22  -2.931 -15.961   9.810
  235    H2*    C  22           H2*        C  22  -5.161 -15.177   9.532
  236   2HO*    C  22          2HO*        C  22  -5.864 -17.459   8.953
  237    H1*    C  22           H1*        C  22  -6.051 -16.345  11.988
  238   1H4     C  22          H41         C  22  -5.848 -10.047  12.640
  239   2H4     C  22          H42         C  22  -4.753 -10.098  13.919
  240    H5     C  22           H5         C  22  -3.513 -12.521  14.317
  241    H6     C  22           H6         C  22  -3.559 -14.811  13.537
  242   1H5*    A  23          H5*         A  23  -5.920 -17.745   7.231
  243   2H5*    A  23          H5**        A  23  -5.691 -17.305   5.544
  244    H4*    A  23           H4*        A  23  -7.889 -16.764   6.750
  245    H3*    A  23           H3*        A  23  -7.107 -15.845   4.389
  246    H2*    A  23           H2*        A  23  -5.718 -14.104   5.523
  247   2HO*    A  23          2HO*        A  23  -8.199 -13.177   4.484
  248    H1*    A  23           H1*        A  23  -8.311 -13.631   7.102
  249    H8     A  23           H8         A  23  -4.458 -13.391   7.752
  250   1H6     A  23          H62         A  23  -5.905  -7.900  10.378
  251   2H6     A  23          H61         A  23  -4.561  -8.997  10.054
  252    H2     A  23           H2         A  23  -9.585  -9.681   8.779
  253   1H5*    A  24          H5*         A  24  -8.986 -14.258   0.791
  254   2H5*    A  24          H5**        A  24  -7.883 -13.447   1.863
  255    H4*    A  24           H4*        A  24 -10.868 -13.385   2.257
  256    H3*    A  24           H3*        A  24  -9.017 -11.410   0.960
  257    H2*    A  24           H2*        A  24 -10.452  -9.717   1.864
  258   2HO*    A  24          2HO*        A  24 -12.343 -11.375   1.402
  259    H1*    A  24           H1*        A  24 -10.830 -11.093   4.325
  260    H8     A  24           H8         A  24  -7.176 -10.906   3.395
  261   1H6     A  24          H61         A  24  -7.243  -5.377   6.275
  262   2H6     A  24          H62         A  24  -6.166  -6.581   5.573
  263    H2     A  24           H2         A  24 -11.388  -6.741   5.851
  264   1H5*    U  25          H5*         U  25 -11.988  -9.098  -0.015
  265   2H5*    U  25          H5**        U  25 -11.689  -8.662  -1.701
  266    H4*    U  25           H4*        U  25 -11.571  -6.735  -0.262
  267    H3*    U  25           H3*        U  25  -8.956  -7.387  -1.626
  268    H2*    U  25           H2*        U  25  -8.138  -5.358  -0.637
  269   2HO*    U  25          2HO*        U  25 -10.581  -4.535  -0.804
  270    H1*    U  25           H1*        U  25  -9.158  -5.859   1.887
  271    H3     U  25           H3         U  25  -4.679  -6.679   2.317
  272    H5     U  25           H5         U  25  -6.216 -10.148   0.556
  273    H6     U  25           H6         U  25  -8.302  -8.999   0.307
  274   1H5*    C  26          H5*         C  26  -9.612  -3.433  -2.303
  275   2H5*    C  26          H5**        C  26  -9.330  -3.047  -4.004
  276    H4*    C  26           H4*        C  26  -8.036  -1.617  -2.565
  277    H3*    C  26           H3*        C  26  -6.361  -3.487  -4.246
  278    H2*    C  26           H2*        C  26  -4.505  -2.155  -3.450
  279   2HO*    C  26          2HO*        C  26  -6.081  -0.192  -3.357
  280    H1*    C  26           H1*        C  26  -5.368  -2.276  -0.789
  281   1H4     C  26          H42         C  26  -1.323  -7.066  -1.753
  282   2H4     C  26          H41         C  26  -2.671  -8.193  -1.889
  283    H5     C  26           H5         C  26  -4.977  -7.414  -1.957
