*HEADER    RNA                                     20-MAR-01   1I9K              
*TITLE     THE RNA I-MOTIF                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-R(*UP*CP*CP*CP*CP*C)-3';                                
*COMPND   3 CHAIN: A, B, C, D;                                                   
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    RNA, I-MOTIF, NMR                                                     
*EXPDTA    NMR, MINIMIZED AVERAGE STRUCTURE                                      
*AUTHOR    K.SNOUSSI, S.NONIN-LECOMTE, J.L.LEROU                                 
*REVDAT   1   30-MAY-01 1I9K    0                                                
assign (resid 1 and name H3' and segid A) (resid 2 and name H6 and segid A) 3.7 1.4 0         
assign (resid 1 and name H3 and segid A) (resid 2 and name H1' and segid A) 4.7 1.4 0         
assign (resid 1 and name H3 and segid A) (resid 2 and name H42 and segid A) 4.7 1.5 0         
assign (resid 1 and name H2'' and segid A) (resid 2 and name H5 and segid A) 4.7 1.5 0         
assign (resid 1 and name H2'' and segid A) (resid 2 and name H6 and segid A) 3.7 1.4 0         
assign (resid 1 and name H5 and segid A) (resid 2 and name H5 and segid A) 3.7 1.4 0         
assign (resid 1 and name H5 and segid A) (resid 2 and name H42 and segid A) 4.7 1.5 0         
assign (resid 1 and name H1' and segid B) (resid 2 and name H6 and segid B) 4.7 1.5 0         
assign (resid 1 and name H3 and segid B) (resid 2 and name H42 and segid B) 4.7 1.5 0         
assign (resid 1 and name H2'' and segid B) (resid 2 and name H5 and segid B) 4.7 1.5 0         
assign (resid 1 and name H3 and segid B) (resid 2 and name H1' and segid B) 4.7 1.4 0         
assign (resid 1 and name H5 and segid B) (resid 2 and name H42 and segid B) 4.7 1.5 0         
assign (resid 1 and name H5 and segid B) (resid 2 and name H5 and segid B) 3.7 1.4 0         
assign (resid 1 and name H2'' and segid B) (resid 2 and name H6 and segid B) 3.7 1.4 0         
assign (resid 1 and name H3' and segid B) (resid 2 and name H6 and segid B) 3.7 1.4 0         
assign (resid 1 and name H1' and segid C) (resid 2 and name H6 and segid C) 4.7 1.5 0         
assign (resid 1 and name H3 and segid C) (resid 2 and name H1' and segid C) 4.7 1.4 0         
assign (resid 1 and name H2'' and segid C) (resid 2 and name H6 and segid C) 3.7 1.4 0         
assign (resid 1 and name H2'' and segid C) (resid 2 and name H5 and segid C) 4.7 1.5 0         
assign (resid 1 and name H5 and segid C) (resid 2 and name H42 and segid C) 4.7 1.5 0         
assign (resid 1 and name H5 and segid C) (resid 2 and name H5 and segid C) 3.7 1.4 0         
assign (resid 1 and name H3 and segid C) (resid 2 and name H42 and segid C) 4.7 1.5 0         
assign (resid 1 and name H3' and segid C) (resid 2 and name H6 and segid C) 3.7 1.4 0         
assign (resid 1 and name H1' and segid D) (resid 2 and name H6 and segid D) 4.7 1.5 0         
assign (resid 1 and name H5 and segid D) (resid 2 and name H42 and segid D) 4.7 1.5 0         
assign (resid 1 and name H2'' and segid D) (resid 2 and name H5 and segid D) 4.7 1.5 0         
assign (resid 1 and name H3' and segid D) (resid 2 and name H6 and segid D) 3.7 1.4 0         
assign (resid 1 and name H5 and segid D) (resid 2 and name H5 and segid D) 3.7 1.4 0         
assign (resid 1 and name H3 and segid D) (resid 2 and name H1' and segid D) 4.7 1.4 0         
assign (resid 1 and name H3 and segid D) (resid 2 and name H42 and segid D) 4.7 1.5 0         
assign (resid 1 and name H2'' and segid D) (resid 2 and name H6 and segid D) 3.7 1.4 0         
assign (resid 2 and name H3' and segid A) (resid 6 and name H41 and segid B) 3.7 1.9 0         
assign (resid 2 and name H41 and segid A) (resid 6 and name H3' and segid B) 4.7 1.5 0         
assign (resid 2 and name H2'' and segid A) (resid 6 and name H42 and segid B) 3.7 1.9 0         
assign (resid 2 and name H1' and segid A) (resid 6 and name H1' and segid D) 4.2 1.5 0         
assign (resid 2 and name H6 and segid A) (resid 6 and name H41 and segid B) 4.7 1.5 0         
assign (resid 2 and name H6 and segid A) (resid 6 and name H41 and segid B) 4.7 1.5 0         
assign (resid 2 and name H6 and segid B) (resid 6 and name H41 and segid A) 4.7 1.5 0         
assign (resid 2 and name H1' and segid B) (resid 6 and name H1' and segid C) 4.2 1.5 0         
assign (resid 2 and name H3' and segid B) (resid 6 and name H41 and segid A) 3.7 1.9 0         
assign (resid 2 and name H41 and segid B) (resid 6 and name H3' and segid A) 4.7 1.5 0         
assign (resid 2 and name H6 and segid B) (resid 6 and name H41 and segid A) 4.7 1.5 0         
assign (resid 2 and name H2'' and segid B) (resid 6 and name H42 and segid A) 3.7 1.9 0         
assign (resid 2 and name H41 and segid C) (resid 6 and name H3' and segid D) 4.7 1.5 0         
assign (resid 2 and name H1' and segid C) (resid 6 and name H1' and segid B) 4.2 1.5 0         
assign (resid 2 and name H2'' and segid C) (resid 6 and name H42 and segid D) 3.7 1.9 0         
assign (resid 2 and name H3' and segid C) (resid 6 and name H41 and segid D) 3.7 1.9 0         
assign (resid 2 and name H6 and segid C) (resid 6 and name H41 and segid D) 4.7 1.5 0         
assign (resid 2 and name H6 and segid C) (resid 6 and name H41 and segid D) 4.7 1.5 0         
assign (resid 2 and name H6 and segid D) (resid 6 and name H41 and segid C) 4.7 1.5 0         
assign (resid 2 and name H6 and segid D) (resid 6 and name H41 and segid C) 4.7 1.5 0         
assign (resid 2 and name H41 and segid D) (resid 6 and name H3' and segid C) 4.7 1.5 0         
assign (resid 2 and name H2'' and segid D) (resid 6 and name H42 and segid C) 3.7 1.9 0         
assign (resid 2 and name H1' and segid D) (resid 6 and name H1' and segid A) 4.2 1.5 0         
assign (resid 2 and name H3' and segid D) (resid 6 and name H41 and segid C) 3.7 1.9 0         
assign (resid 3 and name H6 and segid A) (resid 5 and name H41 and segid B) 4.7 1.5 0         
assign (resid 3 and name H2' and segid A) (resid 5 and name H2' and segid D) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid A) (resid 5 and name H42 and segid B) 3.7 1.9 0         
assign (resid 3 and name H6 and segid A) (resid 5 and name H42 and segid B) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid A) (resid 5 and name H1' and segid D) 3.7 1.4 0         
assign (resid 3 and name H2' and segid A) (resid 5 and name H1' and segid D) 4.7 1.5 0         
assign (resid 3 and name H6 and segid A) (resid 5 and name H41 and segid B) 3.7 1.4 0         
assign (resid 3 and name H3' and segid A) (resid 5 and name H41 and segid B) 4.7 1.5 0         
assign (resid 3 and name H1' and segid A) (resid 5 and name H1' and segid D) 4.2 1.5 0         
assign (resid 3 and name H2' and segid A) (resid 5 and name H2'' and segid D) 3.7 1.4 0         
assign (resid 3 and name H42 and segid A) (resid 5 and name H2'' and segid B) 3.7 1.9 0         
assign (resid 3 and name H6 and segid A) (resid 5 and name H41 and segid B) 4.7 1.5 0         
assign (resid 3 and name H42 and segid A) (resid 5 and name H6 and segid B) 3.7 1.4 0.5         
assign (resid 3 and name H41 and segid A) (resid 5 and name H6 and segid B) 3.7 1.4 0.5         
assign (resid 3 and name H2'' and segid A) (resid 5 and name H1' and segid D) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid A) (resid 5 and name H2' and segid D) 4.7 1.5 0         
assign (resid 3 and name H1' and segid A) (resid 5 and name H2' and segid D) 3.7 1.4 0         
assign (resid 3 and name H42 and segid B) (resid 5 and name H2'' and segid A) 3.7 1.9 0         
assign (resid 3 and name H6 and segid B) (resid 5 and name H42 and segid A) 4.7 1.5 0         
assign (resid 3 and name H1' and segid B) (resid 5 and name H1' and segid C) 4.2 1.5 0         
assign (resid 3 and name H3' and segid B) (resid 5 and name H41 and segid A) 4.7 1.5 0         
assign (resid 3 and name H2' and segid B) (resid 5 and name H2'' and segid C) 3.7 1.4 0         
assign (resid 3 and name H42 and segid B) (resid 5 and name H6 and segid A) 3.7 1.4 0.5         
assign (resid 3 and name H2' and segid B) (resid 5 and name H2' and segid C) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid B) (resid 5 and name H1' and segid C) 3.7 1.4 0         
assign (resid 3 and name H6 and segid B) (resid 5 and name H41 and segid A) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid B) (resid 5 and name H2' and segid C) 4.7 1.5 0         
assign (resid 3 and name H2' and segid B) (resid 5 and name H1' and segid C) 4.7 1.5 0         
assign (resid 3 and name H6 and segid B) (resid 5 and name H41 and segid A) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid B) (resid 5 and name H42 and segid A) 3.7 1.9 0         
assign (resid 3 and name H1' and segid B) (resid 5 and name H2' and segid C) 3.7 1.4 0         
assign (resid 3 and name H6 and segid B) (resid 5 and name H41 and segid A) 4.7 1.5 0         
assign (resid 3 and name H41 and segid B) (resid 5 and name H6 and segid A) 3.7 1.4 0.5         
assign (resid 3 and name H2'' and segid B) (resid 5 and name H1' and segid C) 3.7 1.4 0         
assign (resid 3 and name H42 and segid C) (resid 5 and name H6 and segid D) 3.7 1.4 0.5         
assign (resid 3 and name H2'' and segid C) (resid 5 and name H42 and segid D) 3.7 1.9 0         
assign (resid 3 and name H2' and segid C) (resid 5 and name H2' and segid B) 3.7 1.4 0         
assign (resid 3 and name H6 and segid C) (resid 5 and name H41 and segid D) 3.7 1.4 0         
assign (resid 3 and name H6 and segid C) (resid 5 and name H41 and segid D) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid C) (resid 5 and name H1' and segid B) 3.7 1.4 0         
assign (resid 3 and name H42 and segid C) (resid 5 and name H2'' and segid D) 3.7 1.9 0         
assign (resid 3 and name H2'' and segid C) (resid 5 and name H1' and segid B) 3.7 1.4 0         
assign (resid 3 and name H2' and segid C) (resid 5 and name H2'' and segid B) 3.7 1.4 0         
assign (resid 3 and name H6 and segid C) (resid 5 and name H42 and segid D) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid C) (resid 5 and name H2' and segid B) 4.7 1.5 0         
assign (resid 3 and name H41 and segid C) (resid 5 and name H6 and segid D) 3.7 1.4 0.5         
assign (resid 3 and name H1' and segid C) (resid 5 and name H1' and segid B) 4.2 1.5 0         
assign (resid 3 and name H2' and segid C) (resid 5 and name H1' and segid B) 4.7 1.5 0         
assign (resid 3 and name H3' and segid C) (resid 5 and name H41 and segid D) 4.7 1.5 0         
assign (resid 3 and name H1' and segid C) (resid 5 and name H2' and segid B) 3.7 1.4 0         
assign (resid 3 and name H6 and segid C) (resid 5 and name H41 and segid D) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid D) (resid 5 and name H42 and segid C) 3.7 1.9 0         
assign (resid 3 and name H42 and segid D) (resid 5 and name H2'' and segid C) 3.7 1.9 0         
assign (resid 3 and name H6 and segid D) (resid 5 and name H41 and segid C) 3.7 1.4 0         
assign (resid 3 and name H3' and segid D) (resid 5 and name H41 and segid C) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid D) (resid 5 and name H2' and segid A) 4.7 1.5 0         
assign (resid 3 and name H1' and segid D) (resid 5 and name H1' and segid A) 4.2 1.5 0         
assign (resid 3 and name H2'' and segid D) (resid 5 and name H1' and segid A) 3.7 1.4 0         
assign (resid 3 and name H2' and segid D) (resid 5 and name H2'' and segid A) 3.7 1.4 0         
assign (resid 3 and name H2' and segid D) (resid 5 and name H1' and segid A) 4.7 1.5 0         
assign (resid 3 and name H6 and segid D) (resid 5 and name H41 and segid C) 4.7 1.5 0         
assign (resid 3 and name H42 and segid D) (resid 5 and name H6 and segid C) 3.7 1.4 0.5         
assign (resid 3 and name H6 and segid D) (resid 5 and name H41 and segid C) 4.7 1.5 0         
assign (resid 3 and name H1' and segid D) (resid 5 and name H2' and segid A) 3.7 1.4 0         
assign (resid 3 and name H41 and segid D) (resid 5 and name H6 and segid C) 3.7 1.4 0.5         
assign (resid 3 and name H2' and segid D) (resid 5 and name H2' and segid A) 3.7 1.4 0         
assign (resid 3 and name H6 and segid D) (resid 5 and name H42 and segid C) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid D) (resid 5 and name H1' and segid A) 3.7 1.4 0         
assign (resid 3 and name H1' and segid A) (resid 6 and name H6 and segid D) 4.7 1.4 0         
