*HEADER    COMPLEX (DEOXYRIBONUCLEIC ACID/DRUG)    10-AUG-96   1DSD      
*TITLE     NMR STUDY OF DNA (5'-D(*GP*AP*TP*GP*CP*TP*TP*C)-3') T:T       
*TITLE    2 MISMATCHED DUPLEX COMPLEXED WITH ACTINOMYCIN D, MINIMIZED    
*TITLE    3 AVERAGE STRUCTURE                                            
*COMPND    MOL_ID: 1;                                                    
*COMPND   2 MOLECULE: DNA (5'-D(*GP*AP*TP*GP*CP*TP*TP*C)-3') T\:T        
*COMPND   3 MISMATCHED DUPLEX;                                           
*COMPND   4 CHAIN: A, B;                                                 
*COMPND   5 ENGINEERED: YES;                                             
*COMPND   6 MOL_ID: 2;                                                   
*COMPND   7 MOLECULE: ACTINOMYCIN D;                                     
*COMPND   8 CHAIN: C;                                                    
*COMPND   9 OTHER_DETAILS: ACTINOMYCIN D IS AN INTERCALATOR              
*SOURCE    MOL_ID: 1;                                                    
*SOURCE   2 SYNTHETIC: YES;                                              
*SOURCE   3 MOL_ID: 2;                                                   
*SOURCE   4 ORGANISM_SCIENTIFIC: STREPTOMYCES SP.                        
*KEYWDS    COMPLEX (DEOXYRIBONUCLEIC ACID/DRUG), DNA, T:T MISMATCH       
*EXPDTA    NMR, MINIMIZED AVERAGE STRUCTURE                              
*AUTHOR    C.LIAN,H.ROBINSON,A.H.-J.WANG                                 
*REVDAT   1   12-OCT-04 1DSD    0   

assign
 (resid 1 and name H5'') (resid 1 and name H4') 2.82 0.50 0.90
assign
 (resid 1 and name H5'') (resid 1 and name H3') 2.73 0.50 0.90
assign
 (resid 1 and name H5'') (resid 1 and name H2') 3.43 0.50 0.90
assign
 (resid 1 and name H5'') (resid 1 and name H2'') 4.52 1.30 1.70
assign
 (resid 1 and name H5'') (resid 1 and name H1') 4.86 1.30 1.70
assign
 (resid 1 and name H5'') (resid 1 and name H8) 4.50 1.30 1.70
assign
 (resid 1 and name H5') (resid 1 and name H4') 2.74 0.50 0.90
assign
 (resid 1 and name H5') (resid 1 and name H3') 3.92 0.80 1.30
assign
 (resid 1 and name H5') (resid 1 and name H2') 3.65 0.80 1.30
assign
 (resid 1 and name H5') (resid 1 and name H2'') 4.87 1.30 1.70
assign
 (resid 1 and name H5') (resid 1 and name H1') 4.52 1.30 1.70
assign
 (resid 1 and name H5') (resid 1 and name H8) 3.66 0.80 1.30
assign
 (resid 1 and name H4') (resid 1 and name H3') 2.95 0.50 0.90
assign
 (resid 1 and name H4') (resid 1 and name H2') 3.81 0.80 1.30
assign
 (resid 1 and name H4') (resid 1 and name H2'') 3.94 0.80 1.30
assign
 (resid 1 and name H4') (resid 1 and name H1') 3.19 0.50 0.90
assign
 (resid 1 and name H4') (resid 1 and name H8) 4.29 0.80 1.30
assign
 (resid 1 and name H4') (resid 2 and name H5'') 5.36 1.30 1.70
assign
 (resid 1 and name H4') (resid 2 and name H5') 4.68 1.30 1.70
assign
 (resid 1 and name H4') (resid 2 and name H8) 5.86 2.00 2.00
assign
 (resid 1 and name H3') (resid 1 and name H2') 2.48 0.50 0.90
assign
 (resid 1 and name H3') (resid 1 and name H2'') 2.76 0.50 0.90
assign
 (resid 1 and name H3') (resid 1 and name H1') 3.81 0.80 1.30
assign
 (resid 1 and name H3') (resid 1 and name H8) 4.32 0.80 1.30
assign
 (resid 1 and name H3') (resid 2 and name H5'') 5.43 1.30 1.70
assign
 (resid 1 and name H3') (resid 2 and name H5') 5.12 1.30 1.70
assign
 (resid 1 and name H3') (resid 2 and name H2') 5.87 2.00 2.00
assign
 (resid 1 and name H3') (resid 2 and name H8) 4.91 1.30 1.70
assign
 (resid 1 and name H3') (resid 3 and (name H51 or name H52 or name H53)) 5.32 1.30 1.70
assign
 (resid 1 and name H2') (resid 1 and name H1') 3.14 0.50 0.90
assign
 (resid 1 and name H2') (resid 1 and name H8) 2.43 0.50 0.90
assign
 (resid 1 and name H2') (resid 2 and name H5'') 6.39 2.00 2.00
assign
 (resid 1 and name H2') (resid 2 and name H5') 5.30 1.30 1.70
assign
 (resid 1 and name H2') (resid 2 and name H2') 6.02 2.00 2.00
assign
 (resid 1 and name H2') (resid 2 and name H2'') 7.27 2.00 2.00
assign
 (resid 1 and name H2') (resid 2 and name H8) 4.35 0.80 1.30
assign
 (resid 1 and name H2') (resid 3 and (name H51 or name H52 or name H53)) 5.03 1.30 1.70
assign
 (resid 1 and name H2'') (resid 1 and name H1') 2.51 0.50 0.90
assign
 (resid 1 and name H2'') (resid 1 and name H8) 3.75 0.80 1.30
assign
 (resid 1 and name H2'') (resid 2 and name H5'') 4.44 0.80 1.30
assign
 (resid 1 and name H2'') (resid 2 and name H5') 3.94 0.80 1.30
assign
 (resid 1 and name H2'') (resid 2 and name H4') 5.11 1.30 1.70
assign
 (resid 1 and name H2'') (resid 2 and name H3') 5.27 1.30 1.70
assign
 (resid 1 and name H2'') (resid 2 and name H2') 4.20 0.80 1.30
assign
 (resid 1 and name H2'') (resid 2 and name H2'') 5.74 2.00 2.00
assign
 (resid 1 and name H2'') (resid 2 and name H1') 5.56 2.00 2.00
assign
 (resid 1 and name H2'') (resid 2 and name H8) 2.67 0.50 0.90
assign
 (resid 1 and name H2'') (resid 3 and (name H51 or name H52 or name H53)) 4.13 0.80 1.30
assign
 (resid 1 and name H2'') (resid 3 and name H6) 6.05 2.00 2.00
assign
 (resid 1 and name H1') (resid 1 and name H8) 3.39 0.50 0.90
assign
 (resid 1 and name H1') (resid 2 and name H5'') 4.27 0.80 1.30
assign
 (resid 1 and name H1') (resid 2 and name H5') 3.28 0.50 0.90
assign
 (resid 1 and name H1') (resid 2 and name H4') 4.70 1.30 1.70
assign
 (resid 1 and name H1') (resid 2 and name H3') 4.88 1.30 1.70
assign
 (resid 1 and name H1') (resid 2 and name H2') 5.34 1.30 1.70
assign
 (resid 1 and name H1') (resid 2 and name H2'') 6.68 2.00 2.00
assign
 (resid 1 and name H1') (resid 2 and name H8) 3.55 0.80 1.30
assign
 (resid 1 and name H1') (resid 3 and (name H51 or name H52 or name H53)) 6.29 2.00 2.00
assign
 (resid 1 and name H8) (resid 2 and name H8) 5.03 1.30 1.70
assign
 (resid 2 and name H5'') (resid 2 and name H4') 2.43 0.50 0.90
assign
 (resid 2 and name H5'') (resid 2 and name H3') 2.62 0.50 0.90
assign
 (resid 2 and name H5'') (resid 2 and name H2') 3.65 0.80 1.30
assign
 (resid 2 and name H5'') (resid 2 and name H2'') 4.56 1.30 1.70
assign
 (resid 2 and name H5'') (resid 2 and name H1') 4.99 1.30 1.70
assign
 (resid 2 and name H5'') (resid 2 and name H8) 4.26 0.80 1.30
assign
 (resid 2 and name H5'') (resid 3 and name H5') 6.05 2.00 2.00
assign
 (resid 2 and name H5'') (resid 3 and (name H51 or name H52 or name H53)) 5.19 1.30 1.70
assign
 (resid 2 and name H5'') (resid 3 and name H6) 5.70 2.00 2.00
assign
 (resid 2 and name H5') (resid 2 and name H4') 2.47 0.50 0.90
assign
 (resid 2 and name H5') (resid 2 and name H3') 3.55 0.80 1.30
assign
 (resid 2 and name H5') (resid 2 and name H2') 3.89 0.80 1.30
assign
 (resid 2 and name H5') (resid 2 and name H2'') 4.72 1.30 1.70
assign
 (resid 2 and name H5') (resid 2 and name H1') 4.58 1.30 1.70
assign
 (resid 2 and name H5') (resid 2 and name H8) 3.90 0.80 1.30
assign
 (resid 2 and name H5') (resid 3 and (name H51 or name H52 or name H53)) 5.58 2.00 2.00
assign
 (resid 2 and name H4') (resid 2 and name H3') 2.71 0.50 0.90
assign
 (resid 2 and name H4') (resid 2 and name H2') 3.51 0.80 1.30
assign
 (resid 2 and name H4') (resid 2 and name H2'') 3.68 0.80 1.30
assign
 (resid 2 and name H4') (resid 2 and name H1') 3.19 0.50 0.90
assign
 (resid 2 and name H4') (resid 2 and name H8) 4.38 0.80 1.30
assign
 (resid 2 and name H4') (resid 3 and name H5'') 5.49 1.30 1.70
assign
 (resid 2 and name H4') (resid 3 and name H5') 4.17 0.80 1.30
assign
 (resid 2 and name H4') (resid 3 and (name H51 or name H52 or name H53)) 5.91 2.00 2.00
assign
 (resid 2 and name H4') (resid 3 and name H6) 5.55 2.00 2.00
assign
 (resid 2 and name H3') (resid 2 and name H2') 2.42 0.50 0.90
assign
 (resid 2 and name H3') (resid 2 and name H2'') 2.83 0.50 0.90
assign
 (resid 2 and name H3') (resid 2 and name H1') 3.79 0.80 1.30
assign
 (resid 2 and name H3') (resid 2 and name H8) 4.16 0.80 1.30
assign
 (resid 2 and name H3') (resid 3 and name H5'') 5.05 1.30 1.70
assign
 (resid 2 and name H3') (resid 3 and name H5') 3.85 0.80 1.30
assign
 (resid 2 and name H3') (resid 3 and name H4') 5.07 1.30 1.70
assign
 (resid 2 and name H3') (resid 3 and name H3') 4.08 0.80 1.30
assign
 (resid 2 and name H3') (resid 3 and name H2') 6.75 2.00 2.00
assign
 (resid 2 and name H3') (resid 3 and name H1') 4.95 1.30 1.70
assign
 (resid 2 and name H3') (resid 3 and (name H51 or name H52 or name H53)) 4.78 1.30 1.70
assign
 (resid 2 and name H3') (resid 3 and name H6) 4.41 0.80 1.30
assign
 (resid 2 and name H2') (resid 2 and name H1') 3.01 0.50 0.90
assign
 (resid 2 and name H2') (resid 2 and name H8) 2.36 0.50 0.90
assign
 (resid 2 and name H2') (resid 3 and name H5'') 5.13 1.30 1.70
assign
 (resid 2 and name H2') (resid 3 and name H5') 4.36 0.80 1.30
assign
 (resid 2 and name H2') (resid 3 and name H4') 4.85 1.30 1.70
assign
 (resid 2 and name H2') (resid 3 and name H3') 4.08 0.80 1.30