  284    H6     C  26           H6         C  26  -6.393  -5.430  -1.906
  285   1H5*    C  27          H5*         C  27  -5.555   0.960  -5.226
  286   2H5*    C  27          H5**        C  27  -6.260   0.909  -6.855
  287    H4*    C  27           H4*        C  27  -4.373   2.418  -6.779
  288    H3*    C  27           H3*        C  27  -4.067  -0.037  -8.502
  289    H2*    C  27           H2*        C  27  -1.921   0.750  -9.130
  290   2HO*    C  27          2HO*        C  27  -2.701   3.012  -9.297
  291    H1*    C  27           H1*        C  27  -1.227   1.740  -6.570
  292   1H4     C  27          H41         C  27   1.900  -3.718  -6.888
  293   2H4     C  27          H42         C  27   0.488  -4.612  -6.334
  294    H5     C  27           H5         C  27  -1.658  -3.546  -6.028
  295    H6     C  27           H6         C  27  -2.867  -1.437  -6.203
  296   1H5*    A  28          H5*         A  28  -3.174   3.153 -11.216
  297   2H5*    A  28          H5**        A  28  -4.663   3.225 -12.172
  298    H4*    A  28           H4*        A  28  -2.845   3.538 -13.636
  299    H3*    A  28           H3*        A  28  -4.027   0.772 -13.995
  300    H2*    A  28           H2*        A  28  -2.594   0.663 -15.921
  301   2HO*    A  28          2HO*        A  28  -2.655   2.780 -16.773
  302    H1*    A  28           H1*        A  28  -0.405   1.792 -14.546
  303    H8     A  28           H8         A  28  -1.772  -0.590 -12.084
  304   1H6     A  28          H62         A  28   1.062  -5.105 -15.301
  305   2H6     A  28          H61         A  28   0.246  -4.726 -13.785
  306    H2     A  28           H2         A  28   1.102  -1.448 -17.772
  307   1H5*    G  29          H5*         G  29  -6.676   2.739 -18.153
  308   2H5*    G  29          H5**        G  29  -5.506   1.887 -19.162
  309    H4*    G  29           H4*        G  29  -4.839   4.104 -17.215
  310    H3*    G  29           H3*        G  29  -5.932   4.834 -19.462
  311    H2*    G  29           H2*        G  29  -4.717   3.126 -20.776
  312   2HO*    G  29          2HO*        G  29  -3.770   5.781 -21.044
  313    H1*    G  29           H1*        G  29  -2.108   4.172 -19.562
  314    H8     G  29           H8         G  29  -2.868   0.677 -18.830
  315    H1     G  29           H1         G  29   0.110   1.315 -24.472
  316   1H2     G  29          H22         G  29   0.091   3.418 -25.100
  317   2H2     G  29          H21         G  29  -0.666   4.649 -24.105
  318   1H5*    U  30          H5*         U  30  -1.742   7.221 -20.736
  319   2H5*    U  30          H5**        U  30  -2.367   8.450 -19.632
  320    H4*    U  30           H4*        U  30  -2.369   8.509 -22.640
  321    H3*    U  30           H3*        U  30  -0.200   9.271 -21.317
  322    H2*    U  30           H2*        U  30  -1.615  10.568 -19.724
  323   2HO*    U  30          2HO*        U  30   0.067  11.969 -21.406
  324    H1*    U  30           H1*        U  30  -2.710  11.700 -22.367
  325    H3     U  30           H3         U  30  -4.838  15.197 -20.495
  326    H5     U  30           H5         U  30  -5.588  12.118 -17.768
  327    H6     U  30           H6         U  30  -4.165  10.692 -19.097
  328   1H5*    G  31          H5*         G  31  -0.207  13.296 -23.305
  329   2H5*    G  31          H5**        G  31   1.329  13.271 -24.199
  330    H4*    G  31           H4*        G  31   0.938  15.206 -22.638
  331    H3*    G  31           H3*        G  31   3.493  13.610 -22.605
  332    H2*    G  31           H2*        G  31   4.311  15.183 -21.006
  333   2HO*    G  31          2HO*        G  31   2.677  16.856 -22.212