assign (resid 3 and name H2'' and segid A) (resid 6 and name H1' and segid D) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid A) (resid 6 and name H1' and segid D) 4.7 1.5 0         
assign (resid 3 and name H1' and segid B) (resid 6 and name H6 and segid C) 4.7 1.4 0         
assign (resid 3 and name H2'' and segid B) (resid 6 and name H1' and segid C) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid B) (resid 6 and name H1' and segid C) 4.7 1.5 0         
assign (resid 3 and name H1' and segid B) (resid 6 and name H1' and segid C) 2.7 0.9 0         
assign (resid 3 and name H2'' and segid C) (resid 6 and name H1' and segid B) 4.7 1.5 0         
assign (resid 3 and name H1' and segid C) (resid 6 and name H1' and segid B) 2.7 0.9 0         
assign (resid 3 and name H1' and segid C) (resid 6 and name H6 and segid B) 4.7 1.4 0         
assign (resid 3 and name H2'' and segid C) (resid 6 and name H1' and segid B) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid D) (resid 6 and name H1' and segid A) 4.7 1.5 0         
assign (resid 3 and name H2'' and segid D) (resid 6 and name H1' and segid A) 4.7 1.5 0         
assign (resid 3 and name H1' and segid D) (resid 6 and name H1' and segid A) 2.7 0.9 0         
assign (resid 3 and name H1' and segid D) (resid 6 and name H6 and segid A) 4.7 1.4 0         
assign (resid 4 and name H1' and segid A) (resid 5 and name H1' and segid D) 2.7 0.9 0         
assign (resid 4 and name N3 and segid A) (resid 5 and name N3 and segid D) 4.7 2 0.5         
assign (resid 4 and name H5 and segid A) (resid 5 and name H41 and segid B) 4.7 1.5 0         
assign (resid 4 and name H1' and segid A) (resid 5 and name H6 and segid D) 4.7 1.5 0         
assign (resid 4 and name H2'' and segid A) (resid 5 and name H1' and segid D) 4.7 1.5 0         
assign (resid 4 and name H4' and segid A) (resid 5 and name H1' and segid D) 4.7 1.5 0         
assign (resid 4 and name N3 and segid A) (resid 5 and name N3 and segid B) 4.7 2 0.5         
assign (resid 4 and name H41 and segid A) (resid 5 and name H6 and segid B) 3.7 1.4 0         
assign (resid 4 and name H41 and segid B) (resid 5 and name H6 and segid A) 3.7 1.4 0         
assign (resid 4 and name H5 and segid B) (resid 5 and name H41 and segid A) 4.7 1.5 0         
assign (resid 4 and name H1' and segid B) (resid 5 and name H6 and segid C) 4.7 1.5 0         
assign (resid 4 and name H1' and segid B) (resid 5 and name H1' and segid C) 2.7 0.9 0         
assign (resid 4 and name H2'' and segid B) (resid 5 and name H1' and segid C) 4.7 1.5 0         
assign (resid 4 and name N3 and segid B) (resid 5 and name N3 and segid C) 4.7 2 0.5         
assign (resid 4 and name H4' and segid B) (resid 5 and name H1' and segid C) 4.7 1.5 0         
assign (resid 4 and name N3 and segid B) (resid 5 and name N3 and segid A) 4.7 2 0.5         
assign (resid 4 and name N3 and segid C) (resid 5 and name N3 and segid B) 4.7 2 0.5         
assign (resid 4 and name H4' and segid C) (resid 5 and name H1' and segid B) 4.7 1.5 0         
assign (resid 4 and name N3 and segid C) (resid 5 and name N3 and segid D) 4.7 2 0.5         
assign (resid 4 and name H1' and segid C) (resid 5 and name H1' and segid B) 2.7 0.9 0         
assign (resid 4 and name H41 and segid C) (resid 5 and name H6 and segid D) 3.7 1.4 0         
assign (resid 4 and name H5 and segid C) (resid 5 and name H41 and segid D) 4.7 1.5 0         
assign (resid 4 and name H1' and segid C) (resid 5 and name H6 and segid B) 4.7 1.5 0         
assign (resid 4 and name H4' and segid D) (resid 5 and name H1' and segid A) 4.7 1.5 0         
assign (resid 4 and name H1' and segid D) (resid 5 and name H6 and segid A) 4.7 1.5 0         
assign (resid 4 and name H2'' and segid D) (resid 5 and name H1' and segid A) 4.7 1.5 0         
assign (resid 4 and name H1' and segid D) (resid 5 and name H1' and segid A) 2.7 0.9 0         
assign (resid 4 and name N3 and segid D) (resid 5 and name N3 and segid C) 4.7 2 0.5         
assign (resid 4 and name H5 and segid D) (resid 5 and name H41 and segid C) 4.7 1.5 0         
assign (resid 4 and name N3 and segid D) (resid 5 and name N3 and segid A) 4.7 2 0.5         
assign (resid 4 and name H41 and segid D) (resid 5 and name H6 and segid C) 3.7 1.4 0         
! INTRA-residue distance restraint                            
assign (resid 1 and name H1' and segid D) (resid 1 and name H2'' and segid D) 2.67 0.05 0.05         
assign (resid 1 and name H1' and segid C) (resid 1 and name H2'' and segid C) 2.67 0.05 0.05         
assign (resid 1 and name H1' and segid A) (resid 1 and name H2'' and segid A) 2.7 0.1 0.15         
assign (resid 1 and name H1' and segid A) (resid 1 and name H2'' and segid A) 2.7 0.1 0.15         
assign (resid 1 and name H1' and segid A) (resid 1 and name H2'' and segid A) 2.7 0.1 0.15         
assign (resid 1 and name H1' and segid A) (resid 1 and name H2'' and segid A) 2.7 0.1 0.15         
assign (resid 1 and name H1' and segid A) (resid 1 and name H2'' and segid A) 2.67 0.05 0.05         
assign (resid 1 and name H1' and segid B) (resid 1 and name H2'' and segid B) 2.67 0.05 0.05         
assign (resid 1 and name H1' and segid B) (resid 1 and name H3' and segid B) 3.8 0.3 0.3         
assign (resid 1 and name H1' and segid C) (resid 1 and name H3' and segid C) 3.8 0.3 0.3         
assign (resid 1 and name H1' and segid A) (resid 1 and name H3' and segid A) 3.8 0.3 0.3         
assign (resid 1 and name H1' and segid D) (resid 1 and name H3' and segid D) 3.8 0.3 0.3         
assign (resid 1 and name H6 and segid B) (resid 1 and name H1' and segid B) 3.4 0.1 0.1         
assign (resid 1 and name H6 and segid D) (resid 1 and name H1' and segid D) 3.4 0.1 0.1         
assign (resid 1 and name H6 and segid C) (resid 1 and name H1' and segid C) 3.4 0.1 0.1         
assign (resid 1 and name H6 and segid A) (resid 1 and name H1' and segid A) 3.4 0.1 0.1         
assign (resid 1 and name H6 and segid D) (resid 1 and name H2'' and segid D) 3.6 0.1 0.1         
assign (resid 1 and name H6 and segid B) (resid 1 and name H2'' and segid B) 3.6 0.1 0.1         
assign (resid 1 and name H6 and segid A) (resid 1 and name H2'' and segid A) 3.6 0.1 0.1         
assign (resid 1 and name H6 and segid C) (resid 1 and name H2'' and segid C) 3.6 0.1 0.1         
assign (resid 1 and name H6 and segid D) (resid 1 and name H3' and segid D) 3 0.1 0.3         
assign (resid 1 and name H6 and segid B) (resid 1 and name H3' and segid B) 3 0.1 0.3         
assign (resid 1 and name H6 and segid C) (resid 1 and name H3' and segid C) 3 0.1 0.3         
assign (resid 1 and name H6 and segid A) (resid 1 and name H3' and segid A) 3 0.1 0.3         
assign (resid 1 and name H6 and segid B) (resid 1 and name H5' and segid B) 2.6 0 50         
assign (resid 1 and name H6 and segid A) (resid 1 and name H5' and segid A) 2.6 0 50         
assign (resid 1 and name H6 and segid D) (resid 1 and name H5' and segid D) 2.6 0 50         
assign (resid 1 and name H6 and segid D) (resid 1 and name H5' and segid D) 2.6 0 50         
assign (resid 1 and name H6 and segid A) (resid 1 and name H5' and segid A) 2.6 0 50         
assign (resid 1 and name H6 and segid B) (resid 1 and name H5' and segid B) 2.6 0 50         
assign (resid 1 and name H6 and segid C) (resid 1 and name H5' and segid C) 2.6 0 50         
assign (resid 1 and name H6 and segid C) (resid 1 and name H5' and segid C) 2.6 0 50         
assign (resid 1 and name H6 and segid B) (resid 1 and name H5'' and segid B) 2.6 0 50         
assign (resid 1 and name H6 and segid B) (resid 1 and name H5'' and segid B) 2.6 0 50         
assign (resid 1 and name H6 and segid A) (resid 1 and name H5'' and segid A) 2.6 0 50         
assign (resid 1 and name H6 and segid A) (resid 1 and name H5'' and segid A) 2.6 0 50         
assign (resid 1 and name H6 and segid C) (resid 1 and name H5'' and segid C) 2.6 0 50         
assign (resid 1 and name H6 and segid C) (resid 1 and name H5'' and segid C) 2.6 0 50         
assign (resid 1 and name H6 and segid D) (resid 1 and name H5'' and segid D) 2.6 0 50         
assign (resid 1 and name H6 and segid D) (resid 1 and name H5'' and segid D) 2.6 0 50         
assign (resid 2 and name H1' and segid A) (resid 2 and name H2'' and segid A) 2.7 0.05 0.05         
assign (resid 2 and name H1' and segid C) (resid 2 and name H2'' and segid C) 2.7 0.05 0.05         
assign (resid 2 and name H1' and segid B) (resid 2 and name H2'' and segid B) 2.7 0.05 0.05         
assign (resid 2 and name H1' and segid D) (resid 2 and name H2'' and segid D) 2.7 0.05 0.05         
assign (resid 2 and name H1' and segid D) (resid 2 and name H3' and segid D) 3.8 0.1 0.1         
assign (resid 2 and name H1' and segid A) (resid 2 and name H3' and segid A) 3.8 0.1 0.1         
assign (resid 2 and name H1' and segid C) (resid 2 and name H3' and segid C) 3.8 0.1 0.1         
assign (resid 2 and name H1' and segid B) (resid 2 and name H3' and segid B) 3.8 0.1 0.1         
assign (resid 2 and name H3' and segid D) (resid 2 and name H2'' and segid D) 2.6 0.3 0.1         
assign (resid 2 and name H3' and segid C) (resid 2 and name H2'' and segid C) 2.6 0.3 0.1         
assign (resid 2 and name H3' and segid B) (resid 2 and name H2'' and segid B) 2.6 0.3 0.1         
assign (resid 2 and name H3' and segid A) (resid 2 and name H2'' and segid A) 2.6 0.3 0.1         
assign (resid 2 and name H41 and segid C) (resid 2 and name H6 and segid C) 4.7 0 50         
assign (resid 2 and name H41 and segid B) (resid 2 and name H6 and segid B) 4.7 0 50         
assign (resid 2 and name H41 and segid A) (resid 2 and name H6 and segid A) 4.7 0 50         
assign (resid 2 and name H41 and segid D) (resid 2 and name H6 and segid D) 4.7 0 50         
assign (resid 2 and name H6 and segid B) (resid 2 and name H1' and segid B) 3.6 0.3 0.1         
assign (resid 2 and name H6 and segid C) (resid 2 and name H1' and segid C) 3.6 0.3 0.1         
assign (resid 2 and name H6 and segid A) (resid 2 and name H1' and segid A) 3.6 0.3 0.1         
assign (resid 2 and name H6 and segid D) (resid 2 and name H1' and segid D) 3.6 0.3 0.1         
assign (resid 2 and name H6 and segid B) (resid 2 and name H2'' and segid B) 4 0.4 0.2         
assign (resid 2 and name H6 and segid D) (resid 2 and name H2'' and segid D) 4 0.4 0.2         
assign (resid 2 and name H6 and segid C) (resid 2 and name H2'' and segid C) 4 0.4 0.2         
assign (resid 2 and name H6 and segid A) (resid 2 and name H2'' and segid A) 4 0.4 0.3         
assign (resid 2 and name H6 and segid A) (resid 2 and name H3' and segid A) 2.6 0.1 0.1         
assign (resid 2 and name H6 and segid C) (resid 2 and name H3' and segid C) 2.6 0.1 0.1         
assign (resid 2 and name H6 and segid D) (resid 2 and name H3' and segid D) 2.6 0.1 0.1         
assign (resid 2 and name H6 and segid B) (resid 2 and name H3' and segid B) 2.6 0.1 0.1         
assign (resid 2 and name H6 and segid D) (resid 2 and name H5' and segid D) 2.6 0 50         
assign (resid 2 and name H6 and segid C) (resid 2 and name H5' and segid C) 2.6 0 50         
assign (resid 2 and name H6 and segid D) (resid 2 and name H5' and segid D) 2.6 0 50         
assign (resid 2 and name H6 and segid A) (resid 2 and name H5' and segid A) 2.6 0 50         
assign (resid 2 and name H6 and segid B) (resid 2 and name H5' and segid B) 2.6 0 50         
assign (resid 2 and name H6 and segid C) (resid 2 and name H5' and segid C) 2.6 0 50         
assign (resid 2 and name H6 and segid A) (resid 2 and name H5' and segid A) 2.6 0 50         
assign (resid 2 and name H6 and segid B) (resid 2 and name H5' and segid B) 2.6 0 50         
assign (resid 3 and name H1' and segid A) (resid 3 and name H2'' and segid A) 2.78 0.05 0.05         
assign (resid 3 and name H1' and segid C) (resid 3 and name H2'' and segid C) 2.78 0.05 0.05         
assign (resid 3 and name H1' and segid B) (resid 3 and name H2'' and segid B) 2.78 0.05 0.05         
assign (resid 3 and name H1' and segid D) (resid 3 and name H2'' and segid D) 2.78 0.05 0.05         
assign (resid 3 and name H1' and segid B) (resid 3 and name H3' and segid B) 4.1 0.1 0.1         
assign (resid 3 and name H1' and segid A) (resid 3 and name H3' and segid A) 4.1 0.1 0.1         
assign (resid 3 and name H1' and segid C) (resid 3 and name H3' and segid C) 4.1 0.1 0.1         
assign (resid 3 and name H1' and segid D) (resid 3 and name H3' and segid D) 4.1 0.1 0.1         
assign (resid 3 and name H2' and segid D) (resid 3 and name H1' and segid D) 3.7 1.9 0         