assign
 (resid 2 and name H2') (resid 3 and name H2') 5.08 1.30 1.70
assign
 (resid 2 and name H2') (resid 3 and name H2'') 5.68 2.00 2.00
assign
 (resid 2 and name H2') (resid 3 and name H1') 4.93 1.30 1.70
assign
 (resid 2 and name H2') (resid 3 and (name H51 or name H52 or name H53)) 3.28 0.50 0.90
assign
 (resid 2 and name H2') (resid 3 and name H6) 2.92 0.50 0.90
assign
 (resid 2 and name H2'') (resid 2 and name H1') 2.41 0.50 0.90
assign
 (resid 2 and name H2'') (resid 2 and name H8) 3.74 0.80 1.30
assign
 (resid 2 and name H2'') (resid 3 and name H5'') 3.41 0.50 0.90
assign
 (resid 2 and name H2'') (resid 3 and name H5') 2.65 0.50 0.90
assign
 (resid 2 and name H2'') (resid 3 and name H4') 3.25 0.50 0.90
assign
 (resid 2 and name H2'') (resid 3 and name H3') 2.86 0.50 0.90
assign
 (resid 2 and name H2'') (resid 3 and name H2') 4.26 0.80 1.30
assign
 (resid 2 and name H2'') (resid 3 and name H2'') 4.46 0.80 1.30
assign
 (resid 2 and name H2'') (resid 3 and name H1') 3.65 0.80 1.30
assign
 (resid 2 and name H2'') (resid 3 and (name H51 or name H52 or name H53)) 4.31 0.80 1.30
assign
 (resid 2 and name H2'') (resid 3 and name H6) 2.73 0.50 0.90
assign
 (resid 2 and name H2'') (resid 4 and name H5'') 5.31 1.30 1.70
assign
 (resid 2 and name H2'') (resid 4 and name H5') 5.02 1.30 1.70
assign
 (resid 2 and name H1') (resid 2 and name H2) 4.82 1.30 1.70
assign
 (resid 2 and name H1') (resid 2 and name H8) 3.45 0.50 0.90
assign
 (resid 2 and name H1') (resid 3 and name H5'') 4.45 0.80 1.30
assign
 (resid 2 and name H1') (resid 3 and name H5') 2.76 0.50 0.90
assign
 (resid 2 and name H1') (resid 3 and name H4') 3.63 0.80 1.30
assign
 (resid 2 and name H1') (resid 3 and name H3') 4.26 0.80 1.30
assign
 (resid 2 and name H1') (resid 3 and name H2') 5.32 1.30 1.70
assign
 (resid 2 and name H1') (resid 3 and name H2'') 4.71 1.30 1.70
assign
 (resid 2 and name H1') (resid 3 and name H1') 3.53 0.80 1.30
assign
 (resid 2 and name H1') (resid 3 and (name H51 or name H52 or name H53)) 5.14 1.30 1.70
assign
 (resid 2 and name H1') (resid 3 and name H6) 4.09 0.80 1.30
assign
 (resid 2 and name H1') (resid 4 and name H5'') 6.22 2.00 2.00
assign
 (resid 2 and name H1') (resid 4 and name H5') 5.95 2.00 2.00
assign
 (resid 2 and name H2) (resid 3 and name H4') 4.76 1.30 1.70
assign
 (resid 2 and name H2) (resid 3 and name H2'') 5.36 1.30 1.70
assign
 (resid 2 and name H2) (resid 3 and name H1') 4.02 0.80 1.30
assign
 (resid 2 and name H2) (resid 15 and name H1') 4.37 0.80 1.30
assign
 (resid 2 and name H2) (resid 16 and name H1') 4.30 0.80 1.30
assign
 (resid 2 and name H2) (resid 21 and (name HNA or name HNB or name HNC)) 5.69 2.00 2.00
assign
 (resid 2 and name H2) (resid 21 and name HA1) 4.38 0.80 1.30
assign
 (resid 2 and name H2) (resid 21 and name HA2) 5.69 2.00 2.00
assign
 (resid 2 and name H2) (resid 22 and (name HNA or name HNB or name HNC)) 4.81 1.30 1.70
assign
 (resid 2 and name H2) (resid 22 and name HA) 5.62 2.00 2.00
assign
 (resid 2 and name H2) (resid 22 and name HB) 4.32 0.80 1.30
assign
 (resid 2 and name H2) (resid 22 and (name H1A or name H1B or name H1C)) 5.06 1.30 1.70
assign
 (resid 2 and name H2) (resid 22 and (name H2A or name H2B or name H2C)) 6.86 2.00 2.00
assign
 (resid 2 and name H8) (resid 3 and name H5'') 6.43 2.00 2.00
assign
 (resid 2 and name H8) (resid 3 and name H5') 5.51 2.00 2.00
assign
 (resid 2 and name H8) (resid 3 and name H3') 6.09 2.00 2.00
assign
 (resid 2 and name H8) (resid 3 and name H2') 7.22 2.00 2.00
assign
 (resid 2 and name H8) (resid 3 and name H1') 5.54 2.00 2.00
assign
 (resid 2 and name H8) (resid 3 and (name H51 or name H52 or name H53)) 3.45 0.50 0.90
assign
 (resid 2 and name H8) (resid 3 and name H6) 4.20 0.80 1.30
assign
 (resid 3 and name H5'') (resid 3 and name H4') 2.27 0.50 0.90
assign
 (resid 3 and name H5'') (resid 3 and name H3') 2.72 0.50 0.90
assign
 (resid 3 and name H5'') (resid 3 and name H2') 4.83 1.30 1.70
assign
 (resid 3 and name H5'') (resid 3 and name H2'') 4.55 1.30 1.70
assign
 (resid 3 and name H5'') (resid 3 and name H1') 4.56 1.30 1.70
assign
 (resid 3 and name H5'') (resid 3 and (name H51 or name H52 or name H53)) 6.37 2.00 2.00
assign
 (resid 3 and name H5'') (resid 3 and name H6) 4.58 1.30 1.70
assign
 (resid 3 and name H5'') (resid 4 and name H5'') 3.62 0.80 1.30
assign
 (resid 3 and name H5'') (resid 4 and name H5') 3.52 0.80 1.30
assign
 (resid 3 and name H5'') (resid 4 and name H4') 5.59 2.00 2.00
assign
 (resid 3 and name H5'') (resid 4 and name H3') 4.61 1.30 1.70
assign
 (resid 3 and name H5'') (resid 4 and name H8) 5.43 1.30 1.70
assign
 (resid 3 and name H5'') (resid 22 and (name HNA or name HNB or name HNC)) 6.90 2.00 2.00
assign
 (resid 3 and name H5'') (resid 22 and name HA) 5.89 2.00 2.00
assign
 (resid 3 and name H5'') (resid 22 and name HB) 5.01 1.30 1.70
assign
 (resid 3 and name H5'') (resid 22 and (name H1A or name H1B or name H1C)) 7.50 2.00 2.00
assign
 (resid 3 and name H5'') (resid 22 and (name H2A or name H2B or name H2C)) 5.74 2.00 2.00
assign
 (resid 3 and name H5') (resid 3 and name H4') 2.38 0.50 0.90
assign
 (resid 3 and name H5') (resid 3 and name H3') 3.19 0.50 0.90
assign
 (resid 3 and name H5') (resid 3 and name H2') 5.01 1.30 1.70
assign
 (resid 3 and name H5') (resid 3 and name H2'') 4.79 1.30 1.70
assign
 (resid 3 and name H5') (resid 3 and name H1') 4.24 0.80 1.30
assign
 (resid 3 and name H5') (resid 3 and (name H51 or name H52 or name H53)) 6.07 2.00 2.00
assign
 (resid 3 and name H5') (resid 3 and name H6) 4.53 1.30 1.70
assign
 (resid 3 and name H5') (resid 4 and name H5'') 4.48 0.80 1.30
assign
 (resid 3 and name H5') (resid 4 and name H5') 4.58 1.30 1.70
assign
 (resid 3 and name H5') (resid 4 and name H4') 6.90 2.00 2.00
assign
 (resid 3 and name H5') (resid 4 and name H3') 5.85 2.00 2.00
assign
 (resid 3 and name H5') (resid 22 and (name HNA or name HNB or name HNC)) 7.32 2.00 2.00
assign
 (resid 3 and name H5') (resid 22 and name HA) 6.76 2.00 2.00
assign
 (resid 3 and name H5') (resid 22 and name HB) 4.97 1.30 1.70
assign
 (resid 3 and name H5') (resid 22 and (name H1A or name H1B or name H1C)) 7.13 2.00 2.00
assign
 (resid 3 and name H5') (resid 22 and (name H2A or name H2B or name H2C)) 6.51 2.00 2.00
assign
 (resid 3 and name H4') (resid 3 and name H3') 2.76 0.50 0.90
assign
 (resid 3 and name H4') (resid 3 and name H2') 3.77 0.80 1.30
assign
 (resid 3 and name H4') (resid 3 and name H2'') 2.96 0.50 0.90
assign
 (resid 3 and name H4') (resid 3 and name H1') 2.60 0.50 0.90
assign
 (resid 3 and name H4') (resid 3 and (name H51 or name H52 or name H53)) 6.11 2.00 2.00
assign
 (resid 3 and name H4') (resid 3 and name H6) 3.99 0.80 1.30
assign
 (resid 3 and name H4') (resid 4 and name H5'') 2.32 0.50 0.90
assign
 (resid 3 and name H4') (resid 4 and name H5') 2.66 0.50 0.90
assign
 (resid 3 and name H4') (resid 4 and name H4') 5.03 1.30 1.70
assign
 (resid 3 and name H4') (resid 4 and name H3') 4.53 1.30 1.70
assign
 (resid 3 and name H4') (resid 4 and name H2') 6.04 2.00 2.00
assign
 (resid 3 and name H4') (resid 4 and name H8) 5.05 1.30 1.70
assign
 (resid 3 and name H4') (resid 22 and (name HNA or name HNB or name HNC)) 4.74 1.30 1.70
assign
 (resid 3 and name H4') (resid 22 and name HA) 3.99 0.80 1.30
assign
 (resid 3 and name H4') (resid 22 and name HB) 3.35 0.50 0.90
assign
 (resid 3 and name H4') (resid 22 and (name H1A or name H1B or name H1C)) 5.53 2.00 2.00
assign
 (resid 3 and name H4') (resid 22 and (name H2A or name H2B or name H2C)) 4.57 1.30 1.70
assign
 (resid 3 and name H3') (resid 3 and name H2') 2.48 0.50 0.90
assign
 (resid 3 and name H3') (resid 3 and name H2'') 3.08 0.50 0.90
assign
 (resid 3 and name H3') (resid 3 and name H1') 3.60 0.80 1.30
assign
 (resid 3 and name H3') (resid 3 and (name H51 or name H52 or name H53)) 5.25 1.30 1.70
assign
 (resid 3 and name H3') (resid 3 and name H6) 2.69 0.50 0.90
assign
 (resid 3 and name H3') (resid 4 and name H5'') 3.90 0.80 1.30
assign
 (resid 3 and name H3') (resid 4 and name H5') 3.10 0.50 0.90
assign
 (resid 3 and name H3') (resid 4 and name H4') 5.56 2.00 2.00
assign
 (resid 3 and name H3') (resid 4 and name H3') 4.39 0.80 1.30
assign
 (resid 3 and name H3') (resid 4 and name H2') 5.48 1.30 1.70
assign
 (resid 3 and name H3') (resid 4 and name H8) 3.78 0.80 1.30
assign
 (resid 3 and name H3') (resid 22 and (name HNA or name HNB or name HNC)) 6.49 2.00 2.00
assign
 (resid 3 and name H3') (resid 22 and name HA) 5.03 1.30 1.70
assign
 (resid 3 and name H3') (resid 22 and name HB) 5.48 1.30 1.70
assign
 (resid 3 and name H3') (resid 22 and (name H2A or name H2B or name H2C)) 5.99 2.00 2.00
assign
 (resid 3 and name H2') (resid 3 and name H1') 3.13 0.50 0.90
assign
 (resid 3 and name H2') (resid 3 and (name H51 or name H52 or name H53)) 5.03 1.30 1.70