  334    H1*    G  31           H1*        G  31   1.977  15.195 -19.468
  335    H8     G  31           H8         G  31   2.833  11.760 -20.900
  336    H1     G  31           H1         G  31   5.497  13.077 -15.226
  337   1H2     G  31          H21         G  31   5.266  14.832 -14.672
  338   2H2     G  31          H22         G  31   4.514  16.157 -15.385
  339   1H5*    G  32          H5*         G  32   4.626  17.398 -23.171
  340   2H5*    G  32          H5**        G  32   5.777  17.544 -24.511
  341    H4*    G  32           H4*        G  32   6.818  18.481 -22.623
  342    H3*    G  32           H3*        G  32   7.955  15.703 -23.068
  343    H2*    G  32           H2*        G  32   9.557  16.381 -21.426
  344   2HO*    G  32          2HO*        G  32   9.619  18.668 -22.156
  345    H1*    G  32           H1*        G  32   7.594  17.408 -19.731
  346    H8     G  32           H8         G  32   6.421  14.219 -21.389
  347    H1     G  32           H1         G  32  10.385  13.406 -16.422
  348   1H2     G  32          H21         G  32  11.165  14.978 -15.831
  349   2H2     G  32          H22         G  32  11.026  16.581 -16.315
  350   1H5*    U  33          H5*         U  33  11.391  18.159 -25.354
  351   2H5*    U  33          H5**        U  33  12.615  16.923 -25.451
  352    H4*    U  33           H4*        U  33  12.506  18.873 -23.589
  353    H3*    U  33           H3*        U  33  14.038  16.284 -23.639
  354    H2*    U  33           H2*        U  33  14.631  16.710 -21.327
  355   2HO*    U  33          2HO*        U  33  14.451  19.219 -22.083
  356    H1*    U  33           H1*        U  33  12.143  17.567 -20.482
  357    H3     U  33           H3         U  33  13.156  13.359 -18.772
  358    H5     U  33           H5         U  33  10.665  12.814 -22.124
  359    H6     U  33           H6         U  33  11.020  15.108 -22.661
  360   1H5*    C  34          H5*         C  34  17.156  19.351 -22.981
  361   2H5*    C  34          H5**        C  34  18.548  19.008 -24.024
  362    H4*    C  34           H4*        C  34  19.170  18.997 -21.667
  363    H3*    C  34           H3*        C  34  19.422  16.326 -23.064
  364    H2*    C  34           H2*        C  34  20.300  15.474 -20.998
  365   2HO*    C  34          2HO*        C  34  21.128  17.862 -20.550
  366    H1*    C  34           H1*        C  34  18.258  16.492 -19.458
  367   1H4     C  34          H41         C  34  16.585  10.815 -21.514
  368   2H4     C  34          H42         C  34  15.316  11.344 -22.512
  369    H5     C  34           H5         C  34  15.219  14.020 -22.943
  370    H6     C  34           H6         C  34  16.307  16.062 -22.247
  371   1H5*    C  35          H5*         C  35  22.909  15.408 -20.508
  372   2H5*    C  35          H5**        C  35  23.907  16.377 -21.600
  373    H4*    C  35           H4*        C  35  25.161  14.466 -21.337
  374    H3*    C  35           H3*        C  35  23.530  13.998 -23.847
  375    H2*    C  35           H2*        C  35  24.767  11.984 -24.096
  376   2HO*    C  35          2HO*        C  35  26.723  13.045 -22.938
  377    H1*    C  35           H1*        C  35  24.213  11.160 -21.514
  378   1H4     C  35          H42         C  35  19.252   9.338 -25.068
  379   2H4     C  35          H41         C  35  18.399  10.813 -24.633
  380    H5     C  35           H5         C  35  19.432  12.587 -23.381
  381    H6     C  35           H6         C  35  21.474  13.306 -22.289
  382    H3T    C  35           H3T        C  35  24.968  15.660 -23.964