assign (resid 3 and name H2' and segid B) (resid 3 and name H1' and segid B) 3.7 1.9 0         
assign (resid 3 and name H2' and segid C) (resid 3 and name H1' and segid C) 3.7 1.9 0         
assign (resid 3 and name H2' and segid A) (resid 3 and name H1' and segid A) 3.7 1.9 0         
assign (resid 3 and name H2' and segid C) (resid 3 and name H2'' and segid C) 3.7 1.4 0         
assign (resid 3 and name H2' and segid D) (resid 3 and name H2'' and segid D) 3.7 1.4 0         
assign (resid 3 and name H2' and segid A) (resid 3 and name H2'' and segid A) 3.7 1.4 0         
assign (resid 3 and name H2' and segid B) (resid 3 and name H2'' and segid B) 3.7 1.4 0         
assign (resid 3 and name H2' and segid B) (resid 3 and name H3' and segid B) 4.7 1 50         
assign (resid 3 and name H2' and segid A) (resid 3 and name H3' and segid A) 4.7 1 50         
assign (resid 3 and name H2' and segid D) (resid 3 and name H3' and segid D) 4.7 1 50         
assign (resid 3 and name H2' and segid C) (resid 3 and name H3' and segid C) 4.7 1 50         
assign (resid 3 and name H2' and segid A) (resid 3 and name H4' and segid A) 3.7 1.4 0         
assign (resid 3 and name H2' and segid C) (resid 3 and name H4' and segid C) 3.7 1.4 0         
assign (resid 3 and name H2' and segid D) (resid 3 and name H4' and segid D) 3.7 1.4 0         
assign (resid 3 and name H2' and segid B) (resid 3 and name H4' and segid B) 3.7 1.4 0         
assign (resid 3 and name H2' and segid A) (resid 3 and name H6 and segid A) 4.7 1.5 50         
assign (resid 3 and name H2' and segid C) (resid 3 and name H6 and segid C) 4.7 1.5 50         
assign (resid 3 and name H2' and segid B) (resid 3 and name H6 and segid B) 4.7 1.5 50         
assign (resid 3 and name H2' and segid D) (resid 3 and name H6 and segid D) 4.7 1.5 50         
assign (resid 3 and name H2'' and segid D) (resid 3 and name H2' and segid D) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid A) (resid 3 and name H2' and segid A) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid C) (resid 3 and name H2' and segid C) 3.7 1.4 0         
assign (resid 3 and name H2'' and segid B) (resid 3 and name H2' and segid B) 3.7 1.4 0         
assign (resid 3 and name H3' and segid D) (resid 3 and name H2'' and segid D) 2.5 0.2 0.1         
assign (resid 3 and name H3' and segid C) (resid 3 and name H2'' and segid C) 2.5 0.2 0.1         
assign (resid 3 and name H3' and segid A) (resid 3 and name H2'' and segid A) 2.5 0.2 0.1         
assign (resid 3 and name H3' and segid B) (resid 3 and name H2'' and segid B) 2.5 0.2 0.1         
assign (resid 3 and name H6 and segid C) (resid 3 and name H1' and segid C) 3.7 0.1 0.1         
assign (resid 3 and name H6 and segid B) (resid 3 and name H1' and segid B) 3.7 0.1 0.1         
assign (resid 3 and name H6 and segid D) (resid 3 and name H1' and segid D) 3.7 0.1 0.1         
assign (resid 3 and name H6 and segid A) (resid 3 and name H1' and segid A) 3.7 0.1 0.1         
assign (resid 3 and name H6 and segid C) (resid 3 and name H2'' and segid C) 3.2 0.3 0.2         
assign (resid 3 and name H6 and segid A) (resid 3 and name H2'' and segid A) 3.2 0.3 0.2         
assign (resid 3 and name H6 and segid D) (resid 3 and name H2'' and segid D) 3.2 0.3 0.2         
assign (resid 3 and name H6 and segid B) (resid 3 and name H2'' and segid B) 3.2 0.3 0.2         
assign (resid 3 and name H6 and segid A) (resid 3 and name H3' and segid A) 2.4 0.1 0.1         
assign (resid 3 and name H6 and segid C) (resid 3 and name H3' and segid C) 2.4 0.1 0.1         
assign (resid 3 and name H6 and segid D) (resid 3 and name H3' and segid D) 2.4 0.1 0.1         
assign (resid 3 and name H6 and segid B) (resid 3 and name H3' and segid B) 2.4 0.1 0.1         
assign (resid 3 and name H6 and segid B) (resid 3 and name H41 and segid B) 4.7 0 50         
assign (resid 3 and name H6 and segid D) (resid 3 and name H41 and segid D) 4.7 0 50         
assign (resid 3 and name H6 and segid C) (resid 3 and name H41 and segid C) 4.7 0 50         
assign (resid 3 and name H6 and segid A) (resid 3 and name H41 and segid A) 4.7 0 50         
assign (resid 3 and name N3 and segid A) (resid 3 and name H3' and segid A) 4.7 0.5 50         
assign (resid 4 and name H1' and segid A) (resid 4 and name H2'' and segid A) 2.78 0.05 0.05         
assign (resid 4 and name H1' and segid D) (resid 4 and name H2'' and segid D) 2.78 0.05 0.05         
assign (resid 4 and name H1' and segid C) (resid 4 and name H2'' and segid C) 2.78 0.05 0.05         
assign (resid 4 and name H1' and segid B) (resid 4 and name H2'' and segid B) 2.78 0.05 0.05         
assign (resid 4 and name H1' and segid B) (resid 4 and name H3' and segid B) 4 0.1 0.1         
assign (resid 4 and name H1' and segid D) (resid 4 and name H3' and segid D) 4 0.1 0.1         
assign (resid 4 and name H1' and segid C) (resid 4 and name H3' and segid C) 4 0.1 0.1         
assign (resid 4 and name H1' and segid A) (resid 4 and name H3' and segid A) 4 0.1 0.1         
assign (resid 4 and name H2' and segid B) (resid 4 and name H2' and segid C) 1.8 0 50         
assign (resid 4 and name H2' and segid A) (resid 4 and name H2' and segid D) 1.8 0 50         
assign (resid 4 and name H2' and segid A) (resid 4 and name H2' and segid D) 1.8 0 50         
assign (resid 4 and name H2' and segid B) (resid 4 and name H2' and segid C) 1.8 0 50         
assign (resid 4 and name H3' and segid A) (resid 4 and name H2'' and segid A) 2.6 0.2 0.1         
assign (resid 4 and name H3' and segid B) (resid 4 and name H2'' and segid B) 2.6 0.2 0.1         
assign (resid 4 and name H3' and segid C) (resid 4 and name H2'' and segid C) 2.6 0.2 0.1         
assign (resid 4 and name H3' and segid D) (resid 4 and name H2'' and segid D) 2.6 0.2 0.1         
assign (resid 4 and name H41 and segid D) (resid 4 and name H2'' and segid C) 3.7 1.9 0         
assign (resid 4 and name H41 and segid A) (resid 4 and name H2'' and segid B) 3.7 1.9 0         
assign (resid 4 and name H41 and segid B) (resid 4 and name H2'' and segid A) 3.7 1.9 0         
assign (resid 4 and name H41 and segid C) (resid 4 and name H2'' and segid D) 3.7 1.9 0         
assign (resid 4 and name H41 and segid B) (resid 4 and name H3' and segid A) 4.7 1.5 0         
assign (resid 4 and name H41 and segid A) (resid 4 and name H3' and segid B) 4.7 1.5 0         
assign (resid 4 and name H41 and segid D) (resid 4 and name H3' and segid C) 4.7 1.5 0         
assign (resid 4 and name H41 and segid C) (resid 4 and name H3' and segid D) 4.7 1.5 0         
assign (resid 4 and name H42 and segid C) (resid 4 and name H2'' and segid D) 3.7 1.9 0         
assign (resid 4 and name H42 and segid A) (resid 4 and name H2'' and segid B) 3.7 1.9 0         
assign (resid 4 and name H42 and segid D) (resid 4 and name H2'' and segid C) 3.7 1.9 0         
assign (resid 4 and name H42 and segid B) (resid 4 and name H2'' and segid A) 3.7 1.9 0         
assign (resid 4 and name H42 and segid A) (resid 4 and name H3' and segid B) 4.7 0.5 50         
assign (resid 4 and name H42 and segid D) (resid 4 and name H3' and segid C) 4.7 0.5 50         
assign (resid 4 and name H42 and segid B) (resid 4 and name H3' and segid A) 4.7 0.5 50         
assign (resid 4 and name H42 and segid C) (resid 4 and name H3' and segid D) 4.7 0.5 50         
assign (resid 4 and name H6 and segid D) (resid 4 and name H1' and segid D) 3.7 0.1 0.1         
assign (resid 4 and name H6 and segid B) (resid 4 and name H1' and segid B) 3.7 0.1 0.1         
assign (resid 4 and name H6 and segid C) (resid 4 and name H1' and segid C) 3.7 0.1 0.1         
assign (resid 4 and name H6 and segid A) (resid 4 and name H1' and segid A) 3.7 0.1 0.1         
assign (resid 4 and name H6 and segid D) (resid 4 and name H2'' and segid D) 2.8 0.2 0.2         
assign (resid 4 and name H6 and segid A) (resid 4 and name H2'' and segid A) 2.8 0.2 0.2         
assign (resid 4 and name H6 and segid C) (resid 4 and name H2'' and segid C) 2.8 0.2 0.2         
assign (resid 4 and name H6 and segid B) (resid 4 and name H2'' and segid B) 2.8 0.2 0.2         
assign (resid 4 and name H6 and segid B) (resid 4 and name H3' and segid B) 2.4 0.1 0.1         
assign (resid 4 and name H6 and segid C) (resid 4 and name H3' and segid C) 2.4 0.1 0.1         
assign (resid 4 and name H6 and segid D) (resid 4 and name H3' and segid D) 2.4 0.1 0.1         
assign (resid 4 and name H6 and segid A) (resid 4 and name H3' and segid A) 2.4 0.1 0.1         
assign (resid 4 and name N3 and segid A) (resid 4 and name H3' and segid B) 4.7 0.5 50         
assign (resid 4 and name N3 and segid A) (resid 4 and name H3' and segid A) 4.7 0.5 50         
assign (resid 5 and name H1' and segid D) (resid 5 and name H2'' and segid D) 2.6 0.05 0.05         
assign (resid 5 and name H1' and segid A) (resid 5 and name H2'' and segid A) 2.6 0.05 0.05         
assign (resid 5 and name H1' and segid C) (resid 5 and name H2'' and segid C) 2.6 0.05 0.05         
assign (resid 5 and name H1' and segid B) (resid 5 and name H2'' and segid B) 2.6 0.05 0.05         
assign (resid 5 and name H1' and segid A) (resid 5 and name H3' and segid A) 3.7 0.1 0.2         
assign (resid 5 and name H1' and segid B) (resid 5 and name H3' and segid B) 3.7 0.1 0.2         
assign (resid 5 and name H1' and segid C) (resid 5 and name H3' and segid C) 3.7 0.1 0.2         
assign (resid 5 and name H1' and segid D) (resid 5 and name H3' and segid D) 3.7 0.1 0.2         
assign (resid 5 and name H2' and segid B) (resid 5 and name H1' and segid B) 3.7 1.4 0         
assign (resid 5 and name H2' and segid C) (resid 5 and name H1' and segid C) 3.7 1.4 0         
assign (resid 5 and name H2' and segid D) (resid 5 and name H1' and segid D) 3.7 1.4 0         
assign (resid 5 and name H2' and segid A) (resid 5 and name H1' and segid A) 3.7 1.4 0         
assign (resid 5 and name H2' and segid B) (resid 5 and name H2'' and segid B) 3.7 1.4 0         
assign (resid 5 and name H2' and segid C) (resid 5 and name H2'' and segid C) 3.7 1.4 0         
assign (resid 5 and name H2' and segid D) (resid 5 and name H2'' and segid D) 3.7 1.4 0         
assign (resid 5 and name H2' and segid A) (resid 5 and name H2'' and segid A) 3.7 1.4 0         
assign (resid 5 and name H2' and segid B) (resid 5 and name H5 and segid B) 4.7 0.5 50         
assign (resid 5 and name H2' and segid A) (resid 5 and name H5 and segid A) 4.7 0.5 50         
assign (resid 5 and name H2' and segid D) (resid 5 and name H5 and segid D) 4.7 0.5 50         
assign (resid 5 and name H2' and segid C) (resid 5 and name H5 and segid C) 4.7 0.5 50         
assign (resid 5 and name H2' and segid C) (resid 5 and name H6 and segid C) 4.7 1.5 50         
assign (resid 5 and name H2' and segid D) (resid 5 and name H6 and segid D) 4.7 0.5 50         
assign (resid 5 and name H2' and segid D) (resid 5 and name H6 and segid D) 4.7 1.5 50         
assign (resid 5 and name H2' and segid C) (resid 5 and name H6 and segid C) 4.7 0.5 50         
assign (resid 5 and name H2' and segid A) (resid 5 and name H6 and segid A) 4.7 0.5 50         
assign (resid 5 and name H2' and segid B) (resid 5 and name H6 and segid B) 4.7 0.5 50         
assign (resid 5 and name H2' and segid A) (resid 5 and name H6 and segid A) 4.7 1.5 50         
assign (resid 5 and name H2' and segid B) (resid 5 and name H6 and segid B) 4.7 1.5 50         
assign (resid 5 and name H6 and segid C) (resid 5 and name H1' and segid C) 3.7 0.1 0.1         
assign (resid 5 and name H6 and segid D) (resid 5 and name H1' and segid D) 3.7 0.1 0.1         
assign (resid 5 and name H6 and segid B) (resid 5 and name H1' and segid B) 3.7 0.1 0.1         
assign (resid 5 and name H6 and segid A) (resid 5 and name H1' and segid A) 3.7 0.1 0.1         
assign (resid 5 and name H6 and segid C) (resid 5 and name H2'' and segid C) 3.4 0.3 0.2         
assign (resid 5 and name H6 and segid A) (resid 5 and name H2'' and segid A) 3.4 0.3 0.2         
assign (resid 5 and name H6 and segid D) (resid 5 and name H2'' and segid D) 3.4 0.3 0.2         
assign (resid 5 and name H6 and segid B) (resid 5 and name H2'' and segid B) 3.4 0.3 0.2         
assign (resid 5 and name H6 and segid C) (resid 5 and name H3' and segid C) 2.4 0.1 0.1         
assign (resid 5 and name H6 and segid B) (resid 5 and name H3' and segid B) 2.4 0.1 0.1         
assign (resid 5 and name H6 and segid A) (resid 5 and name H3' and segid A) 2.4 0.1 0.1         