assign
 (resid 3 and name H2') (resid 3 and name H6) 2.52 0.50 0.90
assign
 (resid 3 and name H2') (resid 4 and name H5'') 4.69 1.30 1.70
assign
 (resid 3 and name H2') (resid 4 and name H5') 3.99 0.80 1.30
assign
 (resid 3 and name H2') (resid 4 and name H4') 6.41 2.00 2.00
assign
 (resid 3 and name H2') (resid 4 and name H3') 5.01 1.30 1.70
assign
 (resid 3 and name H2') (resid 4 and name H2') 4.86 1.30 1.70
assign
 (resid 3 and name H2') (resid 4 and name H2'') 5.89 2.00 2.00
assign
 (resid 3 and name H2') (resid 4 and name H1') 5.84 2.00 2.00
assign
 (resid 3 and name H2') (resid 4 and name H8) 3.27 0.50 0.90
assign
 (resid 3 and name H2') (resid 17 and (name H4A or name H4B or name H4C)) 4.87 1.30 1.70
assign
 (resid 3 and name H2') (resid 22 and (name HNA or name HNB or name HNC)) 5.20 1.30 1.70
assign
 (resid 3 and name H2') (resid 22 and name HA) 5.03 1.30 1.70
assign
 (resid 3 and name H2') (resid 22 and name HB) 5.65 2.00 2.00
assign
 (resid 3 and name H2') (resid 22 and (name H1A or name H1B or name H1C)) 8.27 2.00 2.00
assign
 (resid 3 and name H2') (resid 22 and (name H2A or name H2B or name H2C)) 7.44 2.00 2.00
assign
 (resid 3 and name H2'') (resid 3 and name H1') 2.21 0.50 0.90
assign
 (resid 3 and name H2'') (resid 3 and (name H51 or name H52 or name H53)) 5.47 1.30 1.70
assign
 (resid 3 and name H2'') (resid 3 and name H6) 3.69 0.80 1.30
assign
 (resid 3 and name H2'') (resid 4 and name H5'') 3.32 0.50 0.90
assign
 (resid 3 and name H2'') (resid 4 and name H5') 2.94 0.50 0.90
assign
 (resid 3 and name H2'') (resid 4 and name H4') 5.22 1.30 1.70
assign
 (resid 3 and name H2'') (resid 4 and name H3') 4.45 0.80 1.30
assign
 (resid 3 and name H2'') (resid 4 and name H2') 4.64 1.30 1.70
assign
 (resid 3 and name H2'') (resid 4 and name H2'') 5.22 1.30 1.70
assign
 (resid 3 and name H2'') (resid 4 and name H1') 4.76 1.30 1.70
assign
 (resid 3 and name H2'') (resid 4 and name H8) 3.50 0.80 1.30
assign
 (resid 3 and name H2'') (resid 17 and (name H4A or name H4B or name H4C)) 5.83 2.00 2.00
assign
 (resid 3 and name H2'') (resid 22 and (name HNA or name HNB or name HNC)) 3.55 0.80 1.30
assign
 (resid 3 and name H2'') (resid 22 and name HA) 3.35 0.50 0.90
assign
 (resid 3 and name H2'') (resid 22 and name HB) 3.74 0.80 1.30
assign
 (resid 3 and name H2'') (resid 22 and (name H1A or name H1B or name H1C)) 6.11 2.00 2.00
assign
 (resid 3 and name H2'') (resid 22 and (name H2A or name H2B or name H2C)) 5.47 1.30 1.70
assign
 (resid 3 and name H1') (resid 3 and (name H51 or name H52 or name H53)) 5.32 1.30 1.70
assign
 (resid 3 and name H1') (resid 3 and name H6) 3.33 0.50 0.90
assign
 (resid 3 and name H1') (resid 4 and name H5'') 3.89 0.80 1.30
assign
 (resid 3 and name H1') (resid 4 and name H5') 4.01 0.80 1.30
assign
 (resid 3 and name H1') (resid 4 and name H4') 6.39 2.00 2.00
assign
 (resid 3 and name H1') (resid 4 and name H3') 5.83 2.00 2.00
assign
 (resid 3 and name H1') (resid 4 and name H8) 5.16 1.30 1.70
assign
 (resid 3 and name H1') (resid 21 and name HA1) 5.70 2.00 2.00
assign
 (resid 3 and name H1') (resid 21 and name HA2) 5.82 2.00 2.00
assign
 (resid 3 and name H1') (resid 22 and (name HNA or name HNB or name HNC)) 3.39 0.50 0.90
assign
 (resid 3 and name H1') (resid 22 and name HA) 3.92 0.80 1.30
assign
 (resid 3 and name H1') (resid 22 and name HB) 3.50 0.50 0.90
assign
 (resid 3 and name H1') (resid 22 and (name H1A or name H1B or name H1C)) 5.15 1.30 1.70
assign
 (resid 3 and name H1') (resid 22 and (name H2A or name H2B or name H2C)) 5.42 1.30 1.70
assign
 (resid 3 and (name H51 or name H52 or name H53))
 (resid 3 and name H6) 3.05 0.50 0.90
assign
 (resid 3 and name H6) (resid 4 and name H5'') 5.63 2.00 2.00
assign
 (resid 3 and name H6) (resid 4 and name H5') 4.61 1.30 1.70
assign
 (resid 3 and name H6) (resid 4 and name H8) 5.52 2.00 2.00
assign
 (resid 3 and name H6) (resid 22 and (name HNA or name HNB or name HNC)) 6.88 2.00 2.00
assign
 (resid 4 and name H5'') (resid 4 and name H4') 2.87 0.50 0.90
assign
 (resid 4 and name H5'') (resid 4 and name H3') 3.36 0.50 0.90
assign
 (resid 4 and name H5'') (resid 4 and name H2') 5.04 1.30 1.70
assign
 (resid 4 and name H5'') (resid 4 and name H2'') 4.89 1.30 1.70
assign
 (resid 4 and name H5'') (resid 4 and name H1') 4.36 0.80 1.30
assign
 (resid 4 and name H5'') (resid 4 and name H8) 4.56 1.30 1.70
assign
 (resid 4 and name H5'') (resid 18 and (name H2A or name H2B or name H2C)) 6.29 2.00 2.00
assign
 (resid 4 and name H5'') (resid 22 and (name HNA or name HNB or name HNC)) 4.35 0.80 1.30
assign
 (resid 4 and name H5'') (resid 22 and name HA) 2.57 0.50 0.90
assign
 (resid 4 and name H5'') (resid 22 and name HB) 2.47 0.50 0.90
assign
 (resid 4 and name H5'') (resid 22 and (name H1A or name H1B or name H1C)) 4.78 1.30 1.70
assign
 (resid 4 and name H5'') (resid 22 and (name H2A or name H2B or name H2C)) 2.87 0.50 0.90
assign
 (resid 4 and name H5') (resid 4 and name H4') 3.15 0.50 0.90
assign
 (resid 4 and name H5') (resid 4 and name H3') 2.37 0.50 0.90
assign
 (resid 4 and name H5') (resid 4 and name H2') 4.03 0.80 1.30
assign
 (resid 4 and name H5') (resid 4 and name H2'') 4.33 0.80 1.30
assign
 (resid 4 and name H5') (resid 4 and name H1') 4.10 0.80 1.30
assign
 (resid 4 and name H5') (resid 4 and name H8) 3.22 0.50 0.90
assign
 (resid 4 and name H5') (resid 18 and (name H2A or name H2B or name H2C)) 6.40 2.00 2.00
assign
 (resid 4 and name H5') (resid 22 and (name HNA or name HNB or name HNC)) 5.04 1.30 1.70
assign
 (resid 4 and name H5') (resid 22 and name HA) 3.74 0.80 1.30
assign
 (resid 4 and name H5') (resid 22 and name HB) 3.70 0.80 1.30
assign
 (resid 4 and name H5') (resid 22 and (name H1A or name H1B or name H1C)) 6.41 2.00 2.00
assign
 (resid 4 and name H5') (resid 22 and (name H2A or name H2B or name H2C)) 4.89 1.30 1.70
assign
 (resid 4 and name H4') (resid 4 and name H3') 2.80 0.50 0.90
assign
 (resid 4 and name H4') (resid 4 and name H2') 4.08 0.80 1.30
assign
 (resid 4 and name H4') (resid 4 and name H2'') 3.17 0.50 0.90
assign
 (resid 4 and name H4') (resid 4 and name H1') 3.42 0.50 0.90
assign
 (resid 4 and name H4') (resid 4 and name H8) 4.83 1.30 1.70
assign
 (resid 4 and name H4') (resid 5 and name H5'') 4.76 1.30 1.70
assign
 (resid 4 and name H4') (resid 5 and name H5') 5.66 2.00 2.00
assign
 (resid 4 and name H4') (resid 5 and name H4') 5.39 1.30 1.70
assign
 (resid 4 and name H4') (resid 18 and name HA) 6.29 2.00 2.00
assign
 (resid 4 and name H4') (resid 18 and name HB) 4.97 1.30 1.70
assign
 (resid 4 and name H4') (resid 18 and (name H2A or name H2B or name H2C)) 4.16 0.80 1.30
assign
 (resid 4 and name H4') (resid 22 and (name HNA or name HNB or name HNC)) 5.82 2.00 2.00
assign
 (resid 4 and name H4') (resid 22 and name HA) 3.37 0.50 0.90
assign
 (resid 4 and name H4') (resid 22 and name HB) 4.68 1.30 1.70
assign
 (resid 4 and name H4') (resid 22 and (name H1A or name H1B or name H1C)) 6.17 2.00 2.00
assign
 (resid 4 and name H4') (resid 22 and (name H2A or name H2B or name H2C)) 3.42 0.50 0.90
assign
 (resid 4 and name H4') (resid 25 and name HD1) 6.40 2.00 2.00
assign
 (resid 4 and name H3') (resid 4 and name H2') 2.44 0.50 0.90
assign
 (resid 4 and name H3') (resid 4 and name H2'') 2.97 0.50 0.90
assign
 (resid 4 and name H3') (resid 4 and name H1') 3.70 0.80 1.30
assign
 (resid 4 and name H3') (resid 4 and name H8) 2.92 0.50 0.90
assign
 (resid 4 and name H3') (resid 5 and name H5'') 4.47 0.80 1.30
assign
 (resid 4 and name H3') (resid 5 and name H5') 5.89 2.00 2.00
assign
 (resid 4 and name H3') (resid 17 and (name H4A or name H4B or name H4C)) 6.06 2.00 2.00
assign
 (resid 4 and name H3') (resid 18 and (name H2A or name H2B or name H2C)) 5.43 1.30 1.70
assign
 (resid 4 and name H3') (resid 22 and (name HNA or name HNB or name HNC)) 6.54 2.00 2.00
assign
 (resid 4 and name H3') (resid 22 and name HA) 4.34 0.80 1.30
assign
 (resid 4 and name H3') (resid 22 and name HB) 5.65 2.00 2.00
assign
 (resid 4 and name H3') (resid 22 and (name H1A or name H1B or name H1C)) 7.29 2.00 2.00
assign
 (resid 4 and name H3') (resid 22 and (name H2A or name H2B or name H2C)) 5.26 1.30 1.70
assign
 (resid 4 and name H2') (resid 4 and name H1') 2.98 0.50 0.90
assign
 (resid 4 and name H2') (resid 4 and name H8) 2.20 0.30 0.50
assign
 (resid 4 and name H2') (resid 5 and name H5'') 3.93 0.80 1.30
assign
 (resid 4 and name H2') (resid 5 and name H5') 5.45 1.30 1.70
assign
 (resid 4 and name H2') (resid 5 and name H4') 5.83 2.00 2.00
assign
 (resid 4 and name H2') (resid 5 and name H3') 6.14 2.00 2.00
assign
 (resid 4 and name H2') (resid 5 and name H1') 5.62 2.00 2.00
assign
 (resid 4 and name H2') (resid 5 and name H5) 4.15 0.80 1.30
assign
 (resid 4 and name H2') (resid 5 and name H6) 4.88 1.30 1.70