assign (resid 5 and name H6 and segid D) (resid 5 and name H3' and segid D) 2.4 0.1 0.1         
assign (resid 5 and name N3 and segid A) (resid 5 and name H2'' and segid A) 4.7 0.5 50         
assign (resid 5 and name N3 and segid A) (resid 5 and name H2'' and segid C) 4.7 0.5 50         
assign (resid 6 and name H1' and segid B) (resid 6 and name H2'' and segid B) 2.7 0.05 0.05         
assign (resid 6 and name H1' and segid C) (resid 6 and name H2'' and segid C) 2.7 0.05 0.05         
assign (resid 6 and name H1' and segid D) (resid 6 and name H2'' and segid D) 2.7 0.05 0.05         
assign (resid 6 and name H1' and segid A) (resid 6 and name H2'' and segid A) 2.7 0.05 0.05         
assign (resid 6 and name H1' and segid D) (resid 6 and name H3' and segid D) 4.2 0.1 0.1         
assign (resid 6 and name H1' and segid A) (resid 6 and name H3' and segid A) 4.2 0.1 0.1         
assign (resid 6 and name H1' and segid C) (resid 6 and name H3' and segid C) 4.2 0.1 0.1         
assign (resid 6 and name H1' and segid B) (resid 6 and name H3' and segid B) 4.2 0.1 0.1         
assign (resid 6 and name H6 and segid B) (resid 6 and name H1' and segid B) 3.7 0.1 0.1         
assign (resid 6 and name H6 and segid A) (resid 6 and name H1' and segid A) 3.7 0.1 0.1         
assign (resid 6 and name H6 and segid D) (resid 6 and name H1' and segid D) 3.7 0.1 0.1         
assign (resid 6 and name H6 and segid C) (resid 6 and name H1' and segid C) 3.7 0.1 0.1         
assign (resid 6 and name H6 and segid B) (resid 6 and name H2'' and segid B) 2.7 0.1 0.1         
assign (resid 6 and name H6 and segid A) (resid 6 and name H2'' and segid A) 2.7 0.1 0.1         
assign (resid 6 and name H6 and segid D) (resid 6 and name H2'' and segid D) 2.7 0.1 0.1         
assign (resid 6 and name H6 and segid C) (resid 6 and name H2'' and segid C) 2.7 0.1 0.1         
assign (resid 6 and name H6 and segid C) (resid 6 and name H3' and segid C) 2.5 0.1 0.1         
assign (resid 6 and name H6 and segid D) (resid 6 and name H3' and segid D) 2.5 0.1 0.1         
assign (resid 6 and name H6 and segid A) (resid 6 and name H3' and segid A) 2.5 0.1 0.1         
assign (resid 6 and name H6 and segid B) (resid 6 and name H3' and segid B) 2.5 0.1 0.1         
! repulsive distance restraints                            
assign (resid 1 and name H5 and segid A) (resid 2 and name H3' and segid A) 4.7 0 50         
assign (resid 1 and name H3 and segid A) (resid 2 and name H41 and segid A) 4.3 1.5 50         
assign (resid 1 and name H3 and segid A) (resid 2 and name H3' and segid C) 4.7 0 50         
assign (resid 1 and name H1' and segid A) (resid 2 and name H5 and segid A) 4.7 0 50         
assign (resid 1 and name H5 and segid A) (resid 2 and name H1' and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid A) (resid 2 and name H6 and segid A) 4.7 0 50         
assign (resid 1 and name H3 and segid A) (resid 2 and name H41 and segid C) 4.3 1.5 50         
assign (resid 1 and name H3 and segid A) (resid 2 and name H3' and segid A) 4.7 0 50         
assign (resid 1 and name H3' and segid A) (resid 2 and name H3' and segid A) 4.7 0 50         
assign (resid 1 and name H6 and segid A) (resid 2 and name H6 and segid A) 4.7 0 50         
assign (resid 1 and name H1' and segid A) (resid 2 and name H3' and segid A) 4.7 0 50         
assign (resid 1 and name H3 and segid A) (resid 2 and name H2'' and segid A) 4.7 0 50         
assign (resid 1 and name H3 and segid A) (resid 2 and name H2'' and segid C) 4.7 0 50         
assign (resid 1 and name H1' and segid A) (resid 2 and name H1' and segid A) 4.7 0 50         
assign (resid 1 and name H1' and segid B) (resid 2 and name H5 and segid B) 4.7 0 50         
assign (resid 1 and name H3' and segid B) (resid 2 and name H3' and segid B) 4.7 0 50         
assign (resid 1 and name H1' and segid B) (resid 2 and name H1' and segid B) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 2 and name H3' and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 2 and name H1' and segid A) 4.7 0 50         
assign (resid 1 and name H1' and segid C) (resid 2 and name H5 and segid C) 4.7 0 50         
assign (resid 1 and name H6 and segid C) (resid 2 and name H6 and segid C) 4.7 0 50         
assign (resid 1 and name H3' and segid C) (resid 2 and name H3' and segid C) 4.7 0 50         
assign (resid 1 and name H1' and segid C) (resid 2 and name H3' and segid C) 4.7 0 50         
assign (resid 1 and name H1' and segid C) (resid 2 and name H3' and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 2 and name H3' and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 2 and name H6 and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 2 and name H6 and segid C) 4.7 0 50         
assign (resid 1 and name H6 and segid C) (resid 2 and name H6 and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid D) (resid 2 and name H1' and segid B) 4.7 0 50         
assign (resid 1 and name H5 and segid D) (resid 2 and name H6 and segid D) 4.7 0 50         
assign (resid 1 and name H1' and segid D) (resid 2 and name H3' and segid D) 4.7 0 50         
assign (resid 1 and name H3' and segid D) (resid 2 and name H3' and segid D) 4.7 0 50         
assign (resid 1 and name H5 and segid D) (resid 2 and name H3' and segid D) 4.7 0 50         
assign (resid 1 and name H1' and segid D) (resid 2 and name H5 and segid D) 4.7 0 50         
assign (resid 1 and name H6 and segid D) (resid 2 and name H6 and segid D) 4.7 0 50         
assign (resid 1 and name H5 and segid A) (resid 6 and name H6 and segid B) 4.7 0 50         
assign (resid 1 and name H3' and segid A) (resid 6 and name H41 and segid B) 4.7 0 50         
assign (resid 1 and name H5 and segid A) (resid 6 and name H2'' and segid B) 4.7 0 50         
assign (resid 1 and name H5 and segid A) (resid 6 and name H5 and segid B) 4.7 0 50         
assign (resid 1 and name H2'' and segid A) (resid 6 and name H41 and segid B) 4.7 0 50         
assign (resid 1 and name H2'' and segid B) (resid 6 and name H41 and segid A) 4.7 0 50         
assign (resid 1 and name H5 and segid B) (resid 6 and name H2'' and segid A) 4.7 0 50         
assign (resid 1 and name H5 and segid B) (resid 6 and name H6 and segid A) 4.7 0 50         
assign (resid 1 and name H5 and segid B) (resid 6 and name H5 and segid A) 4.7 0 50         
assign (resid 1 and name H3' and segid B) (resid 6 and name H41 and segid A) 4.7 0 50         
assign (resid 1 and name H2'' and segid C) (resid 6 and name H41 and segid D) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 6 and name H6 and segid D) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 6 and name H2'' and segid D) 4.7 0 50         
assign (resid 1 and name H5 and segid C) (resid 6 and name H5 and segid D) 4.7 0 50         
assign (resid 1 and name H3' and segid C) (resid 6 and name H41 and segid D) 4.7 0 50         
assign (resid 1 and name H5 and segid D) (resid 6 and name H6 and segid C) 4.7 0 50         
assign (resid 1 and name H3' and segid D) (resid 6 and name H41 and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid D) (resid 6 and name H2'' and segid C) 4.7 0 50         
assign (resid 1 and name H5 and segid D) (resid 6 and name H5 and segid C) 4.7 0 50         
assign (resid 1 and name H2'' and segid D) (resid 6 and name H41 and segid C) 4.7 0 50         
assign (resid 2 and name H41 and segid A) (resid 1 and name H5 and segid A) 4 0 50         
assign (resid 2 and name H5 and segid A) (resid 1 and name H3 and segid A) 3.7 1.4 50         
assign (resid 2 and name H5 and segid A) (resid 1 and name H3 and segid C) 4.7 0 50         
assign (resid 2 and name H41 and segid B) (resid 1 and name H5 and segid B) 4 0 50         
assign (resid 2 and name H5 and segid B) (resid 1 and name H3 and segid B) 3.7 1.4 50         
assign (resid 2 and name H5 and segid B) (resid 1 and name H3 and segid D) 4.7 0 50         
assign (resid 2 and name H5 and segid C) (resid 1 and name H3 and segid C) 3.7 1.4 50         
assign (resid 2 and name H5 and segid C) (resid 1 and name H3 and segid A) 4.7 0 50         
assign (resid 2 and name H41 and segid C) (resid 1 and name H5 and segid C) 4 0 50         
assign (resid 2 and name H41 and segid D) (resid 1 and name H5 and segid D) 4 0 50         
assign (resid 2 and name H5 and segid D) (resid 1 and name H3 and segid B) 4.7 0 50         
assign (resid 2 and name H5 and segid D) (resid 1 and name H3 and segid D) 3.7 1.4 50         
assign (resid 2 and name H2' and segid A) (resid 6 and name H2' and segid D) 1.8 0 50         
assign (resid 2 and name H6 and segid A) (resid 6 and name H42 and segid B) 4.7 0 50         
assign (resid 2 and name H6 and segid A) (resid 6 and name H41 and segid B) 4.7 0 50         
assign (resid 2 and name H3' and segid A) (resid 6 and name H5 and segid B) 4.7 0 50         
assign (resid 2 and name H41 and segid A) (resid 6 and name H2'' and segid B) 3.7 1.5 50         
assign (resid 2 and name H2' and segid A) (resid 6 and name H2' and segid D) 1.8 0 50         
assign (resid 2 and name H42 and segid A) (resid 6 and name H2'' and segid B) 3.7 1.9 50         
assign (resid 2 and name H42 and segid A) (resid 6 and name H2'' and segid B) 3.7 1.9 50         
assign (resid 2 and name H42 and segid A) (resid 6 and name H3' and segid B) 4.7 0 50         
assign (resid 2 and name H3' and segid A) (resid 6 and name H1' and segid D) 4.7 0 50         
assign (resid 2 and name H3' and segid B) (resid 6 and name H5 and segid A) 4.7 0 50         
assign (resid 2 and name H2' and segid B) (resid 6 and name H2' and segid C) 1.8 0 50         
assign (resid 2 and name H41 and segid B) (resid 6 and name H2'' and segid A) 3.7 1.5 50         
assign (resid 2 and name H2' and segid B) (resid 6 and name H2' and segid C) 1.8 0 50         
assign (resid 2 and name H3' and segid B) (resid 6 and name H1' and segid C) 4.7 0 50         
assign (resid 2 and name H42 and segid B) (resid 6 and name H2'' and segid A) 3.7 1.9 50         
assign (resid 2 and name H42 and segid B) (resid 6 and name H2'' and segid A) 3.7 1.9 50         
assign (resid 2 and name H6 and segid B) (resid 6 and name H41 and segid A) 4.7 0 50         
assign (resid 2 and name H6 and segid B) (resid 6 and name H42 and segid A) 4.7 0 50         
assign (resid 2 and name H42 and segid B) (resid 6 and name H3' and segid A) 4.7 0 50         
assign (resid 2 and name H3' and segid C) (resid 6 and name H1' and segid B) 4.7 0 50         
assign (resid 2 and name H41 and segid C) (resid 6 and name H2'' and segid D) 3.7 1.5 50         
assign (resid 2 and name H42 and segid C) (resid 6 and name H3' and segid D) 4.7 0 50         
assign (resid 2 and name H6 and segid C) (resid 6 and name H41 and segid D) 4.7 0 50         
assign (resid 2 and name H3' and segid C) (resid 6 and name H5 and segid D) 4.7 0 50         
assign (resid 2 and name H6 and segid C) (resid 6 and name H42 and segid D) 4.7 0 50         
assign (resid 2 and name H42 and segid C) (resid 6 and name H2'' and segid D) 3.7 1.9 50         
assign (resid 2 and name H42 and segid C) (resid 6 and name H2'' and segid D) 3.7 1.9 50         
assign (resid 2 and name H6 and segid D) (resid 6 and name H42 and segid C) 4.7 0 50         
assign (resid 2 and name H6 and segid D) (resid 6 and name H41 and segid C) 4.7 0 50         
assign (resid 2 and name H41 and segid D) (resid 6 and name H2'' and segid C) 3.7 1.5 50         
assign (resid 2 and name H42 and segid D) (resid 6 and name H2'' and segid C) 3.7 1.9 50         
assign (resid 2 and name H42 and segid D) (resid 6 and name H3' and segid C) 4.7 0 50         
assign (resid 2 and name H42 and segid D) (resid 6 and name H2'' and segid C) 3.7 1.9 50         
assign (resid 2 and name H3' and segid D) (resid 6 and name H1' and segid A) 4.7 0 50         
assign (resid 2 and name H3' and segid D) (resid 6 and name H5 and segid C) 4.7 0 50         
assign (resid 3 and name H6 and segid A) (resid 2 and name H2'' and segid A) 4.7 0 50         
assign (resid 3 and name H1' and segid A) (resid 2 and name H2'' and segid A) 4.7 0 50         
assign (resid 3 and name H1' and segid B) (resid 2 and name H2'' and segid B) 4.7 0 50         
assign (resid 3 and name H6 and segid B) (resid 2 and name H2'' and segid B) 4.7 0 50         
assign (resid 3 and name H6 and segid C) (resid 2 and name H2'' and segid C) 4.7 0 50         
assign (resid 3 and name H1' and segid C) (resid 2 and name H2'' and segid C) 4.7 0 50         
assign (resid 3 and name H1' and segid D) (resid 2 and name H2'' and segid D) 4.7 0 50         
assign (resid 3 and name H6 and segid D) (resid 2 and name H2'' and segid D) 4.7 0 50         
assign (resid 3 and name H3' and segid A) (resid 5 and name H1' and segid D) 4.7 0 50         
assign (resid 3 and name N3 and segid A) (resid 5 and name H41 and segid D) 4.7 0.5 50         
assign (resid 3 and name H3' and segid A) (resid 5 and name H1' and segid D) 4.7 0 50         
assign (resid 3 and name N3 and segid A) (resid 5 and name H41 and segid B) 4.7 0.5 50         
assign (resid 3 and name H41 and segid A) (resid 5 and name H2'' and segid B) 3.4 0 50         
assign (resid 3 and name H41 and segid B) (resid 5 and name H2'' and segid A) 3.4 0 50         
assign (resid 3 and name H3' and segid B) (resid 5 and name H1' and segid C) 4.7 0 50         
assign (resid 3 and name H3' and segid B) (resid 5 and name H1' and segid C) 4.7 0 50         
assign (resid 3 and name H3' and segid C) (resid 5 and name H1' and segid B) 4.7 0 50         
assign (resid 3 and name H41 and segid C) (resid 5 and name H2'' and segid D) 3.4 0 50         
assign (resid 3 and name H3' and segid C) (resid 5 and name H1' and segid B) 4.7 0 50         
assign (resid 3 and name H41 and segid D) (resid 5 and name H2'' and segid C) 3.4 0 50         
assign (resid 3 and name H3' and segid D) (resid 5 and name H1' and segid A) 4.7 0 50         
assign (resid 3 and name H3' and segid D) (resid 5 and name H1' and segid A) 4.7 0 50         
assign (resid 3 and name H6 and segid A) (resid 6 and name H1' and segid D) 4.7 0 50         
assign (resid 3 and name H6 and segid A) (resid 6 and name H1' and segid D) 4.7 0 50         
assign (resid 3 and name H6 and segid B) (resid 6 and name H1' and segid C) 4.7 0 50         
assign (resid 3 and name H6 and segid B) (resid 6 and name H1' and segid C) 4.7 0 50         
assign (resid 3 and name H6 and segid C) (resid 6 and name H1' and segid B) 4.7 0 50         
assign (resid 3 and name H6 and segid C) (resid 6 and name H1' and segid B) 4.7 0 50         
assign (resid 3 and name H6 and segid D) (resid 6 and name H1' and segid A) 4.7 0 50         
assign (resid 3 and name H6 and segid D) (resid 6 and name H1' and segid A) 4.7 0 50         
assign (resid 4 and name N3 and segid A) (resid 5 and name H41 and segid D) 4.7 0.5 50         
assign (resid 4 and name N3 and segid A) (resid 5 and name H41 and segid B) 4.7 0.5 50         
assign (resid 4 and name H2'' and segid C) (resid 5 and name H1' and segid B) 4.7 1.5 50         
assign (resid 5 and name N3 and segid A) (resid 3 and name H3' and segid D) 4.7 0.5 50         
assign (resid 5 and name H41 and segid A) (resid 3 and name H2'' and segid B) 3.4 0 50         
assign (resid 5 and name H2' and segid A) (resid 3 and name H3' and segid D) 4.7 0.5 50         
assign (resid 5 and name N3 and segid A) (resid 3 and name H3' and segid B) 4.7 0.5 50         
assign (resid 5 and name H2' and segid B) (resid 3 and name H3' and segid C) 4.7 1.5 50         
assign (resid 5 and name H41 and segid B) (resid 3 and name H2'' and segid A) 3.4 0 50         
assign (resid 5 and name H41 and segid C) (resid 3 and name H2'' and segid D) 3.4 0 50         
assign (resid 5 and name H2' and segid C) (resid 3 and name H3' and segid B) 4.7 0.5 50         
assign (resid 5 and name H41 and segid D) (resid 3 and name H2'' and segid C) 3.4 0 50         
assign (resid 5 and name H2' and segid D) (resid 3 and name H3' and segid A) 4.7 0.5 50         
assign (resid 5 and name H1' and segid A) (resid 4 and name H6 and segid D) 4.7 0 50         
assign (resid 5 and name H1' and segid A) (resid 4 and name H6 and segid D) 4.7 0 50         
assign (resid 5 and name H2' and segid A) (resid 4 and name H1' and segid D) 4.7 0.5 50         
assign (resid 5 and name H1' and segid B) (resid 4 and name H6 and segid C) 4.7 0 50         
assign (resid 5 and name H2' and segid B) (resid 4 and name H1' and segid C) 4.7 0.5 50         
assign (resid 5 and name H1' and segid B) (resid 4 and name H6 and segid C) 4.7 0 50         
assign (resid 5 and name H1' and segid C) (resid 4 and name H6 and segid B) 4.7 0 50         
assign (resid 5 and name H1' and segid C) (resid 4 and name H6 and segid B) 4.7 0 50         
assign (resid 5 and name H2' and segid C) (resid 4 and name H1' and segid B) 4.7 0.5 50         
assign (resid 5 and name H2' and segid D) (resid 4 and name H1' and segid A) 4.7 0.5 50         
assign (resid 5 and name H1' and segid D) (resid 4 and name H6 and segid A) 4.7 0 50         
assign (resid 5 and name H1' and segid D) (resid 4 and name H6 and segid A) 4.7 0 50         
assign (resid 6 and name H41 and segid A) (resid 2 and name H2'' and segid B) 3.2 0 50         
assign (resid 6 and name H2' and segid A) (resid 2 and name H2' and segid D) 1.8 0 50         
assign (resid 6 and name H2' and segid A) (resid 2 and name H2' and segid D) 1.8 0 50         
assign (resid 6 and name H2' and segid B) (resid 2 and name H2' and segid C) 1.8 0 50         
assign (resid 6 and name H41 and segid B) (resid 2 and name H2'' and segid A) 3.2 0 50         
assign (resid 6 and name H2' and segid B) (resid 2 and name H2' and segid C) 1.8 0 50         
assign (resid 6 and name H41 and segid C) (resid 2 and name H2'' and segid D) 3.2 0 50         
assign (resid 6 and name H42 and segid A) (resid 3 and name H1' and segid B) 4.7 0 50         
assign (resid 6 and name H42 and segid A) (resid 3 and name H1' and segid D) 4.7 0 50         
assign (resid 6 and name H6 and segid A) (resid 3 and name H41 and segid B) 4.7 0 50         
assign (resid 6 and name H42 and segid B) (resid 3 and name H1' and segid A) 4.7 0 50         
assign (resid 6 and name H42 and segid B) (resid 3 and name H1' and segid C) 4.7 0 50         
assign (resid 6 and name H6 and segid B) (resid 3 and name H41 and segid A) 4.7 0 50         
assign (resid 6 and name H6 and segid C) (resid 3 and name H41 and segid D) 4.7 0 50         
assign (resid 6 and name H42 and segid C) (resid 3 and name H1' and segid D) 4.7 0 50         
assign (resid 6 and name H42 and segid C) (resid 3 and name H1' and segid B) 4.7 0 50         
assign (resid 6 and name H6 and segid D) (resid 3 and name H41 and segid C) 4.7 0 50         
assign (resid 6 and name H42 and segid D) (resid 3 and name H1' and segid C) 4.7 0 50         
assign (resid 6 and name H42 and segid D) (resid 3 and name H1' and segid A) 4.7 0 50         
! base-pairing distance restraint                            
assign (resid 2 and name H42 and segid A) (resid 2 and name O2 and segid C) 1.74 0.1 0.1         
assign (resid 2 and name O2 and segid A) (resid 2 and name H42 and segid C) 1.74 0.1 0.1         
assign (resid 2 and name N3 and segid A) (resid 2 and name N3 and segid C) 2.76 0.1 0.1         
assign (resid 3 and name H42 and segid A) (resid 3 and name O2 and segid C) 1.74 0.1 0.1         
assign (resid 3 and name O2 and segid A) (resid 3 and name H42 and segid C) 1.74 0.1 0.1         
assign (resid 3 and name N3 and segid A) (resid 3 and name N3 and segid C) 2.76 0.1 0.1         
assign (resid 4 and name H42 and segid A) (resid 4 and name O2 and segid C) 1.74 0.1 0.1         
assign (resid 4 and name O2 and segid A) (resid 4 and name H42 and segid C) 1.74 0.1 0.1         
assign (resid 4 and name N3 and segid A) (resid 4 and name N3 and segid C) 2.76 0.1 0.1         
assign (resid 5 and name H42 and segid A) (resid 5 and name O2 and segid C) 1.74 0.1 0.1         
assign (resid 5 and name O2 and segid A) (resid 5 and name H42 and segid C) 1.74 0.1 0.1         
assign (resid 5 and name N3 and segid A) (resid 5 and name N3 and segid C) 2.76 0.1 0.1         
assign (resid 6 and name H42 and segid A) (resid 6 and name O2 and segid C) 1.74 0.1 0.1         
assign (resid 6 and name O2 and segid A) (resid 6 and name H42 and segid C) 1.74 0.1 0.1         
assign (resid 6 and name N3 and segid A) (resid 6 and name N3 and segid C) 2.76 0.1 0.1         
assign (resid 2 and name H42 and segid B) (resid 2 and name O2 and segid D) 1.74 0.1 0.1         
assign (resid 2 and name O2 and segid B) (resid 2 and name H42 and segid D) 1.74 0.1 0.1         
assign (resid 2 and name N3 and segid B) (resid 2 and name N3 and segid D) 2.76 0.1 0.1         
assign (resid 3 and name H42 and segid B) (resid 3 and name O2 and segid D) 1.74 0.1 0.1         
assign (resid 3 and name O2 and segid B) (resid 3 and name H42 and segid D) 1.74 0.1 0.1         
assign (resid 3 and name N3 and segid B) (resid 3 and name N3 and segid D) 2.76 0.1 0.1         
assign (resid 4 and name H42 and segid B) (resid 4 and name O2 and segid D) 1.74 0.1 0.1         
assign (resid 4 and name O2 and segid B) (resid 4 and name H42 and segid D) 1.74 0.1 0.1         
assign (resid 4 and name N3 and segid B) (resid 4 and name N3 and segid D) 2.76 0.1 0.1         
assign (resid 5 and name H42 and segid B) (resid 5 and name O2 and segid D) 1.74 0.1 0.1         
assign (resid 5 and name O2 and segid B) (resid 5 and name H42 and segid D) 1.74 0.1 0.1         
assign (resid 5 and name N3 and segid B) (resid 5 and name N3 and segid D) 2.76 0.1 0.1         
assign (resid 6 and name H42 and segid B) (resid 6 and name O2 and segid D) 1.74 0.1 0.1         
assign (resid 6 and name O2 and segid B) (resid 6 and name H42 and segid D) 1.74 0.1 0.1         
assign (resid 6 and name N3 and segid B) (resid 6 and name N3 and segid D) 2.76 0.1 0.1         
!ambiguous distance restraints
assign (resid 3 and name H1' and segid A) ((resid 5* or resid 6*) and (name H2'' or name H4') and segid D) 3.7 1.4 0 
assign (resid 3 and name H1' and segid B) ((resid 5* or resid 6*) and (name H2'' or name H4') and segid C) 3.7 1.4 0
assign (resid 3 and name H1' and segid C) ((resid 5* or resid 6*) and (name H2'' or name H4') and segid B) 3.7 1.4 0
assign (resid 3 and name H1' and segid D) ((resid 5* or resid 6*) and (name H2'' or name H4') and segid A) 3.7 1.4 0
assign (resid 4 and name H1' and segid A) (resid 5  and (name H4' or name H3') and segid D) 4.7 1.4 0 
assign (resid 4 and name H1' and segid B) (resid 5  and (name H4' or name H3') and segid C) 4.7 1.4 0
assign (resid 4 and name H1' and segid C) (resid 5  and (name H4' or name H3') and segid B) 4.7 1.4 0
assign (resid 4 and name H1' and segid D) (resid 5  and (name H4' or name H3') and segid A) 4.7 1.4 0
assign (resid 5 and name  N3 and segid D) (resid 3 and name  H2'' and (segid  C or segid A))  4.7  2  0.5  
assign (resid 3 and name  N3 and segid D) (resid 5 and name  H2'' and (segid  C or segid A))  4.7  2  0.5   
assign (resid 4 and name  N3 and segid D) (resid 4 and name  H2'' and (segid  C or segid A))  4.7  2  0.5  
assign (resid 5 and name  N3 and segid B) (resid 3 and name  H2'' and (segid  C or segid A))  4.7  2  0.5 
assign (resid 3 and name  N3 and segid B) (resid 5 and name  H2'' and (segid  C or segid A))  4.7  2  0.5 
assign (resid 4 and name  N3 and segid B) (resid 4 and name  H2'' and (segid  C or segid A))  4.7  2  0.5 
assign (resid 5 and name  N3 and segid A) (resid 3 and name  H2'' and (segid  B or segid D))  4.7  2  0.5   
assign (resid 3 and name  N3 and segid A) (resid 5 and name  H2'' and (segid  B or segid D))  4.7  2  0.5  
assign (resid 4 and name  N3 and segid A) (resid 4 and name  H2'' and (segid  B or segid D))  4.7  2  0.5   
assign (resid 5 and name  N3 and segid C) (resid 3 and name  H2'' and (segid  B or segid D))  4.7  2  0.5  
assign (resid 3 and name  N3 and segid C) (resid 5 and name  H2'' and (segid  B or segid D))  4.7  2  0.5  
assign (resid 4 and name  N3 and segid C) (resid 4 and name  H2'' and (segid  B or segid D))  4.7  2  0.5 
assign (resid 3 and name H2' and segid C) (resid 5 and (name H4' or name H3') and segid B) 4.7 1.5 0
assign (resid 3 and name H2' and segid B) (resid 5 and (name H4' or name H3') and segid C) 4.7 0.5 0  
assign (resid 3 and name H2' and segid D) (resid 5 and (name H4' or name H3') and segid A) 4.7 1.5 0  
assign (resid 3 and name H2' and segid A) (resid 5 and (name H4' or name H3') and segid D) 4.7 1.5 0  
assign (resid 5 and name H2' and segid C) (resid 5 and (name H4' or name H3') and segid C) 3.7 1.4 0   
assign (resid 5 and name H2' and segid D) (resid 5 and (name H4' or name H3') and segid D) 3.7 1.4 0  
assign (resid 5 and name H2' and segid A) (resid 5 and (name H4' or name H3') and segid A) 3.7 1.4 0   
assign (resid 5 and name H2' and segid B) (resid 5 and (name H4' or name H3') and segid B) 3.7 1.4 0  
assign (resid 4 and name H1' and segid B) (resid 5 and (name H4' or name H3') and segid C) 4.7 1.5 0 
assign (resid 4 and name H1' and segid A) (resid 5 and (name H4' or name H3') and segid D) 4.7 1.5 0 