assign
 (resid 4 and name H2') (resid 17 and (name H4A or name H4B or name H4C)) 5.10 1.30 1.70
assign
 (resid 4 and name H2') (resid 18 and name HA) 6.23 2.00 2.00
assign
 (resid 4 and name H2') (resid 18 and name HB) 6.17 2.00 2.00
assign
 (resid 4 and name H2') (resid 18 and (name H2A or name H2B or name H2C)) 4.97 1.30 1.70
assign
 (resid 4 and name H2') (resid 22 and (name HNA or name HNB or name HNC)) 7.25 2.00 2.00
assign
 (resid 4 and name H2') (resid 22 and name HA) 5.12 1.30 1.70
assign
 (resid 4 and name H2') (resid 22 and (name H2A or name H2B or name H2C)) 7.07 2.00 2.00
assign
 (resid 4 and name H2') (resid 25 and name HD1) 6.64 2.00 2.00
assign
 (resid 4 and name H2'') (resid 4 and name H1') 2.43 0.50 0.90
assign
 (resid 4 and name H2'') (resid 4 and name H8) 3.59 0.80 1.30
assign
 (resid 4 and name H2'') (resid 5 and name H5'') 2.94 0.50 0.90
assign
 (resid 4 and name H2'') (resid 5 and name H5') 4.09 0.80 1.30
assign
 (resid 4 and name H2'') (resid 5 and name H4') 4.03 0.80 1.30
assign
 (resid 4 and name H2'') (resid 5 and name H3') 4.92 1.30 1.70
assign
 (resid 4 and name H2'') (resid 5 and name H2') 5.52 2.00 2.00
assign
 (resid 4 and name H2'') (resid 5 and name H2'') 5.43 1.30 1.70
assign
 (resid 4 and name H2'') (resid 5 and name H1') 4.45 0.80 1.30
assign
 (resid 4 and name H2'') (resid 5 and name H5) 4.49 0.80 1.30
assign
 (resid 4 and name H2'') (resid 5 and name H6) 4.39 0.80 1.30
assign
 (resid 4 and name H2'') (resid 17 and (name H4A or name H4B or name H4C)) 6.09 2.00 2.00
assign
 (resid 4 and name H2'') (resid 18 and name HA) 5.10 1.30 1.70
assign
 (resid 4 and name H2'') (resid 18 and name HB) 5.05 1.30 1.70
assign
 (resid 4 and name H2'') (resid 18 and (name H2A or name H2B or name H2C)) 3.37 0.50 0.90
assign
 (resid 4 and name H2'') (resid 22 and (name HNA or name HNB or name HNC)) 7.29 2.00 2.00
assign
 (resid 4 and name H2'') (resid 22 and name HA) 4.68 1.30 1.70
assign
 (resid 4 and name H2'') (resid 22 and (name H2A or name H2B or name H2C)) 5.99 2.00 2.00
assign
 (resid 4 and name H2'') (resid 25 and name HB1) 4.56 1.30 1.70
assign
 (resid 4 and name H2'') (resid 25 and name HG1) 4.97 1.30 1.70
assign
 (resid 4 and name H2'') (resid 25 and name HD1) 5.10 1.30 1.70
assign
 (resid 4 and name H2'') (resid 25 and name HD2) 6.00 2.00 2.00
assign
 (resid 4 and name H1') (resid 4 and name H8) 3.51 0.80 1.30
assign
 (resid 4 and name H1') (resid 5 and name H5'') 5.15 1.30 1.70
assign
 (resid 4 and name H1') (resid 5 and name H5') 6.15 2.00 2.00
assign
 (resid 4 and name H1') (resid 5 and name H4') 5.21 1.30 1.70
assign
 (resid 4 and name H1') (resid 5 and name H1') 4.27 0.80 1.30
assign
 (resid 4 and name H1') (resid 5 and name H6) 5.62 2.00 2.00
assign
 (resid 4 and name H1') (resid 17 and (name H4A or name H4B or name H4C)) 5.80 2.00 2.00
assign
 (resid 4 and name H1') (resid 18 and name HA) 3.83 0.80 1.30
assign
 (resid 4 and name H1') (resid 18 and name HB) 4.10 0.80 1.30
assign
 (resid 4 and name H1') (resid 18 and (name H2A or name H2B or name H2C)) 2.85 0.50 0.90
assign
 (resid 4 and name H1') (resid 19 and name HN) 5.21 1.30 1.70
assign
 (resid 4 and name H1') (resid 19 and (name H2A or name H2B or name H2C)) 6.40 2.00 2.00
assign
 (resid 4 and name H1') (resid 22 and (name HNA or name HNB or name HNC)) 5.14 1.30 1.70
assign
 (resid 4 and name H1') (resid 22 and name HA) 3.11 0.50 0.90
assign
 (resid 4 and name H1') (resid 22 and name HB) 5.23 1.30 1.70
assign
 (resid 4 and name H1') (resid 22 and (name H1A or name H1B or name H1C)) 6.54 2.00 2.00
assign
 (resid 4 and name H1') (resid 22 and (name H2A or name H2B or name H2C)) 4.99 1.30 1.70
assign
 (resid 4 and name H1') (resid 25 and name HB1) 4.44 0.80 1.30
assign
 (resid 4 and name H1') (resid 25 and name HB2) 6.02 2.00 2.00
assign
 (resid 4 and name H1') (resid 25 and name HG1) 5.22 1.30 1.70
assign
 (resid 4 and name H1') (resid 25 and name HG2) 6.50 2.00 2.00
assign
 (resid 4 and name H1') (resid 25 and name HD1) 4.43 0.80 1.30
assign
 (resid 4 and name H1') (resid 25 and name HD2) 5.83 2.00 2.00
assign
 (resid 4 and name H8) (resid 5 and name H5'') 5.80 2.00 2.00
assign
 (resid 4 and name H8) (resid 5 and name H5) 5.53 2.00 2.00
assign
 (resid 4 and name H8) (resid 17 and (name H4A or name H4B or name H4C)) 4.40 0.80 1.30
assign
 (resid 4 and name H8) (resid 18 and (name H2A or name H2B or name H2C)) 6.07 2.00 2.00
assign
 (resid 4 and name H8) (resid 22 and (name HNA or name HNB or name HNC)) 5.55 2.00 2.00
assign
 (resid 4 and name H8) (resid 22 and name HA) 4.36 0.80 1.30
assign
 (resid 4 and name H8) (resid 22 and name HB) 6.70 2.00 2.00
assign
 (resid 4 and name H8) (resid 22 and (name H2A or name H2B or name H2C)) 7.28 2.00 2.00
assign
 (resid 5 and name H5'') (resid 5 and name H4') 2.93 0.50 0.90
assign
 (resid 5 and name H5'') (resid 5 and name H3') 2.53 0.50 0.90
assign
 (resid 5 and name H5'') (resid 5 and name H2') 3.64 0.80 1.30
assign
 (resid 5 and name H5'') (resid 5 and name H2'') 3.10 0.50 0.90
assign
 (resid 5 and name H5'') (resid 5 and name H1') 3.74 0.80 1.30
assign
 (resid 5 and name H5'') (resid 5 and name H5) 4.12 0.80 1.30
assign
 (resid 5 and name H5'') (resid 5 and name H6) 2.67 0.50 0.90
assign
 (resid 5 and name H5'') (resid 6 and (name H51 or name H52 or name H53)) 5.16 1.30 1.70
assign
 (resid 5 and name H5'') (resid 6 and name H6) 5.36 1.30 1.70
assign
 (resid 5 and name H5'') (resid 18 and name HB) 6.51 2.00 2.00
assign
 (resid 5 and name H5'') (resid 18 and (name H2A or name H2B or name H2C)) 4.68 1.30 1.70
assign
 (resid 5 and name H5'') (resid 25 and name HB1) 4.74 1.30 1.70
assign
 (resid 5 and name H5'') (resid 25 and name HB2) 5.83 2.00 2.00
assign
 (resid 5 and name H5'') (resid 25 and name HG1) 4.13 0.80 1.30
assign
 (resid 5 and name H5'') (resid 25 and name HG2) 5.70 2.00 2.00
assign
 (resid 5 and name H5'') (resid 25 and name HD1) 4.94 1.30 1.70
assign
 (resid 5 and name H5'') (resid 25 and name HD2) 6.16 2.00 2.00
assign
 (resid 5 and name H5') (resid 5 and name H4') 2.61 0.50 0.90
assign
 (resid 5 and name H5') (resid 5 and name H3') 2.35 0.50 0.90
assign
 (resid 5 and name H5') (resid 5 and name H2') 4.44 0.80 1.30
assign
 (resid 5 and name H5') (resid 5 and name H2'') 4.16 0.80 1.30
assign
 (resid 5 and name H5') (resid 5 and name H1') 4.76 1.30 1.70
assign
 (resid 5 and name H5') (resid 5 and name H5) 5.22 1.30 1.70
assign
 (resid 5 and name H5') (resid 5 and name H6) 4.28 0.80 1.30
assign
 (resid 5 and name H5') (resid 6 and name H5') 6.49 2.00 2.00
assign
 (resid 5 and name H5') (resid 6 and (name H51 or name H52 or name H53)) 6.30 2.00 2.00
assign
 (resid 5 and name H5') (resid 6 and name H6) 6.30 2.00 2.00
assign
 (resid 5 and name H5') (resid 18 and name HB) 6.01 2.00 2.00
assign
 (resid 5 and name H5') (resid 18 and (name H2A or name H2B or name H2C)) 5.37 1.30 1.70
assign
 (resid 5 and name H5') (resid 25 and name HB1) 5.58 2.00 2.00
assign
 (resid 5 and name H5') (resid 25 and name HB2) 7.20 2.00 2.00
assign
 (resid 5 and name H5') (resid 25 and name HG1) 4.61 1.30 1.70
assign
 (resid 5 and name H5') (resid 25 and name HG2) 6.37 2.00 2.00
assign
 (resid 5 and name H5') (resid 25 and name HD1) 6.16 2.00 2.00
assign
 (resid 5 and name H5') (resid 25 and name HD2) 6.31 2.00 2.00
assign
 (resid 5 and name H4') (resid 5 and name H3') 2.65 0.50 0.90
assign
 (resid 5 and name H4') (resid 5 and name H2') 3.42 0.50 0.90
assign
 (resid 5 and name H4') (resid 5 and name H2'') 3.87 0.80 1.30
assign
 (resid 5 and name H4') (resid 5 and name H1') 3.46 0.50 0.90
assign
 (resid 5 and name H4') (resid 5 and name H6) 4.57 1.30 1.70
assign
 (resid 5 and name H4') (resid 6 and name H5'') 5.97 2.00 2.00
assign
 (resid 5 and name H4') (resid 6 and name H5') 4.37 0.80 1.30
assign
 (resid 5 and name H4') (resid 6 and name H4') 6.39 2.00 2.00
assign
 (resid 5 and name H4') (resid 6 and (name H51 or name H52 or name H53)) 6.26 2.00 2.00
assign
 (resid 5 and name H4') (resid 6 and name H6) 5.41 1.30 1.70
assign
 (resid 5 and name H4') (resid 18 and name HA) 5.11 1.30 1.70
assign
 (resid 5 and name H4') (resid 18 and name HB) 4.74 1.30 1.70
assign
 (resid 5 and name H4') (resid 18 and (name H2A or name H2B or name H2C)) 3.58 0.80 1.30
assign
 (resid 5 and name H4') (resid 19 and name HN) 5.98 2.00 2.00
assign
 (resid 5 and name H4') (resid 25 and name HA) 5.94 2.00 2.00
assign
 (resid 5 and name H4') (resid 25 and name HB1) 3.96 0.80 1.30
assign
 (resid 5 and name H4') (resid 25 and name HB2) 5.09 1.30 1.70
assign
 (resid 5 and name H4') (resid 25 and name HG1) 2.38 0.50 0.90
assign
 (resid 5 and name H4') (resid 25 and name HG2) 3.95 0.80 1.30
assign
 (resid 5 and name H4') (resid 25 and name HD1) 3.44 0.50 0.90
assign
 (resid 5 and name H4') (resid 25 and name HD2) 3.61 0.80 1.30
assign