assign (resid 4 and name H1' and segid C) (resid 5 and (name H4' or name H3') and segid B) 4.7 1.5 0 
assign (resid 4 and name H1' and segid D) (resid 5 and (name H4' or name H3') and segid A) 4.7 1.5 0
assign (resid 3 and name H41 and segid C) (resid 5 and (name H4' or name H3') and segid D) 4.7 1.5 0   
assign (resid 3 and name H41 and segid B) (resid 5 and (name H4' or name H3') and segid A) 4.7 1.5 0
assign (resid 3 and name H41 and segid A) (resid 5 and (name H4' or name H3') and segid B) 4.7 1.5 0   
assign (resid 3 and name H41 and segid D) (resid 5 and (name H4' or name H3') and segid C) 4.7 1.5 0   
assign (resid 3 and name H42 and segid A) (resid 5 and (name H4' or name H3') and segid B) 4.7 1.5 0   
assign (resid 3 and name H42 and segid C) (resid 5 and (name H4' or name H3') and segid D) 4.7 1.5 0   
assign (resid 3 and name H42 and segid D) (resid 5 and (name H4' or name H3') and segid C) 4.7 1.5 0   
assign (resid 3 and name H42 and segid B) (resid 5 and (name H4' or name H3') and segid A) 4.7 1.5 0   
!dihedral restraint
assign (residue 2 and name C4' and segid A) (residue 2 and name O4' and segid A) 
(residue 2 and name C1' and segid A) (residue 2 and name C2' and segid A) 1 10 20 2 !t0
assign (residue 2 and name O4' and segid A) (residue 2 and name C1' and segid A)
(residue 2 and name C2' and segid A) (residue 2 and name C3' and segid A) 1 -26 13 2 !t1
assign (residue 2 and name C1' and segid A) (residue 2 and name C2' and segid A) 
(residue 2 and name C3' and segid A) (residue 2 and name C4' and segid A) 1 33 7 2 !t2
assign (residue 2 and name C2' and segid A) (residue 2 and name C3' and segid A) 
(residue 2 and name C4' and segid A) (residue 2 and name O4' and segid A) 1 -26 13 2 !t3
assign (residue 2 and name C3' and segid A) (residue 2 and name C4' and segid A) 
(residue 2 and name O4' and segid A) (residue 2 and name C1' and segid A) 1 10 20 2 !t4
assign (residue 3 and name C4' and segid A) (residue 3 and name O4' and segid A) 
(residue 3 and name C1' and segid A) (residue 3 and name C2' and segid A) 1 10 20 2 !t0
assign (residue 3 and name O4' and segid A) (residue 3 and name C1' and segid A)
(residue 3 and name C2' and segid A) (residue 3 and name C3' and segid A) 1 -26 13 2 !t1
assign (residue 3 and name C1' and segid A) (residue 3 and name C2' and segid A) 
(residue 3 and name C3' and segid A) (residue 3 and name C4' and segid A) 1 33 7 2 !t2
assign (residue 3 and name C2' and segid A) (residue 3 and name C3' and segid A) 
(residue 3 and name C4' and segid A) (residue 3 and name O4' and segid A) 1 -26 13 2 !t3
assign (residue 3 and name C3' and segid A) (residue 3 and name C4' and segid A) 
(residue 3 and name O4' and segid A) (residue 3 and name C1' and segid A) 1 10 20 2 !t4
assign (residue 4 and name C4' and segid A) (residue 4 and name O4' and segid A) 
(residue 4 and name C1' and segid A) (residue 4 and name C2' and segid A) 1 10 20 2 !t0
assign (residue 4 and name O4' and segid A) (residue 4 and name C1' and segid A)
(residue 4 and name C2' and segid A) (residue 4 and name C3' and segid A) 1 -26 13 2 !t1
assign (residue 4 and name C1' and segid A) (residue 4 and name C2' and segid A) 
(residue 4 and name C3' and segid A) (residue 4 and name C4' and segid A) 1 33 7 2 !t2
assign (residue 4 and name C2' and segid A) (residue 4 and name C3' and segid A) 
(residue 4 and name C4' and segid A) (residue 4 and name O4' and segid A) 1 -26 13 2 !t3
assign (residue 4 and name C3' and segid A) (residue 4 and name C4' and segid A) 
(residue 4 and name O4' and segid A) (residue 4 and name C1' and segid A) 1 10 20 2 !t4
assign (residue 5 and name C4' and segid A) (residue 5 and name O4' and segid A) 
(residue 5 and name C1' and segid A) (residue 5 and name C2' and segid A) 1 10 20 2 !t0
assign (residue 5 and name O4' and segid A) (residue 5 and name C1' and segid A)
(residue 5 and name C2' and segid A) (residue 5 and name C3' and segid A) 1 -26 13 2 !t1
assign (residue 5 and name C1' and segid A) (residue 5 and name C2' and segid A) 
(residue 5 and name C3' and segid A) (residue 5 and name C4' and segid A) 1 33 7 2 !t2
assign (residue 5 and name C2' and segid A) (residue 5 and name C3' and segid A) 
(residue 5 and name C4' and segid A) (residue 5 and name O4' and segid A) 1 -26 13 2 !t3
assign (residue 5 and name C3' and segid A) (residue 5 and name C4' and segid A) 
(residue 5 and name O4' and segid A) (residue 5 and name C1' and segid A) 1 10 20 2 !t4
assign (residue 6 and name C4' and segid A) (residue 6 and name O4' and segid A) 
(residue 6 and name C1' and segid A) (residue 6 and name C2' and segid A) 1 10 20 2 !t0
assign (residue 6 and name O4' and segid A) (residue 6 and name C1' and segid A)
(residue 6 and name C2' and segid A) (residue 6 and name C3' and segid A) 1 -26 13 2 !t1
assign (residue 6 and name C1' and segid A) (residue 6 and name C2' and segid A) 
(residue 6 and name C3' and segid A) (residue 6 and name C4' and segid A) 1 33 7 2 !t2
assign (residue 6 and name C2' and segid A) (residue 6 and name C3' and segid A) 
(residue 6 and name C4' and segid A) (residue 6 and name O4' and segid A) 1 -26 13 2 !t3
assign (residue 6 and name C3' and segid A) (residue 6 and name C4' and segid A) 
(residue 6 and name O4' and segid A) (residue 6 and name C1' and segid A) 1 10 20 2 !t4
assign (residue 2 and name C4' and segid B) (residue 2 and name O4' and segid B) 
(residue 2 and name C1' and segid B) (residue 2 and name C2' and segid B) 1 10 20 2 !t0
assign (residue 2 and name O4' and segid B) (residue 2 and name C1' and segid B)
(residue 2 and name C2' and segid B) (residue 2 and name C3' and segid B) 1 -26 13 2 !t1
assign (residue 2 and name C1' and segid B) (residue 2 and name C2' and segid B) 
(residue 2 and name C3' and segid B) (residue 2 and name C4' and segid B) 1 33 7 2 !t2
assign (residue 2 and name C2' and segid B) (residue 2 and name C3' and segid B) 
(residue 2 and name C4' and segid B) (residue 2 and name O4' and segid B) 1 -26 13 2 !t3
assign (residue 2 and name C3' and segid B) (residue 2 and name C4' and segid B) 
(residue 2 and name O4' and segid B) (residue 2 and name C1' and segid B) 1 10 20 2 !t4
assign (residue 3 and name C4' and segid B) (residue 3 and name O4' and segid B) 
(residue 3 and name C1' and segid B) (residue 3 and name C2' and segid B) 1 10 20 2 !t0
assign (residue 3 and name O4' and segid B) (residue 3 and name C1' and segid B)
(residue 3 and name C2' and segid B) (residue 3 and name C3' and segid B) 1 -26 13 2 !t1
assign (residue 3 and name C1' and segid B) (residue 3 and name C2' and segid B) 
(residue 3 and name C3' and segid B) (residue 3 and name C4' and segid B) 1 33 7 2 !t2
assign (residue 3 and name C2' and segid B) (residue 3 and name C3' and segid B) 
(residue 3 and name C4' and segid B) (residue 3 and name O4' and segid B) 1 -26 13 2 !t3
assign (residue 3 and name C3' and segid B) (residue 3 and name C4' and segid B) 
(residue 3 and name O4' and segid B) (residue 3 and name C1' and segid B) 1 10 20 2 !t4
assign (residue 4 and name C4' and segid B) (residue 4 and name O4' and segid B) 
(residue 4 and name C1' and segid B) (residue 4 and name C2' and segid B) 1 10 20 2 !t0
assign (residue 4 and name O4' and segid B) (residue 4 and name C1' and segid B)
(residue 4 and name C2' and segid B) (residue 4 and name C3' and segid B) 1 -26 13 2 !t1
assign (residue 4 and name C1' and segid B) (residue 4 and name C2' and segid B) 
(residue 4 and name C3' and segid B) (residue 4 and name C4' and segid B) 1 33 7 2 !t2
assign (residue 4 and name C2' and segid B) (residue 4 and name C3' and segid B) 
(residue 4 and name C4' and segid B) (residue 4 and name O4' and segid B) 1 -26 13 2 !t3
assign (residue 4 and name C3' and segid B) (residue 4 and name C4' and segid B) 
(residue 4 and name O4' and segid B) (residue 4 and name C1' and segid B) 1 10 20 2 !t4
assign (residue 5 and name C4' and segid B) (residue 5 and name O4' and segid B) 
(residue 5 and name C1' and segid B) (residue 5 and name C2' and segid B) 1 10 20 2 !t0
assign (residue 5 and name O4' and segid B) (residue 5 and name C1' and segid B)
(residue 5 and name C2' and segid B) (residue 5 and name C3' and segid B) 1 -26 13 2 !t1
assign (residue 5 and name C1' and segid B) (residue 5 and name C2' and segid B) 
(residue 5 and name C3' and segid B) (residue 5 and name C4' and segid B) 1 33 7 2 !t2
assign (residue 5 and name C2' and segid B) (residue 5 and name C3' and segid B) 
(residue 5 and name C4' and segid B) (residue 5 and name O4' and segid B) 1 -26 13 2 !t3
assign (residue 5 and name C3' and segid B) (residue 5 and name C4' and segid B) 
(residue 5 and name O4' and segid B) (residue 5 and name C1' and segid B) 1 10 20 2 !t4
assign (residue 6 and name C4' and segid B) (residue 6 and name O4' and segid B) 
(residue 6 and name C1' and segid B) (residue 6 and name C2' and segid B) 1 10 20 2 !t0
assign (residue 6 and name O4' and segid B) (residue 6 and name C1' and segid B)
(residue 6 and name C2' and segid B) (residue 6 and name C3' and segid B) 1 -26 13 2 !t1
assign (residue 6 and name C1' and segid B) (residue 6 and name C2' and segid B) 
(residue 6 and name C3' and segid B) (residue 6 and name C4' and segid B) 1 33 7 2 !t2
assign (residue 6 and name C2' and segid B) (residue 6 and name C3' and segid B) 
(residue 6 and name C4' and segid B) (residue 6 and name O4' and segid B) 1 -26 13 2 !t3
assign (residue 6 and name C3' and segid B) (residue 6 and name C4' and segid B) 
(residue 6 and name O4' and segid B) (residue 6 and name C1' and segid B) 1 10 20 2 !t4
assign (residue 2 and name C4' and segid C) (residue 2 and name O4' and segid C) 
(residue 2 and name C1' and segid C) (residue 2 and name C2' and segid C) 1 10 20 2 !t0
assign (residue 2 and name O4' and segid C) (residue 2 and name C1' and segid C)
(residue 2 and name C2' and segid C) (residue 2 and name C3' and segid C) 1 -26 13 2 !t1
assign (residue 2 and name C1' and segid C) (residue 2 and name C2' and segid C) 
(residue 2 and name C3' and segid C) (residue 2 and name C4' and segid C) 1 33 7 2 !t2
assign (residue 2 and name C2' and segid C) (residue 2 and name C3' and segid C) 
(residue 2 and name C4' and segid C) (residue 2 and name O4' and segid C) 1 -26 13 2 !t3
assign (residue 2 and name C3' and segid C) (residue 2 and name C4' and segid C) 
(residue 2 and name O4' and segid C) (residue 2 and name C1' and segid C) 1 10 20 2 !t4
assign (residue 3 and name C4' and segid C) (residue 3 and name O4' and segid C) 
(residue 3 and name C1' and segid C) (residue 3 and name C2' and segid C) 1 10 20 2 !t0
assign (residue 3 and name O4' and segid C) (residue 3 and name C1' and segid C)
(residue 3 and name C2' and segid C) (residue 3 and name C3' and segid C) 1 -26 13 2 !t1
assign (residue 3 and name C1' and segid C) (residue 3 and name C2' and segid C) 
(residue 3 and name C3' and segid C) (residue 3 and name C4' and segid C) 1 33 7 2 !t2
assign (residue 3 and name C2' and segid C) (residue 3 and name C3' and segid C) 
(residue 3 and name C4' and segid C) (residue 3 and name O4' and segid C) 1 -26 13 2 !t3
assign (residue 3 and name C3' and segid C) (residue 3 and name C4' and segid C) 
(residue 3 and name O4' and segid C) (residue 3 and name C1' and segid C) 1 10 20 2 !t4
assign (residue 4 and name C4' and segid C) (residue 4 and name O4' and segid C) 
(residue 4 and name C1' and segid C) (residue 4 and name C2' and segid C) 1 10 20 2 !t0
assign (residue 4 and name O4' and segid C) (residue 4 and name C1' and segid C)
(residue 4 and name C2' and segid C) (residue 4 and name C3' and segid C) 1 -26 13 2 !t1
assign (residue 4 and name C1' and segid C) (residue 4 and name C2' and segid C) 
(residue 4 and name C3' and segid C) (residue 4 and name C4' and segid C) 1 33 7 2 !t2
assign (residue 4 and name C2' and segid C) (residue 4 and name C3' and segid C) 
(residue 4 and name C4' and segid C) (residue 4 and name O4' and segid C) 1 -26 13 2 !t3
assign (residue 4 and name C3' and segid C) (residue 4 and name C4' and segid C) 
(residue 4 and name O4' and segid C) (residue 4 and name C1' and segid C) 1 10 20 2 !t4
assign (residue 5 and name C4' and segid C) (residue 5 and name O4' and segid C) 
(residue 5 and name C1' and segid C) (residue 5 and name C2' and segid C) 1 10 20 2 !t0
assign (residue 5 and name O4' and segid C) (residue 5 and name C1' and segid C)
(residue 5 and name C2' and segid C) (residue 5 and name C3' and segid C) 1 -26 13 2 !t1
assign (residue 5 and name C1' and segid C) (residue 5 and name C2' and segid C) 
(residue 5 and name C3' and segid C) (residue 5 and name C4' and segid C) 1 33 7 2 !t2
assign (residue 5 and name C2' and segid C) (residue 5 and name C3' and segid C) 
(residue 5 and name C4' and segid C) (residue 5 and name O4' and segid C) 1 -26 13 2 !t3
assign (residue 5 and name C3' and segid C) (residue 5 and name C4' and segid C) 
(residue 5 and name O4' and segid C) (residue 5 and name C1' and segid C) 1 10 20 2 !t4
assign (residue 6 and name C4' and segid C) (residue 6 and name O4' and segid C) 
(residue 6 and name C1' and segid C) (residue 6 and name C2' and segid C) 1 10 20 2 !t0
assign (residue 6 and name O4' and segid C) (residue 6 and name C1' and segid C)
(residue 6 and name C2' and segid C) (residue 6 and name C3' and segid C) 1 -26 13 2 !t1
assign (residue 6 and name C1' and segid C) (residue 6 and name C2' and segid C) 
(residue 6 and name C3' and segid C) (residue 6 and name C4' and segid C) 1 33 7 2 !t2
assign (residue 6 and name C2' and segid C) (residue 6 and name C3' and segid C) 
(residue 6 and name C4' and segid C) (residue 6 and name O4' and segid C) 1 -26 13 2 !t3
assign (residue 6 and name C3' and segid C) (residue 6 and name C4' and segid C) 
(residue 6 and name O4' and segid C) (residue 6 and name C1' and segid C) 1 10 20 2 !t4
assign (residue 2 and name C4' and segid D) (residue 2 and name O4' and segid D) 
(residue 2 and name C1' and segid D) (residue 2 and name C2' and segid D) 1 10 20 2 !t0
assign (residue 2 and name O4' and segid D) (residue 2 and name C1' and segid D)
(residue 2 and name C2' and segid D) (residue 2 and name C3' and segid D) 1 -26 13 2 !t1
assign (residue 2 and name C1' and segid D) (residue 2 and name C2' and segid D) 
(residue 2 and name C3' and segid D) (residue 2 and name C4' and segid D) 1 33 7 2 !t2
assign (residue 2 and name C2' and segid D) (residue 2 and name C3' and segid D) 
(residue 2 and name C4' and segid D) (residue 2 and name O4' and segid D) 1 -26 13 2 !t3
assign (residue 2 and name C3' and segid D) (residue 2 and name C4' and segid D) 
(residue 2 and name O4' and segid D) (residue 2 and name C1' and segid D) 1 10 20 2 !t4
assign (residue 3 and name C4' and segid D) (residue 3 and name O4' and segid D) 
(residue 3 and name C1' and segid D) (residue 3 and name C2' and segid D) 1 10 20 2 !t0
assign (residue 3 and name O4' and segid D) (residue 3 and name C1' and segid D)
(residue 3 and name C2' and segid D) (residue 3 and name C3' and segid D) 1 -26 13 2 !t1
assign (residue 3 and name C1' and segid D) (residue 3 and name C2' and segid D) 
(residue 3 and name C3' and segid D) (residue 3 and name C4' and segid D) 1 33 7 2 !t2
assign (residue 3 and name C2' and segid D) (residue 3 and name C3' and segid D) 
(residue 3 and name C4' and segid D) (residue 3 and name O4' and segid D) 1 -26 13 2 !t3
assign (residue 3 and name C3' and segid D) (residue 3 and name C4' and segid D) 
(residue 3 and name O4' and segid D) (residue 3 and name C1' and segid D) 1 10 20 2 !t4
assign (residue 4 and name C4' and segid D) (residue 4 and name O4' and segid D) 
(residue 4 and name C1' and segid D) (residue 4 and name C2' and segid D) 1 10 20 2 !t0
assign (residue 4 and name O4' and segid D) (residue 4 and name C1' and segid D)
(residue 4 and name C2' and segid D) (residue 4 and name C3' and segid D) 1 -26 13 2 !t1
assign (residue 4 and name C1' and segid D) (residue 4 and name C2' and segid D) 
(residue 4 and name C3' and segid D) (residue 4 and name C4' and segid D) 1 33 7 2 !t2
assign (residue 4 and name C2' and segid D) (residue 4 and name C3' and segid D) 
(residue 4 and name C4' and segid D) (residue 4 and name O4' and segid D) 1 -26 13 2 !t3
assign (residue 4 and name C3' and segid D) (residue 4 and name C4' and segid D) 
(residue 4 and name O4' and segid D) (residue 4 and name C1' and segid D) 1 10 20 2 !t4
assign (residue 5 and name C4' and segid D) (residue 5 and name O4' and segid D) 
(residue 5 and name C1' and segid D) (residue 5 and name C2' and segid D) 1 10 20 2 !t0
assign (residue 5 and name O4' and segid D) (residue 5 and name C1' and segid D)
(residue 5 and name C2' and segid D) (residue 5 and name C3' and segid D) 1 -26 13 2 !t1
assign (residue 5 and name C1' and segid D) (residue 5 and name C2' and segid D) 
(residue 5 and name C3' and segid D) (residue 5 and name C4' and segid D) 1 33 7 2 !t2
assign (residue 5 and name C2' and segid D) (residue 5 and name C3' and segid D) 
(residue 5 and name C4' and segid D) (residue 5 and name O4' and segid D) 1 -26 13 2 !t3
assign (residue 5 and name C3' and segid D) (residue 5 and name C4' and segid D) 
(residue 5 and name O4' and segid D) (residue 5 and name C1' and segid D) 1 10 20 2 !t4
assign (residue 6 and name C4' and segid D) (residue 6 and name O4' and segid D) 
(residue 6 and name C1' and segid D) (residue 6 and name C2' and segid D) 1 10 20 2 !t0
assign (residue 6 and name O4' and segid D) (residue 6 and name C1' and segid D)
(residue 6 and name C2' and segid D) (residue 6 and name C3' and segid D) 1 -26 13 2 !t1
assign (residue 6 and name C1' and segid D) (residue 6 and name C2' and segid D) 
(residue 6 and name C3' and segid D) (residue 6 and name C4' and segid D) 1 33 7 2 !t2
assign (residue 6 and name C2' and segid D) (residue 6 and name C3' and segid D) 
(residue 6 and name C4' and segid D) (residue 6 and name O4' and segid D) 1 -26 13 2 !t3
assign (residue 6 and name C3' and segid D) (residue 6 and name C4' and segid D) 
(residue 6 and name O4' and segid D) (residue 6 and name C1' and segid D) 1 10 20 2 !t4






  Entry H atom name         Submitted Coord H atom name
    1   1H5*    U   1          1H5*        U   0 -21.111  -3.817  -6.048
    2   2H5*    U   1          2H5*        U   0 -19.955  -4.202  -7.339
    3    H4*    U   1           H4*        U   0 -20.434  -1.847  -7.465
    4    H3*    U   1           H3*        U   0 -17.789  -2.811  -6.670
    5    H2*    U   1          2H2*        U   0 -17.071  -1.111  -5.409
    6   2HO*    U   1          H2*         U   0 -16.806   0.680  -6.425
    7    H1*    U   1           H1*        U   0 -19.403   0.421  -4.981
    8    H3     U   1           H3         U   0 -17.172   0.193  -1.021
    9    H5     U   1           H5         U   0 -18.722  -3.681  -1.593
   10    H6     U   1           H6         U   0 -19.449  -2.995  -3.803
   11    H5T    U   1           H5T        U   0 -18.987  -5.120  -5.697
   12   1H5*    C   2          1H5*        C   0 -13.922  -1.284  -7.982
   13   2H5*    C   2          2H5*        C   0 -15.111  -1.626  -6.709
   14    H4*    C   2           H4*        C   0 -14.362   1.223  -7.352
   15    H3*    C   2           H3*        C   0 -12.711  -0.842  -5.965
   16    H2*    C   2          2H2*        C   0 -12.321   0.371  -4.080
   17   2HO*    C   2          H2*         C   0 -11.505   2.258  -4.727
   18    H1*    C   2           H1*        C   0 -14.651   1.868  -3.950
   19   1H4     C   2          1HN4        C   0 -14.968  -3.913  -0.646
   20   2H4     C   2          2HN4        C   0 -14.632  -2.676   0.542
   21    H5     C   2           H5         C   0 -15.268  -3.420  -3.001
   22    H6     C   2           H6         C   0 -15.047  -1.693  -4.732
   23   1H5*    C   3          1H5*        C   0  -8.836   2.028  -7.549
   24   2H5*    C   3          2H5*        C   0  -9.997   1.349  -6.389
   25    H4*    C   3           H4*        C   0  -9.464   4.177  -5.874
   26    H3*    C   3           H3*        C   0  -7.139   2.353  -6.271
   27    H2*    C   3          2H2*        C   0  -6.214   2.750  -4.179
   28   2HO*    C   3          H2*         C   0  -6.073   4.873  -3.861
   29    H1*    C   3           H1*        C   0  -8.460   3.306  -2.689
   30   1H4     C   3          1HN4        C   0  -7.345  -3.226  -2.492
   31   2H4     C   3          2HN4        C   0  -7.412  -2.665  -0.828
   32    H5     C   3           H5         C   0  -7.503  -1.774  -4.385
   33    H6     C   3           H6         C   0  -7.803   0.533  -5.132
   34   1H5*    C   4          1H5*        C   0  -3.083   4.236  -6.728
   35   2H5*    C   4          2H5*        C   0  -3.151   2.733  -5.787
   36    H4*    C   4           H4*        C   0  -2.826   5.518  -4.595
   37    H3*    C   4           H3*        C   0  -0.886   3.588  -5.665
   38    H2*    C   4          2H2*        C   0   0.251   3.126  -3.744
   39   2HO*    C   4          H2*         C   0   0.768   5.423  -3.545
   40    H1*    C   4           H1*        C   0  -1.569   3.807  -1.754
   41   1H4     C   4          1HN4        C   0  -1.434  -2.701  -3.080
   42   2H4     C   4          2HN4        C   0  -1.481  -2.518  -1.341
   43    H5     C   4           H5         C   0  -1.450  -0.836  -4.599
   44    H6     C   4           H6         C   0  -1.523   1.600  -4.783
   45   1H5*    C   5          1H5*        C   0   3.830   5.904  -5.363
   46   2H5*    C   5          2H5*        C   0   3.037   4.408  -4.829
   47    H4*    C   5           H4*        C   0   3.375   6.649  -2.849
   48    H3*    C   5           H3*        C   0   5.560   5.107  -4.126
   49    H2*    C   5          2H2*        C   0   6.405   4.180  -2.241
   50   2HO*    C   5          H2*         C   0   6.715   6.247  -1.303
   51    H1*    C   5           H1*        C   0   4.191   4.151  -0.561
   52   1H4     C   5          1HN4        C   0   4.674  -1.655  -3.735
   53   2H4     C   5          2HN4        C   0   4.840  -1.983  -2.024
   54    H5     C   5           H5         C   0   4.457   0.571  -4.634
   55    H6     C   5           H6         C   0   4.326   2.951  -4.085
   56   1H5*    C   6          1H5*        C   0   9.901   8.014  -2.845
   57   2H5*    C   6          2H5*        C   0   9.905   6.259  -3.099
   58    H4*    C   6           H4*        C   0   9.950   7.698  -0.419
   59    H3*    C   6           H3*        C   0  12.016   6.624  -2.230
   60    H2*    C   6          2H2*        C   0  12.877   5.015  -0.903
   61   2HO*    C   6          H2*         C   0  12.530   5.471   1.573
   62    H1*    C   6           H1*        C   0  10.854   4.608   1.004
   63   1H4     C   6          1HN4        C   0  10.738   0.027  -3.794
   64   2H4     C   6          2HN4        C   0  10.960  -0.843  -2.287
   65    H5     C   6           H5         C   0  10.700   2.406  -3.954
   66    H6     C   6           H6         C   0  10.742   4.505  -2.703
   67    H3T    C   6           H3T        C   0  12.608   7.864   0.187
   68   1H5*    U   1          1H5*        U   0  21.163   0.120  -7.145
   69   2H5*    U   1          2H5*        U   0  20.016  -0.202  -8.462
   70    H4*    U   1           H4*        U   0  20.455  -2.288  -7.343
   71    H3*    U   1           H3*        U   0  17.825  -1.017  -7.196
   72    H2*    U   1          2H2*        U   0  17.072  -1.817  -5.250
   73   2HO*    U   1          H2*         U   0  16.788  -3.874  -5.185
   74    H1*    U   1           H1*        U   0  19.372  -2.936  -4.066
   75    H3     U   1           H3         U   0  17.151  -0.698  -0.794
   76    H5     U   1           H5         U   0  18.728   2.328  -3.260
   77    H6     U   1           H6         U   0  19.452   0.604  -4.805
   78    H5T    U   1           H5T        U   0  19.044   1.435  -7.547
   79   1H5*    C   2          1H5*        C   0  13.928  -3.086  -7.544
   80   2H5*    C   2          2H5*        C   0  15.070  -2.097  -6.611
   81    H4*    C   2           H4*        C   0  14.345  -4.887  -5.710
   82    H3*    C   2           H3*        C   0  12.715  -2.391  -5.556
   83    H2*    C   2          2H2*        C   0  12.323  -2.487  -3.317
   84   2HO*    C   2          H2*         C   0  11.514  -4.428  -2.883
   85    H1*    C   2           H1*        C   0  14.652  -3.703  -2.449
   86   1H4     C   2          1HN4        C   0  14.970   2.954  -2.601
   87   2H4     C   2          2HN4        C   0  14.606   2.509  -0.950
   88    H5     C   2           H5         C   0  15.301   1.312  -4.357
   89    H6     C   2           H6         C   0  15.086  -1.063  -4.945
   90   1H5*    C   3          1H5*        C   0   8.818  -5.604  -5.368
   91   2H5*    C   3          2H5*        C   0   9.998  -4.439  -4.730
   92    H4*    C   3           H4*        C   0   9.459  -6.580  -2.820
   93    H3*    C   3           H3*        C   0   7.131  -5.232  -4.103
   94    H2*    C   3          2H2*        C   0   6.212  -4.464  -2.110
   95   2HO*    C   3          H2*         C   0   6.050  -6.209  -0.827
   96    H1*    C   3           H1*        C   0   8.464  -4.188  -0.548