 (resid 5 and name H3') (resid 5 and name H2') 2.72 0.50 0.90
assign
 (resid 5 and name H3') (resid 5 and name H2'') 2.48 0.50 0.90
assign
 (resid 5 and name H3') (resid 5 and name H1') 3.76 0.80 1.30
assign
 (resid 5 and name H3') (resid 5 and name H5) 5.07 1.30 1.70
assign
 (resid 5 and name H3') (resid 5 and name H6) 3.34 0.50 0.90
assign
 (resid 5 and name H3') (resid 6 and name H5'') 5.23 1.30 1.70
assign
 (resid 5 and name H3') (resid 6 and name H5') 4.82 1.30 1.70
assign
 (resid 5 and name H3') (resid 6 and name H4') 6.12 2.00 2.00
assign
 (resid 5 and name H3') (resid 6 and name H3') 5.07 1.30 1.70
assign
 (resid 5 and name H3') (resid 6 and name H2') 5.67 2.00 2.00
assign
 (resid 5 and name H3') (resid 6 and (name H51 or name H52 or name H53)) 5.22 1.30 1.70
assign
 (resid 5 and name H3') (resid 6 and name H6) 4.75 1.30 1.70
assign
 (resid 5 and name H3') (resid 18 and (name H2A or name H2B or name H2C)) 5.53 2.00 2.00
assign
 (resid 5 and name H3') (resid 25 and name HB1) 5.16 1.30 1.70
assign
 (resid 5 and name H3') (resid 25 and name HB2) 5.27 1.30 1.70
assign
 (resid 5 and name H3') (resid 25 and name HG1) 3.63 0.80 1.30
assign
 (resid 5 and name H3') (resid 25 and name HG2) 4.57 1.30 1.70
assign
 (resid 5 and name H3') (resid 25 and name HD1) 5.25 1.30 1.70
assign
 (resid 5 and name H3') (resid 25 and name HD2) 5.28 1.30 1.70
assign
 (resid 5 and name H2') (resid 5 and name H1') 2.38 0.50 0.90
assign
 (resid 5 and name H2') (resid 5 and name H5) 4.85 1.30 1.70
assign
 (resid 5 and name H2') (resid 5 and name H6) 3.36 0.50 0.90
assign
 (resid 5 and name H2') (resid 6 and name H5'') 4.09 0.80 1.30
assign
 (resid 5 and name H2') (resid 6 and name H5') 3.44 0.50 0.90
assign
 (resid 5 and name H2') (resid 6 and name H4') 4.37 0.80 1.30
assign
 (resid 5 and name H2') (resid 6 and name H3') 3.61 0.80 1.30
assign
 (resid 5 and name H2') (resid 6 and name H2') 3.96 0.80 1.30
assign
 (resid 5 and name H2') (resid 6 and name H2'') 5.14 1.30 1.70
assign
 (resid 5 and name H2') (resid 6 and name H1') 4.33 0.80 1.30
assign
 (resid 5 and name H2') (resid 6 and (name H51 or name H52 or name H53)) 4.15 0.80 1.30
assign
 (resid 5 and name H2') (resid 6 and name H6) 2.56 0.50 0.90
assign
 (resid 5 and name H2') (resid 7 and (name H51 or name H52 or name H53)) 5.47 1.30 1.70
assign
 (resid 5 and name H2') (resid 18 and name HA) 6.11 2.00 2.00
assign
 (resid 5 and name H2') (resid 18 and name HB) 6.07 2.00 2.00
assign
 (resid 5 and name H2') (resid 18 and (name H2A or name H2B or name H2C)) 5.50 1.30 1.70
assign
 (resid 5 and name H2') (resid 24 and name HA) 6.11 2.00 2.00
assign
 (resid 5 and name H2') (resid 25 and name HA) 5.15 1.30 1.70
assign
 (resid 5 and name H2') (resid 25 and name HB1) 3.83 0.80 1.30
assign
 (resid 5 and name H2') (resid 25 and name HB2) 2.96 0.50 0.90
assign
 (resid 5 and name H2') (resid 25 and name HG1) 2.19 0.30 0.50
assign
 (resid 5 and name H2') (resid 25 and name HG2) 2.88 0.50 0.90
assign
 (resid 5 and name H2') (resid 25 and name HD1) 4.51 1.30 1.70
assign
 (resid 5 and name H2') (resid 25 and name HD2) 4.27 0.80 1.30
assign
 (resid 5 and name H2') (resid 26 and (name HNA or name HNB or name HNC)) 6.66 2.00 2.00
assign
 (resid 5 and name H2') (resid 26 and name HA1) 5.66 2.00 2.00
assign
 (resid 5 and name H2') (resid 26 and name HA2) 5.03 1.30 1.70
assign
 (resid 5 and name H2'') (resid 5 and name H1') 2.61 0.50 0.90
assign
 (resid 5 and name H2'') (resid 5 and name H5) 4.29 0.80 1.30
assign
 (resid 5 and name H2'') (resid 5 and name H6) 2.29 0.50 0.90
assign
 (resid 5 and name H2'') (resid 6 and name H5'') 5.73 2.00 2.00
assign
 (resid 5 and name H2'') (resid 6 and name H5') 5.03 1.30 1.70
assign
 (resid 5 and name H2'') (resid 6 and name H4') 6.30 2.00 2.00
assign
 (resid 5 and name H2'') (resid 6 and name H3') 4.76 1.30 1.70
assign
 (resid 5 and name H2'') (resid 6 and name H2') 4.75 1.30 1.70
assign
 (resid 5 and name H2'') (resid 6 and name H2'') 5.89 2.00 2.00
assign
 (resid 5 and name H2'') (resid 6 and name H1') 5.51 2.00 2.00
assign
 (resid 5 and name H2'') (resid 6 and (name H51 or name H52 or name H53)) 3.18 0.50 0.90
assign
 (resid 5 and name H2'') (resid 6 and name H6) 2.70 0.50 0.90
assign
 (resid 5 and name H2'') (resid 7 and (name H51 or name H52 or name H53)) 6.06 2.00 2.00
assign
 (resid 5 and name H2'') (resid 18 and name HA) 7.05 2.00 2.00
assign
 (resid 5 and name H2'') (resid 18 and (name H2A or name H2B or name H2C)) 5.68 2.00 2.00
assign
 (resid 5 and name H2'') (resid 25 and name HA) 5.76 2.00 2.00
assign
 (resid 5 and name H2'') (resid 25 and name HB1) 4.46 0.80 1.30
assign
 (resid 5 and name H2'') (resid 25 and name HB2) 4.16 0.80 1.30
assign
 (resid 5 and name H2'') (resid 25 and name HG1) 3.62 0.80 1.30
assign
 (resid 5 and name H2'') (resid 25 and name HG2) 4.53 1.30 1.70
assign
 (resid 5 and name H2'') (resid 25 and name HD1) 6.09 2.00 2.00
assign
 (resid 5 and name H2'') (resid 25 and name HD2) 5.50 2.00 2.00
assign
 (resid 5 and name H2'') (resid 26 and name HA2) 5.82 2.00 2.00
assign
 (resid 5 and name H1') (resid 5 and name H5) 4.36 0.80 1.30
assign
 (resid 5 and name H1') (resid 5 and name H6) 3.24 0.50 0.90
assign
 (resid 5 and name H1') (resid 6 and name H5'') 5.83 2.00 2.00
assign
 (resid 5 and name H1') (resid 6 and name H5') 4.63 1.30 1.70
assign
 (resid 5 and name H1') (resid 6 and name H4') 5.43 1.30 1.70
assign
 (resid 5 and name H1') (resid 6 and name H3') 4.72 1.30 1.70
assign
 (resid 5 and name H1') (resid 6 and name H2') 5.38 1.30 1.70
assign
 (resid 5 and name H1') (resid 6 and name H2'') 5.72 2.00 2.00
assign
 (resid 5 and name H1') (resid 6 and name H1') 4.56 1.30 1.70
assign
 (resid 5 and name H1') (resid 6 and (name H51 or name H52 or name H53)) 4.26 0.80 1.30
assign
 (resid 5 and name H1') (resid 6 and name H6) 3.39 0.50 0.90
assign
 (resid 5 and name H1') (resid 18 and name HA) 4.50 1.30 1.70
assign
 (resid 5 and name H1') (resid 18 and name HB) 5.28 1.30 1.70
assign
 (resid 5 and name H1') (resid 18 and (name H2A or name H2B or name H2C)) 4.30 0.80 1.30
assign
 (resid 5 and name H1') (resid 19 and name HN) 5.81 2.00 2.00
assign
 (resid 5 and name H1') (resid 24 and name HA) 5.81 2.00 2.00
assign
 (resid 5 and name H1') (resid 24 and (name H1A or name H1B or name H1C)) 6.53 2.00 2.00
assign
 (resid 5 and name H1') (resid 25 and name HA) 4.12 0.80 1.30
assign
 (resid 5 and name H1') (resid 25 and name HB1) 2.23 0.50 0.90
assign
 (resid 5 and name H1') (resid 25 and name HB2) 2.55 0.50 0.90
assign
 (resid 5 and name H1') (resid 25 and name HG1) 2.32 0.50 0.90
assign
 (resid 5 and name H1') (resid 25 and name HG2) 3.68 0.80 1.30
assign
 (resid 5 and name H1') (resid 25 and name HD1) 3.78 0.80 1.30
assign
 (resid 5 and name H1') (resid 25 and name HD2) 4.50 1.30 1.70
assign
 (resid 5 and name H1') (resid 26 and (name HNA or name HNB or name HNC)) 6.48 2.00 2.00
assign
 (resid 5 and name H1') (resid 26 and name HA1) 5.33 1.30 1.70
assign
 (resid 5 and name H1') (resid 26 and name HA2) 4.55 1.30 1.70
assign
 (resid 5 and name H1') (resid 27 and (name HNA or name HNB or name HNC)) 6.52 2.00 2.00
assign
 (resid 5 and name H5) (resid 5 and name H6) 2.45 0.50 0.90
assign
 (resid 5 and name H5) (resid 6 and (name H51 or name H52 or name H53)) 4.17 0.80 1.30
assign
 (resid 5 and name H5) (resid 6 and name H6) 5.79 2.00 2.00
assign
 (resid 5 and name H5) (resid 17 and (name H4A or name H4B or name H4C)) 4.87 1.30 1.70
assign
 (resid 5 and name H5) (resid 18 and (name H2A or name H2B or name H2C)) 6.38 2.00 2.00
assign
 (resid 5 and name H6) (resid 6 and name H5') 7.41 2.00 2.00
assign
 (resid 5 and name H6) (resid 6 and name H2') 6.91 2.00 2.00
assign
 (resid 5 and name H6) (resid 6 and (name H51 or name H52 or name H53)) 3.57 0.80 1.30
assign
 (resid 5 and name H6) (resid 6 and name H6) 4.70 1.30 1.70
assign
 (resid 5 and name H6) (resid 18 and (name H2A or name H2B or name H2C)) 5.46 1.30 1.70
assign
 (resid 5 and name H6) (resid 25 and name HB1) 4.93 1.30 1.70
assign
 (resid 5 and name H6) (resid 25 and name HB2) 5.60 2.00 2.00
assign
 (resid 5 and name H6) (resid 25 and name HG1) 4.70 1.30 1.70
assign
 (resid 5 and name H6) (resid 25 and name HG2) 6.42 2.00 2.00
assign
 (resid 5 and name H6) (resid 25 and name HD1) 6.05 2.00 2.00
assign
 (resid 6 and name H5'') (resid 6 and name H4') 2.64 0.50 0.90
assign
 (resid 6 and name H5'') (resid 6 and name H3') 2.55 0.50 0.90
assign
 (resid 6 and name H5'') (resid 6 and name H2') 4.67 1.30 1.70
assign
 (resid 6 and name H5'') (resid 6 and name H2'') 4.95 1.30 1.70
assign
 (resid 6 and name H5'') (resid 6 and name H1') 4.57 1.30 1.70
assign
 (resid 6 and name H5'') (resid 6 and name H6) 4.93 1.30 1.70
assign
 (resid 6 and name H5'') (resid 7 and name H5'') 5.87 2.00 2.00
assign
 (resid 6 and name H5'') (resid 7 and name H5') 4.48 0.80 1.30
assign
 (resid 6 and name H5'') (resid 7 and (name H51 or name H52 or name H53)) 6.72 2.00 2.00
assign
 (resid 6 and name H5'') (resid 18 and (name H2A or name H2B or name H2C)) 8.68 2.00 2.00
assign
 (resid 6 and name H5'') (resid 24 and (name H1A or name H1B or name H1C)) 6.47 2.00 2.00
assign
 (resid 6 and name H5'') (resid 25 and name HA) 6.22 2.00 2.00
assign
 (resid 6 and name H5'') (resid 25 and name HB1) 5.12 1.30 1.70
assign
 (resid 6 and name H5'') (resid 25 and name HB2) 5.19 1.30 1.70
assign
 (resid 6 and name H5'') (resid 25 and name HG1) 4.58 1.30 1.70
assign
 (resid 6 and name H5'') (resid 25 and name HG2) 3.43 0.50 0.90
assign
 (resid 6 and name H5'') (resid 25 and name HD1) 6.31 2.00 2.00
assign
 (resid 6 and name H5'') (resid 25 and name HD2) 5.00 1.30 1.70
assign
 (resid 6 and name H5'') (resid 26 and (name HNA or name HNB or name HNC)) 6.83 2.00 2.00
assign
 (resid 6 and name H5'') (resid 26 and name HA2) 7.29 2.00 2.00
assign
 (resid 6 and name H5') (resid 6 and name H4') 2.53 0.50 0.90
assign
 (resid 6 and name H5') (resid 6 and name H3') 3.16 0.50 0.90
assign
 (resid 6 and name H5') (resid 6 and name H2') 4.95 1.30 1.70
assign
 (resid 6 and name H5') (resid 6 and name H2'') 5.10 1.30 1.70
assign
 (resid 6 and name H5') (resid 6 and name H1') 4.27 0.80 1.30
assign
 (resid 6 and name H5') (resid 6 and (name H51 or name H52 or name H53)) 6.82 2.00 2.00
assign
 (resid 6 and name H5') (resid 6 and name H6) 4.51 1.30 1.70
assign
 (resid 6 and name H5') (resid 7 and name H5'') 7.07 2.00 2.00
assign
 (resid 6 and name H5') (resid 7 and name H5') 5.53 2.00 2.00
assign
 (resid 6 and name H5') (resid 18 and name HA) 6.34 2.00 2.00
assign
 (resid 6 and name H5') (resid 18 and name HB) 6.48 2.00 2.00
assign
 (resid 6 and name H5') (resid 18 and (name H2A or name H2B or name H2C)) 7.35 2.00 2.00
assign
 (resid 6 and name H5') (resid 24 and name HA) 5.79 2.00 2.00
assign
 (resid 6 and name H5') (resid 24 and (name H1A or name H1B or name H1C)) 5.57 2.00 2.00
assign
 (resid 6 and name H5') (resid 25 and name HA) 5.13 1.30 1.70
assign
 (resid 6 and name H5') (resid 25 and name HB1) 4.34 0.80 1.30
assign
 (resid 6 and name H5') (resid 25 and name HB2) 4.15 0.80 1.30
assign
 (resid 6 and name H5') (resid 25 and name HG1) 2.99 0.50 0.90
assign
 (resid 6 and name H5') (resid 25 and name HG2) 1.88 0.30 0.50
assign
 (resid 6 and name H5') (resid 25 and name HD1) 4.55 1.30 1.70
assign
 (resid 6 and name H5') (resid 25 and name HD2) 3.15 0.50 0.90
assign
 (resid 6 and name H5') (resid 26 and (name HNA or name HNB or name HNC)) 5.96 2.00 2.00
assign
 (resid 6 and name H5') (resid 26 and name HA1) 6.91 2.00 2.00
assign
 (resid 6 and name H5') (resid 26 and name HA2) 6.32 2.00 2.00
assign
 (resid 6 and name H4') (resid 6 and name H3') 2.86 0.50 0.90
assign
 (resid 6 and name H4') (resid 6 and name H2') 4.13 0.80 1.30
assign
 (resid 6 and name H4') (resid 6 and name H2'') 3.42 0.50 0.90
assign
 (resid 6 and name H4') (resid 6 and name H1') 2.68 0.50 0.90
assign
 (resid 6 and name H4') (resid 6 and (name H51 or name H52 or name H53)) 6.61 2.00 2.00
assign
 (resid 6 and name H4') (resid 6 and name H6) 4.34 0.80 1.30
assign
 (resid 6 and name H4') (resid 7 and name H5'') 4.68 1.30 1.70
assign
 (resid 6 and name H4') (resid 7 and name H5') 3.21 0.50 0.90
assign
 (resid 6 and name H4') (resid 7 and name H4') 5.20 1.30 1.70
assign
 (resid 6 and name H4') (resid 7 and (name H51 or name H52 or name H53)) 6.51 2.00 2.00
assign
 (resid 6 and name H4') (resid 7 and name H6) 5.49 1.30 1.70
assign
 (resid 6 and name H4') (resid 18 and (name H2A or name H2B or name H2C)) 7.83 2.00 2.00
assign
 (resid 6 and name H4') (resid 24 and name HA) 4.71 1.30 1.70
assign
 (resid 6 and name H4') (resid 24 and (name H1A or name H1B or name H1C)) 4.82 1.30 1.70
assign
 (resid 6 and name H4') (resid 24 and (name H2A or name H2B or name H2C)) 6.49 2.00 2.00
assign
 (resid 6 and name H4') (resid 25 and name HA) 4.36 0.80 1.30
assign
 (resid 6 and name H4') (resid 25 and name HB1) 4.43 0.80 1.30
assign
 (resid 6 and name H4') (resid 25 and name HB2) 3.43 0.50 0.90
assign
 (resid 6 and name H4') (resid 25 and name HG1) 4.04 0.80 1.30
assign
 (resid 6 and name H4') (resid 25 and name HG2) 2.54 0.50 0.90
assign
 (resid 6 and name H4') (resid 25 and name HD1) 5.61 2.00 2.00
assign
 (resid 6 and name H4') (resid 25 and name HD2) 4.14 0.80 1.30
assign
 (resid 6 and name H4') (resid 26 and (name HNA or name HNB or name HNC)) 3.63 0.80 1.30
assign
 (resid 6 and name H4') (resid 26 and name HA1) 4.98 1.30 1.70
assign
 (resid 6 and name H4') (resid 26 and name HA2) 4.66 1.30 1.70
assign
 (resid 6 and name H3') (resid 6 and name H2') 2.36 0.50 0.90
assign
 (resid 6 and name H3') (resid 6 and name H2'') 3.09 0.50 0.90
assign
 (resid 6 and name H3') (resid 6 and name H1') 3.52 0.80 1.30
assign
 (resid 6 and name H3') (resid 6 and (name H51 or name H52 or name H53)) 5.53 2.00 2.00
assign
 (resid 6 and name H3') (resid 6 and name H6) 3.04 0.50 0.90
assign
 (resid 6 and name H3') (resid 7 and name H5'') 5.44 1.30 1.70
assign
 (resid 6 and name H3') (resid 7 and name H5') 4.10 0.80 1.30
assign
 (resid 6 and name H3') (resid 7 and name H4') 6.27 2.00 2.00
assign
 (resid 6 and name H3') (resid 7 and name H2') 6.58 2.00 2.00
assign
 (resid 6 and name H3') (resid 7 and (name H51 or name H52 or name H53)) 4.67 1.30 1.70
assign
 (resid 6 and name H3') (resid 7 and name H6) 4.34 0.80 1.30
assign
 (resid 6 and name H3') (resid 25 and name HB1) 4.91 1.30 1.70
assign
 (resid 6 and name H3') (resid 25 and name HB2) 4.43 0.80 1.30
assign
 (resid 6 and name H3') (resid 25 and name HG1) 5.18 1.30 1.70
assign
 (resid 6 and name H3') (resid 25 and name HG2) 3.99 0.80 1.30
assign
 (resid 6 and name H3') (resid 25 and name HD1) 6.71 2.00 2.00
assign
 (resid 6 and name H3') (resid 25 and name HD2) 5.68 2.00 2.00
assign
 (resid 6 and name H3') (resid 26 and (name HNA or name HNB or name HNC)) 5.53 2.00 2.00
assign
 (resid 6 and name H2') (resid 6 and name H1') 3.08 0.50 0.90
assign
 (resid 6 and name H2') (resid 6 and (name H51 or name H52 or name H53)) 4.41 0.80 1.30
assign
 (resid 6 and name H2') (resid 6 and name H6) 2.35 0.50 0.90
assign
 (resid 6 and name H2') (resid 7 and name H5'') 5.42 1.30 1.70
assign
 (resid 6 and name H2') (resid 7 and name H5') 4.24 0.80 1.30
assign
 (resid 6 and name H2') (resid 7 and name H4') 5.55 2.00 2.00
assign
 (resid 6 and name H2') (resid 7 and name H3') 6.72 2.00 2.00
assign
 (resid 6 and name H2') (resid 7 and name H2') 4.82 1.30 1.70
assign
 (resid 6 and name H2') (resid 7 and name H2'') 6.51 2.00 2.00
assign
 (resid 6 and name H2') (resid 7 and name H1') 5.05 1.30 1.70
assign
 (resid 6 and name H2') (resid 7 and (name H51 or name H52 or name H53)) 3.23 0.50 0.90
assign
 (resid 6 and name H2') (resid 7 and name H6) 3.08 0.50 0.90
assign
 (resid 6 and name H2') (resid 25 and name HA) 5.94 2.00 2.00
assign
 (resid 6 and name H2') (resid 25 and name HB1) 5.49 1.30 1.70
assign
 (resid 6 and name H2') (resid 25 and name HB2) 4.13 0.80 1.30
assign
 (resid 6 and name H2') (resid 25 and name HG1) 5.42 1.30 1.70
assign
 (resid 6 and name H2') (resid 25 and name HG2) 4.82 1.30 1.70
assign
 (resid 6 and name H2') (resid 26 and (name HNA or name HNB or name HNC)) 5.24 1.30 1.70
assign
 (resid 6 and name H2') (resid 26 and name HA1) 5.19 1.30 1.70
assign
 (resid 6 and name H2') (resid 26 and name HA2) 5.80 2.00 2.00
assign
 (resid 6 and name H2'') (resid 6 and name H1') 2.30 0.50 0.90
assign
 (resid 6 and name H2'') (resid 6 and (name H51 or name H52 or name H53)) 5.90 2.00 2.00
assign
 (resid 6 and name H2'') (resid 6 and name H6) 3.80 0.80 1.30
assign
 (resid 6 and name H2'') (resid 7 and name H5'') 4.01 0.80 1.30
assign
 (resid 6 and name H2'') (resid 7 and name H5') 2.78 0.50 0.90
assign
 (resid 6 and name H2'') (resid 7 and name H4') 3.96 0.80 1.30
assign
 (resid 6 and name H2'') (resid 7 and name H3') 4.96 1.30 1.70
assign
 (resid 6 and name H2'') (resid 7 and name H2') 4.02 0.80 1.30
assign
 (resid 6 and name H2'') (resid 7 and name H2'') 4.63 1.30 1.70
assign
 (resid 6 and name H2'') (resid 7 and name H1') 3.88 0.80 1.30
assign
 (resid 6 and name H2'') (resid 7 and (name H51 or name H52 or name H53)) 4.22 0.80 1.30
assign
 (resid 6 and name H2'') (resid 7 and name H6) 2.49 0.50 0.90
assign
 (resid 6 and name H2'') (resid 25 and name HA) 5.28 1.30 1.70
assign
 (resid 6 and name H2'') (resid 25 and name HB1) 5.58 2.00 2.00
assign
 (resid 6 and name H2'') (resid 25 and name HB2) 4.36 0.80 1.30
assign
 (resid 6 and name H2'') (resid 25 and name HG1) 6.40 2.00 2.00
assign
 (resid 6 and name H2'') (resid 25 and name HG2) 5.14 1.30 1.70
assign
 (resid 6 and name H2'') (resid 26 and (name HNA or name HNB or name HNC)) 4.18 0.80 1.30