   97   1H4     C   3          1HN4        C   0   7.312   1.516  -3.732
   98   2H4     C   3          2HN4        C   0   7.387   1.889  -2.018
   99    H5     C   3           H5         C   0   7.487  -0.703  -4.612
  100    H6     C   3           H6         C   0   7.793  -3.066  -4.067
  101   1H5*    C   4          1H5*        C   0   3.085  -7.155  -3.584
  102   2H5*    C   4          2H5*        C   0   3.086  -5.381  -3.598
  103    H4*    C   4           H4*        C   0   2.800  -7.137  -1.124
  104    H3*    C   4           H3*        C   0   0.863  -5.985  -3.009
  105    H2*    C   4          2H2*        C   0  -0.236  -4.592  -1.579
  106   2HO*    C   4          H2*         C   0  -0.766  -6.465  -0.237
  107    H1*    C   4           H1*        C   0   1.610  -4.191   0.460
  108   1H4     C   4          1HN4        C   0   1.483   0.722  -4.011
  109   2H4     C   4          2HN4        C   0   1.566   1.453  -2.424
  110    H5     C   4           H5         C   0   1.469  -1.661  -4.362
  111    H6     C   4           H6         C   0   1.531  -3.848  -3.273
  112   1H5*    C   5          1H5*        C   0  -3.867  -7.645  -1.692
  113   2H5*    C   5          2H5*        C   0  -2.956  -6.135  -1.897
  114    H4*    C   5           H4*        C   0  -3.386  -7.106   0.902
  115    H3*    C   5           H3*        C   0  -5.564  -6.422  -0.985
  116    H2*    C   5          2H2*        C   0  -6.410  -4.658   0.153
  117   2HO*    C   5          H2*         C   0  -6.746  -5.961   2.002
  118    H1*    C   5           H1*        C   0  -4.216  -3.777   1.608
  119   1H4     C   5          1HN4        C   0  -4.613  -0.423  -4.113
  120   2H4     C   5          2HN4        C   0  -4.805   0.738  -2.815
  121    H5     C   5           H5         C   0  -4.410  -2.795  -3.733
  122    H6     C   5           H6         C   0  -4.301  -4.554  -2.036
  123   1H5*    C   6          1H5*        C   0  -9.812  -8.442   1.830
  124   2H5*    C   6          2H5*        C   0  -9.992  -7.149   0.629
  125    H4*    C   6           H4*        C   0  -9.962  -6.886   3.655
  126    H3*    C   6           H3*        C   0 -12.016  -6.901   1.536
  127    H2*    C   6          2H2*        C   0 -12.851  -4.825   1.813
  128   2HO*    C   6          H2*         C   0 -12.543  -3.901   4.146
  129    H1*    C   6           H1*        C   0 -10.828  -3.508   3.254
  130   1H4     C   6          1HN4        C   0 -10.674  -2.022  -3.207
  131   2H4     C   6          2HN4        C   0 -10.933  -0.511  -2.353
  132    H5     C   6           H5         C   0 -10.593  -4.155  -2.128
  133    H6     C   6           H6         C   0 -10.652  -5.324   0.023
  134    H3T    C   6           H3T        C   0 -12.659  -6.680   4.221
  135   1H5*    U   1          1H5*        U   0 -21.248   3.689   6.068
  136   2H5*    U   1          2H5*        U   0 -20.089   4.138   7.336
  137    H4*    U   1           H4*        U   0 -20.459   1.757   7.467
  138    H3*    U   1           H3*        U   0 -17.870   2.858   6.660
  139    H2*    U   1          2H2*        U   0 -17.069   1.186   5.414
  140   2HO*    U   1          H2*         U   0 -16.719  -0.593   6.430
  141    H1*    U   1           H1*        U   0 -19.317  -0.462   5.004
  142    H3     U   1           H3         U   0 -17.117  -0.189   1.037
  143    H5     U   1           H5         U   0 -18.839   3.618   1.556
  144    H6     U   1           H6         U   0 -19.529   2.933   3.781
  145    H5T    U   1           H5T        U   0 -19.094   5.050   5.736
  146   1H5*    C   2          1H5*        C   0 -13.900   1.328   8.058
  147   2H5*    C   2          2H5*        C   0 -15.034   1.711   6.747
  148    H4*    C   2           H4*        C   0 -14.296  -1.152   7.373
  149    H3*    C   2           H3*        C   0 -12.674   0.950   6.017
  150    H2*    C   2          2H2*        C   0 -12.279  -0.202   4.102
  151   2HO*    C   2          H2*         C   0 -11.406  -2.088   4.696
  152    H1*    C   2           H1*        C   0 -14.567  -1.782   3.978
  153   1H4     C   2          1HN4        C   0 -15.107   3.943   0.631
  154   2H4     C   2          2HN4        C   0 -14.694   2.711  -0.539
  155    H5     C   2           H5         C   0 -15.395   3.460   2.996
  156    H6     C   2           H6         C   0 -15.107   1.753   4.744
  157   1H5*    C   3          1H5*        C   0  -8.767  -1.859   7.403
  158   2H5*    C   3          2H5*        C   0 -10.013  -1.306   6.266
  159    H4*    C   3           H4*        C   0  -9.498  -4.131   5.877
  160    H3*    C   3           H3*        C   0  -7.112  -2.386   6.222
  161    H2*    C   3          2H2*        C   0  -6.197  -2.853   4.148
  162   2HO*    C   3          H2*         C   0  -6.109  -4.970   3.858
  163    H1*    C   3           H1*        C   0  -8.450  -3.373   2.651
  164   1H4     C   3          1HN4        C   0  -7.217   3.145   2.359
  165   2H4     C   3          2HN4        C   0  -7.280   2.566   0.703
  166    H5     C   3           H5         C   0  -7.406   1.717   4.271
  167    H6     C   3           H6         C   0  -7.753  -0.574   5.049
  168   1H5*    C   4          1H5*        C   0  -3.123  -4.389   6.711
  169   2H5*    C   4          2H5*        C   0  -3.189  -2.840   5.848
  170    H4*    C   4           H4*        C   0  -2.836  -5.566   4.534
  171    H3*    C   4           H3*        C   0  -0.929  -3.619   5.647
  172    H2*    C   4          2H2*        C   0   0.205  -3.131   3.730
  173   2HO*    C   4          H2*         C   0   0.732  -5.422   3.499
  174    H1*    C   4           H1*        C   0  -1.627  -3.804   1.745
  175   1H4     C   4          1HN4        C   0  -1.420   2.698   3.088
  176   2H4     C   4          2HN4        C   0  -1.489   2.518   1.350
  177    H5     C   4           H5         C   0  -1.424   0.827   4.604
  178    H6     C   4           H6         C   0  -1.538  -1.608   4.785
  179   1H5*    C   5          1H5*        C   0   3.822  -5.966   5.364
  180   2H5*    C   5          2H5*        C   0   3.065  -4.440   4.865
  181    H4*    C   5           H4*        C   0   3.389  -6.651   2.844
  182    H3*    C   5           H3*        C   0   5.564  -5.106   4.140
  183    H2*    C   5          2H2*        C   0   6.406  -4.164   2.259
  184   2HO*    C   5          H2*         C   0   6.725  -6.225   1.308
  185    H1*    C   5           H1*        C   0   4.189  -4.141   0.580
  186   1H4     C   5          1HN4        C   0   4.680   1.664   3.757
  187   2H4     C   5          2HN4        C   0   4.847   1.992   2.046
  188    H5     C   5           H5         C   0   4.456  -0.562   4.655
  189    H6     C   5           H6         C   0   4.321  -2.942   4.105
  190   1H5*    C   6          1H5*        C   0   9.916  -8.023   2.832
  191   2H5*    C   6          2H5*        C   0   9.926  -6.269   3.098
  192    H4*    C   6           H4*        C   0   9.973  -7.697   0.411
  193    H3*    C   6           H3*        C   0  12.031  -6.617   2.228
  194    H2*    C   6          2H2*        C   0  12.882  -4.998   0.908
  195   2HO*    C   6          H2*         C   0  12.543  -5.455  -1.573
  196    H1*    C   6           H1*        C   0  10.862  -4.602  -1.007
  197   1H4     C   6          1HN4        C   0  10.724  -0.024   3.793
  198   2H4     C   6          2HN4        C   0  10.955   0.848   2.288
  199    H5     C   6           H5         C   0  10.680  -2.402   3.950
  200    H6     C   6           H6         C   0  10.731  -4.501   2.697
  201    H3T    C   6           H3T        C   0  12.632  -7.847  -0.192
  202   1H5*    U   1          1H5*        U   0  21.140  -0.117   7.197
  203   2H5*    U   1          2H5*        U   0  19.949   0.187   8.478
  204    H4*    U   1           H4*        U   0  20.429   2.281   7.372
  205    H3*    U   1           H3*        U   0  17.797   1.015   7.202
  206    H2*    U   1          2H2*        U   0  17.059   1.826   5.256
  207   2HO*    U   1          H2*         U   0  16.779   3.885   5.200
  208    H1*    U   1           H1*        U   0  19.370   2.949   4.096
  209    H3     U   1           H3         U   0  17.163   0.741   0.792
  210    H5     U   1           H5         U   0  18.730  -2.307   3.240
  211    H6     U   1           H6         U   0  19.442  -0.595   4.806
  212    H5T    U   1           H5T        U   0  19.057  -1.476   7.509
  213   1H5*    C   2          1H5*        C   0  13.911   3.039   7.531
  214   2H5*    C   2          2H5*        C   0  15.083   2.085   6.599
  215    H4*    C   2           H4*        C   0  14.339   4.875   5.719
  216    H3*    C   2           H3*        C   0  12.705   2.383   5.550
  217    H2*    C   2          2H2*        C   0  12.322   2.483   3.310
  218   2HO*    C   2          H2*         C   0  11.508   4.426   2.888
  219    H1*    C   2           H1*        C   0  14.651   3.707   2.450
  220   1H4     C   2          1HN4        C   0  14.975  -2.949   2.580
  221   2H4     C   2          2HN4        C   0  14.616  -2.499   0.930
  222    H5     C   2           H5         C   0  15.297  -1.314   4.343
  223    H6     C   2           H6         C   0  15.075   1.058   4.939
  224   1H5*    C   3          1H5*        C   0   8.810   5.606   5.382
  225   2H5*    C   3          2H5*        C   0   9.988   4.440   4.746
  226    H4*    C   3           H4*        C   0   9.454   6.585   2.837
  227    H3*    C   3           H3*        C   0   7.125   5.230   4.113
  228    H2*    C   3          2H2*        C   0   6.211   4.461   2.117
  229   2HO*    C   3          H2*         C   0   6.052   6.210   0.835
  230    H1*    C   3           H1*        C   0   8.466   4.188   0.560
  231   1H4     C   3          1HN4        C   0   7.317  -1.510   3.754
  232   2H4     C   3          2HN4        C   0   7.392  -1.886   2.040
  233    H5     C   3           H5         C   0   7.493   0.709   4.630
  234    H6     C   3           H6         C   0   7.799   3.072   4.082
  235   1H5*    C   4          1H5*        C   0   3.083   7.128   3.602
  236   2H5*    C   4          2H5*        C   0   3.094   5.354   3.608
  237    H4*    C   4           H4*        C   0   2.799   7.116   1.140
  238    H3*    C   4           H3*        C   0   0.867   5.964   3.029
  239    H2*    C   4          2H2*        C   0  -0.235   4.570   1.601
  240   2HO*    C   4          H2*         C   0  -0.757   6.453   0.257
  241    H1*    C   4           H1*        C   0   1.605   4.168  -0.441
  242   1H4     C   4          1HN4        C   0   1.467  -0.738   4.033
  243   2H4     C   4          2HN4        C   0   1.541  -1.471   2.447
  244    H5     C   4           H5         C   0   1.476   1.643   4.383
  245    H6     C   4           H6         C   0   1.544   3.830   3.294
  246   1H5*    C   5          1H5*        C   0  -3.870   7.923   1.563
  247   2H5*    C   5          2H5*        C   0  -3.128   6.344   1.894
  248    H4*    C   5           H4*        C   0  -3.453   7.295  -0.953
  249    H3*    C   5           H3*        C   0  -5.594   6.485   0.934
  250    H2*    C   5          2H2*        C   0  -6.391   4.742  -0.275
  251   2HO*    C   5          H2*         C   0  -6.722   6.081  -2.100
  252    H1*    C   5           H1*        C   0  -4.148   3.941  -1.687
  253   1H4     C   5          1HN4        C   0  -4.550   0.582   4.022
  254   2H4     C   5          2HN4        C   0  -4.639  -0.584   2.721
  255    H5     C   5           H5         C   0  -4.422   2.961   3.649
  256    H6     C   5           H6         C   0  -4.342   4.721   1.954
  257   1H5*    C   6          1H5*        C   0 -10.009   8.278  -1.599
  258   2H5*    C   6          2H5*        C   0  -9.966   6.893  -0.491
  259    H4*    C   6           H4*        C   0  -9.993   6.762  -3.530
  260    H3*    C   6           H3*        C   0 -12.081   6.749  -1.447
  261    H2*    C   6          2H2*        C   0 -12.910   4.676  -1.766
  262   2HO*    C   6          H2*         C   0 -12.546   3.799  -4.120
  263    H1*    C   6           H1*        C   0 -10.854   3.378  -3.184
  264   1H4     C   6          1HN4        C   0 -10.827   1.817   3.270
  265   2H4     C   6          2HN4        C   0 -11.038   0.321   2.392
  266    H5     C   6           H5         C   0 -10.773   3.970   2.214
  267    H6     C   6           H6         C   0 -10.782   5.157   0.075
  268    H3T    C   6           H3T        C   0 -12.667   6.561  -4.152