assign
 (resid 6 and name H2'') (resid 26 and name HA1) 4.49 0.80 1.30
assign
 (resid 6 and name H2'') (resid 26 and name HA2) 5.09 1.30 1.70
assign
 (resid 6 and name H2'') (resid 27 and (name HNA or name HNB or name HNC)) 7.02 2.00 2.00
assign
 (resid 6 and name H1') (resid 6 and (name H51 or name H52 or name H53)) 5.62 2.00 2.00
assign
 (resid 6 and name H1') (resid 6 and name H6) 3.43 0.50 0.90
assign
 (resid 6 and name H1') (resid 7 and name H5'') 4.67 1.30 1.70
assign
 (resid 6 and name H1') (resid 7 and name H5') 3.38 0.50 0.90
assign
 (resid 6 and name H1') (resid 7 and name H4') 4.25 0.80 1.30
assign
 (resid 6 and name H1') (resid 7 and name H3') 6.08 2.00 2.00
assign
 (resid 6 and name H1') (resid 7 and name H2') 5.65 2.00 2.00
assign
 (resid 6 and name H1') (resid 7 and name H2'') 6.58 2.00 2.00
assign
 (resid 6 and name H1') (resid 7 and name H1') 4.68 1.30 1.70
assign
 (resid 6 and name H1') (resid 7 and (name H51 or name H52 or name H53)) 5.95 2.00 2.00
assign
 (resid 6 and name H1') (resid 7 and name H6) 4.53 1.30 1.70
assign
 (resid 6 and name H1') (resid 18 and (name H2A or name H2B or name H2C)) 7.45 2.00 2.00
assign
 (resid 6 and name H1') (resid 24 and name HA) 4.41 0.80 1.30
assign
 (resid 6 and name H1') (resid 24 and (name H1A or name H1B or name H1C)) 5.48 1.30 1.70
assign
 (resid 6 and name H1') (resid 24 and (name H2A or name H2B or name H2C)) 6.21 2.00 2.00
assign
 (resid 6 and name H1') (resid 25 and name HA) 3.85 0.80 1.30
assign
 (resid 6 and name H1') (resid 25 and name HB1) 4.30 0.80 1.30
assign
 (resid 6 and name H1') (resid 25 and name HB2) 2.68 0.50 0.90
assign
 (resid 6 and name H1') (resid 25 and name HG1) 4.61 1.30 1.70
assign
 (resid 6 and name H1') (resid 25 and name HG2) 3.82 0.80 1.30
assign
 (resid 6 and name H1') (resid 25 and name HD1) 6.24 2.00 2.00
assign
 (resid 6 and name H1') (resid 25 and name HD2) 5.23 1.30 1.70
assign
 (resid 6 and name H1') (resid 26 and (name HNA or name HNB or name HNC)) 3.23 0.50 0.90
assign
 (resid 6 and name H1') (resid 26 and name HA1) 3.11 0.50 0.90
assign
 (resid 6 and name H1') (resid 26 and name HA2) 3.48 0.50 0.90
assign
 (resid 6 and name H1') (resid 27 and (name HNA or name HNB or name HNC)) 5.24 1.30 1.70
assign
 (resid 6 and name H1') (resid 27 and (name H2A or name H2B or name H2C)) 6.82 2.00 2.00
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 6 and name H6) 3.13 0.50 0.90
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 7 and (name H51 or name H52 or name H53)) 5.05 1.30 1.70
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 7 and name H6) 7.47 2.00 2.00
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 18 and (name H2A or name H2B or name H2C)) 7.49 2.00 2.00
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 25 and name HB1) 5.61 2.00 2.00
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 25 and name HB2) 4.96 1.30 1.70
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 25 and name HG1) 5.27 1.30 1.70
assign
 (resid 6 and (name H51 or name H52 or name H53))
 (resid 25 and name HG2) 6.40 2.00 2.00
assign
 (resid 6 and name H6) (resid 7 and name H5') 5.90 2.00 2.00
assign
 (resid 6 and name H6) (resid 7 and (name H51 or name H52 or name H53)) 4.89 1.30 1.70
assign
 (resid 6 and name H6) (resid 7 and name H6) 5.45 1.30 1.70
assign
 (resid 6 and name H6) (resid 18 and (name H2A or name H2B or name H2C)) 6.23 2.00 2.00
assign
 (resid 6 and name H6) (resid 25 and name HA) 5.04 1.30 1.70
assign
 (resid 6 and name H6) (resid 25 and name HB1) 4.61 1.30 1.70
assign
 (resid 6 and name H6) (resid 25 and name HB2) 3.25 0.50 0.90
assign
 (resid 6 and name H6) (resid 25 and name HG1) 4.21 0.80 1.30
assign
 (resid 6 and name H6) (resid 25 and name HG2) 4.24 0.80 1.30
assign
 (resid 6 and name H6) (resid 25 and name HD1) 6.08 2.00 2.00
assign
 (resid 6 and name H6) (resid 25 and name HD2) 5.43 1.30 1.70
assign
 (resid 6 and name H6) (resid 26 and (name HNA or name HNB or name HNC)) 6.20 2.00 2.00
assign
 (resid 6 and name H6) (resid 26 and name HA1) 4.94 1.30 1.70
assign
 (resid 6 and name H6) (resid 26 and name HA2) 4.80 1.30 1.70
assign
 (resid 7 and name H5'') (resid 7 and name H4') 2.62 0.50 0.90
assign
 (resid 7 and name H5'') (resid 7 and name H3') 2.62 0.50 0.90
assign
 (resid 7 and name H5'') (resid 7 and name H2') 3.73 0.80 1.30
assign
 (resid 7 and name H5'') (resid 7 and name H2'') 4.87 1.30 1.70
assign
 (resid 7 and name H5'') (resid 7 and name H1') 4.50 0.80 1.30
assign
 (resid 7 and name H5'') (resid 7 and (name H51 or name H52 or name H53)) 6.21 2.00 2.00
assign
 (resid 7 and name H5'') (resid 7 and name H6) 4.21 0.80 1.30
assign
 (resid 7 and name H5'') (resid 26 and (name HNA or name HNB or name HNC)) 4.51 1.30 1.70
assign
 (resid 7 and name H5') (resid 7 and name H4') 2.41 0.50 0.90
assign
 (resid 7 and name H5') (resid 7 and name H3') 3.60 0.80 1.30
assign
 (resid 7 and name H5') (resid 7 and name H2') 4.10 0.80 1.30
assign
 (resid 7 and name H5') (resid 7 and name H2'') 5.18 1.30 1.70
assign
 (resid 7 and name H5') (resid 7 and name H1') 4.26 0.80 1.30
assign
 (resid 7 and name H5') (resid 7 and (name H51 or name H52 or name H53)) 5.97 2.00 2.00
assign
 (resid 7 and name H5') (resid 7 and name H6) 3.80 0.80 1.30
assign
 (resid 7 and name H5') (resid 24 and (name H1A or name H1B or name H1C)) 6.50 2.00 2.00
assign
 (resid 7 and name H5') (resid 25 and name HB2) 5.86 2.00 2.00
assign
 (resid 7 and name H5') (resid 25 and name HG2) 5.74 2.00 2.00
assign
 (resid 7 and name H5') (resid 26 and (name HNA or name HNB or name HNC)) 3.88 0.80 1.30
assign
 (resid 7 and name H5') (resid 26 and name HA1) 5.70 2.00 2.00
assign
 (resid 7 and name H4') (resid 7 and name H3') 2.73 0.50 0.90
assign
 (resid 7 and name H4') (resid 7 and name H2') 3.66 0.80 1.30
assign
 (resid 7 and name H4') (resid 7 and name H2'') 3.85 0.80 1.30
assign
 (resid 7 and name H4') (resid 7 and name H1') 2.90 0.50 0.90
assign
 (resid 7 and name H4') (resid 7 and (name H51 or name H52 or name H53)) 6.97 2.00 2.00
assign
 (resid 7 and name H4') (resid 7 and name H6) 4.34 0.80 1.30
assign
 (resid 7 and name H4') (resid 8 and name H5'') 5.91 2.00 2.00
assign
 (resid 7 and name H4') (resid 8 and name H5') 4.41 0.80 1.30
assign
 (resid 7 and name H4') (resid 8 and name H6) 6.30 2.00 2.00
assign
 (resid 7 and name H4') (resid 24 and (name H1A or name H1B or name H1C)) 7.27 2.00 2.00
assign
 (resid 7 and name H4') (resid 26 and (name HNA or name HNB or name HNC)) 3.57 0.80 1.30
assign
 (resid 7 and name H4') (resid 26 and name HA1) 5.45 1.30 1.70
assign
 (resid 7 and name H4') (resid 27 and (name H2A or name H2B or name H2C)) 6.24 2.00 2.00
assign
 (resid 7 and name H3') (resid 7 and name H2') 2.41 0.50 0.90
assign
 (resid 7 and name H3') (resid 7 and name H2'') 2.87 0.50 0.90
assign
 (resid 7 and name H3') (resid 7 and name H1') 3.81 0.80 1.30
assign
 (resid 7 and name H3') (resid 7 and (name H51 or name H52 or name H53)) 6.75 2.00 2.00
assign
 (resid 7 and name H3') (resid 7 and name H6) 3.82 0.80 1.30
assign
 (resid 7 and name H3') (resid 8 and name H5'') 5.38 1.30 1.70
assign
 (resid 7 and name H3') (resid 8 and name H5') 4.34 0.80 1.30
assign
 (resid 7 and name H3') (resid 8 and name H3') 5.65 2.00 2.00
assign
 (resid 7 and name H3') (resid 8 and name H5) 4.82 1.30 1.70
assign
 (resid 7 and name H3') (resid 8 and name H6) 5.06 1.30 1.70
assign
 (resid 7 and name H3') (resid 26 and (name HNA or name HNB or name HNC)) 5.35 1.30 1.70
assign
 (resid 7 and name H2') (resid 7 and name H1') 3.14 0.50 0.90
assign
 (resid 7 and name H2') (resid 7 and (name H51 or name H52 or name H53)) 4.72 1.30 1.70
assign
 (resid 7 and name H2') (resid 7 and name H6) 2.19 0.30 0.50
assign
 (resid 7 and name H2') (resid 8 and name H5'') 6.04 2.00 2.00
assign
 (resid 7 and name H2') (resid 8 and name H5') 4.84 1.30 1.70
assign
 (resid 7 and name H2') (resid 8 and name H4') 6.61 2.00 2.00
assign
 (resid 7 and name H2') (resid 8 and name H3') 5.95 2.00 2.00
assign
 (resid 7 and name H2') (resid 8 and name H2') 6.43 2.00 2.00
assign
 (resid 7 and name H2') (resid 8 and name H1') 6.45 2.00 2.00
assign
 (resid 7 and name H2') (resid 8 and name H5) 3.48 0.50 0.90
assign
 (resid 7 and name H2') (resid 8 and name H6) 3.87 0.80 1.30
assign
 (resid 7 and name H2') (resid 26 and (name HNA or name HNB or name HNC)) 5.51 2.00 2.00
assign
 (resid 7 and name H2'') (resid 7 and name H1') 2.34 0.50 0.90
assign
 (resid 7 and name H2'') (resid 7 and (name H51 or name H52 or name H53)) 5.97 2.00 2.00
assign
 (resid 7 and name H2'') (resid 7 and name H6) 3.64 0.80 1.30
assign
 (resid 7 and name H2'') (resid 8 and name H5'') 4.24 0.80 1.30
assign
 (resid 7 and name H2'') (resid 8 and name H5') 3.23 0.50 0.90
assign
 (resid 7 and name H2'') (resid 8 and name H4') 4.64 1.30 1.70
assign
 (resid 7 and name H2'') (resid 8 and name H3') 3.93 0.80 1.30
assign
 (resid 7 and name H2'') (resid 8 and name H2') 4.80 1.30 1.70
assign
 (resid 7 and name H2'') (resid 8 and name H2'') 5.70 2.00 2.00
assign
 (resid 7 and name H2'') (resid 8 and name H1') 4.34 0.80 1.30
assign
 (resid 7 and name H2'') (resid 8 and name H5) 3.51 0.80 1.30
assign
 (resid 7 and name H2'') (resid 8 and name H6) 2.67 0.50 0.90
assign
 (resid 7 and name H2'') (resid 26 and (name HNA or name HNB or name HNC)) 6.31 2.00 2.00
assign
 (resid 7 and name H1') (resid 7 and (name H51 or name H52 or name H53)) 5.88 2.00 2.00
assign
 (resid 7 and name H1') (resid 7 and name H6) 3.57 0.80 1.30
assign
 (resid 7 and name H1') (resid 8 and name H5'') 4.83 1.30 1.70
assign
 (resid 7 and name H1') (resid 8 and name H5') 3.31 0.50 0.90
assign
 (resid 7 and name H1') (resid 8 and name H4') 4.63 1.30 1.70
assign
 (resid 7 and name H1') (resid 8 and name H3') 4.81 1.30 1.70
assign
 (resid 7 and name H1') (resid 8 and name H2') 5.78 2.00 2.00
assign
 (resid 7 and name H1') (resid 8 and name H2'') 6.15 2.00 2.00
assign
 (resid 7 and name H1') (resid 8 and name H1') 4.59 1.30 1.70
assign
 (resid 7 and name H1') (resid 8 and name H5) 4.55 1.30 1.70
assign
 (resid 7 and name H1') (resid 8 and name H6) 4.01 0.80 1.30
assign
 (resid 7 and name H1') (resid 10 and name H2) 4.45 0.80 1.30
assign
 (resid 7 and name H1') (resid 26 and (name HNA or name HNB or name HNC)) 4.73 1.30 1.70
assign
 (resid 7 and name H1') (resid 26 and name HA1) 4.76 1.30 1.70
assign
 (resid 7 and name H1') (resid 27 and (name HNA or name HNB or name HNC)) 6.03 2.00 2.00
assign
 (resid 7 and name H1') (resid 27 and (name H2A or name H2B or name H2C)) 5.25 1.30 1.70
assign
 (resid 7 and (name H51 or name H52 or name H53))
 (resid 7 and name H6) 3.03 0.50 0.90
assign
 (resid 7 and (name H51 or name H52 or name H53))
 (resid 8 and name H5) 4.66 1.30 1.70
assign
 (resid 7 and (name H51 or name H52 or name H53))
 (resid 8 and name H6) 6.29 2.00 2.00
assign
 (resid 7 and (name H51 or name H52 or name H53))
 (resid 26 and (name HNA or name HNB or name HNC)) 6.75 2.00 2.00
assign
 (resid 7 and name H6) (resid 8 and name H5') 6.17 2.00 2.00
assign
 (resid 7 and name H6) (resid 8 and name H5) 3.93 0.80 1.30
assign
 (resid 7 and name H6) (resid 8 and name H6) 5.34 1.30 1.70
assign
 (resid 7 and name H6) (resid 26 and (name HNA or name HNB or name HNC)) 5.76 2.00 2.00
assign
 (resid 8 and name H5'') (resid 8 and name H4') 2.42 0.50 0.90
assign
 (resid 8 and name H5'') (resid 8 and name H3') 2.86 0.50 0.90
assign
 (resid 8 and name H5'') (resid 8 and name H2') 5.07 1.30 1.70
assign
 (resid 8 and name H5'') (resid 8 and name H2'') 4.95 1.30 1.70
assign
 (resid 8 and name H5'') (resid 8 and name H1') 5.16 1.30 1.70
assign
 (resid 8 and name H5'') (resid 8 and name H6) 4.36 0.80 1.30
assign
 (resid 8 and name H5'') (resid 27 and (name H2A or name H2B or name H2C)) 6.44 2.00 2.00
assign
 (resid 8 and name H5') (resid 8 and name H4') 2.52 0.50 0.90
assign
 (resid 8 and name H5') (resid 8 and name H3') 3.42 0.50 0.90
assign
 (resid 8 and name H5') (resid 8 and name H2') 4.89 1.30 1.70
assign
 (resid 8 and name H5') (resid 8 and name H2'') 4.84 1.30 1.70
assign
 (resid 8 and name H5') (resid 8 and name H1') 4.21 0.80 1.30
assign
 (resid 8 and name H5') (resid 8 and name H5) 5.05 1.30 1.70
assign
 (resid 8 and name H5') (resid 8 and name H6) 4.14 0.80 1.30
assign
 (resid 8 and name H5') (resid 26 and (name HNA or name HNB or name HNC)) 6.02 2.00 2.00
assign
 (resid 8 and name H5') (resid 27 and (name H2A or name H2B or name H2C)) 5.94 2.00 2.00
assign
 (resid 8 and name H4') (resid 8 and name H3') 2.99 0.50 0.90
assign
 (resid 8 and name H4') (resid 8 and name H2') 3.94 0.80 1.30
assign
 (resid 8 and name H4') (resid 8 and name H2'') 3.16 0.50 0.90
assign
 (resid 8 and name H4') (resid 8 and name H1') 3.02 0.50 0.90
assign
 (resid 8 and name H4') (resid 8 and name H6) 4.01 0.80 1.30
assign
 (resid 8 and name H4') (resid 27 and (name H2A or name H2B or name H2C)) 5.91 2.00 2.00
assign
 (resid 8 and name H3') (resid 8 and name H2') 2.67 0.50 0.90
assign
 (resid 8 and name H3') (resid 8 and name H2'') 3.37 0.50 0.90
assign
 (resid 8 and name H3') (resid 8 and name H1') 3.96 0.80 1.30
assign
 (resid 8 and name H3') (resid 8 and name H5) 4.96 1.30 1.70
assign
 (resid 8 and name H3') (resid 8 and name H6) 2.75 0.50 0.90
assign
 (resid 8 and name H2') (resid 8 and name H1') 3.05 0.50 0.90
assign
 (resid 8 and name H2') (resid 8 and name H5) 4.35 0.80 1.30
assign
 (resid 8 and name H2') (resid 8 and name H6) 2.45 0.50 0.90
assign
 (resid 8 and name H2'') (resid 8 and name H1') 2.45 0.50 0.90
assign
 (resid 8 and name H2'') (resid 8 and name H5) 5.81 2.00 2.00
assign
 (resid 8 and name H2'') (resid 8 and name H6) 3.73 0.80 1.30
assign
 (resid 8 and name H1') (resid 8 and name H5) 5.14 1.30 1.70
assign
 (resid 8 and name H1') (resid 8 and name H6) 3.42 0.50 0.90
assign
 (resid 8 and name H1') (resid 10 and name H2) 4.25 0.80 1.30
assign
 (resid 8 and name H5) (resid 8 and name H6) 2.46 0.50 0.90
assign
 (resid 9 and name H5'') (resid 9 and name H4') 2.82 0.50 0.90
assign
 (resid 9 and name H5'') (resid 9 and name H3') 2.73 0.50 0.90
assign
 (resid 9 and name H5'') (resid 9 and name H2') 3.42 0.50 0.90
assign
 (resid 9 and name H5'') (resid 9 and name H2'') 4.52 1.30 1.70
assign
 (resid 9 and name H5'') (resid 9 and name H1') 4.86 1.30 1.70
assign
 (resid 9 and name H5'') (resid 9 and name H8) 4.50 1.30 1.70
assign
 (resid 9 and name H5') (resid 9 and name H4') 2.74 0.50 0.90
assign
 (resid 9 and name H5') (resid 9 and name H3') 3.92 0.80 1.30
assign
 (resid 9 and name H5') (resid 9 and name H2') 3.64 0.80 1.30
assign
 (resid 9 and name H5') (resid 9 and name H2'') 4.87 1.30 1.70
assign
 (resid 9 and name H5') (resid 9 and name H1') 4.52 1.30 1.70
assign
 (resid 9 and name H5') (resid 9 and name H8) 3.66 0.80 1.30
assign
 (resid 9 and name H4') (resid 9 and name H3') 2.94 0.50 0.90
assign
 (resid 9 and name H4') (resid 9 and name H2') 3.81 0.80 1.30
assign
 (resid 9 and name H4') (resid 9 and name H2'') 3.95 0.80 1.30
assign
 (resid 9 and name H4') (resid 9 and name H1') 3.19 0.50 0.90
assign
 (resid 9 and name H4') (resid 9 and name H8) 4.29 0.80 1.30
assign
 (resid 9 and name H4') (resid 10 and name H5'') 5.36 1.30 1.70
assign
 (resid 9 and name H4') (resid 10 and name H5') 4.68 1.30 1.70
assign
 (resid 9 and name H4') (resid 10 and name H8) 5.87 2.00 2.00
assign
 (resid 9 and name H3') (resid 9 and name H2') 2.48 0.50 0.90
assign
 (resid 9 and name H3') (resid 9 and name H2'') 2.76 0.50 0.90
assign
 (resid 9 and name H3') (resid 9 and name H1') 3.81 0.80 1.30
assign
 (resid 9 and name H3') (resid 9 and name H8) 4.32 0.80 1.30
assign
 (resid 9 and name H3') (resid 10 and name H5'') 5.44 1.30 1.70
assign
 (resid 9 and name H3') (resid 10 and name H5') 5.12 1.30 1.70
assign
 (resid 9 and name H3') (resid 10 and name H2') 5.86 2.00 2.00
assign
 (resid 9 and name H3') (resid 10 and name H8) 4.92 1.30 1.70
assign
 (resid 9 and name H2') (resid 9 and name H1') 3.14 0.50 0.90
assign
 (resid 9 and name H2') (resid 9 and name H8) 2.43 0.50 0.90
assign
 (resid 9 and name H2') (resid 10 and name H5'') 6.39 2.00 2.00
assign
 (resid 9 and name H2') (resid 10 and name H5') 5.31 1.30 1.70
assign
 (resid 9 and name H2') (resid 10 and name H2') 6.02 2.00 2.00
assign
 (resid 9 and name H2') (resid 10 and name H2'') 7.27 2.00 2.00
assign
 (resid 9 and name H2') (resid 10 and name H8) 4.36 0.80 1.30
assign
 (resid 9 and name H2') (resid 11 and (name H51 or name H52 or name H53)) 7.45 2.00 2.00
assign
 (resid 9 and name H2'') (resid 9 and name H1') 2.51 0.50 0.90
assign
 (resid 9 and name H2'') (resid 9 and name H8) 3.75 0.80 1.30
assign
 (resid 9 and name H2'') (resid 10 and name H5'') 4.45 0.80 1.30
assign
 (resid 9 and name H2'') (resid 10 and name H5') 3.94 0.80 1.30
assign
 (resid 9 and name H2'') (resid 10 and name H4') 5.12 1.30 1.70
assign
 (resid 9 and name H2'') (resid 10 and name H3') 5.26 1.30 1.70
assign
 (resid 9 and name H2'') (resid 10 and name H2') 4.19 0.80 1.30
assign
 (resid 9 and name H2'') (resid 10 and name H2'') 5.74 2.00 2.00
assign
 (resid 9 and name H2'') (resid 10 and name H1') 5.59 2.00 2.00
assign
 (resid 9 and name H2'') (resid 10 and name H8) 2.68 0.50 0.90
assign
 (resid 9 and name H2'') (resid 11 and (name H51 or name H52 or name H53)) 5.70 2.00 2.00
assign
 (resid 9 and name H1') (resid 9 and name H8) 3.39 0.50 0.90
assign
 (resid 9 and name H1') (resid 10 and name H5'') 4.27 0.80 1.30
assign
 (resid 9 and name H1') (resid 10 and name H5') 3.28 0.50 0.90
assign
 (resid 9 and name H1') (resid 10 and name H4') 4.70 1.30 1.70
assign
 (resid 9 and name H1') (resid 10 and name H3') 4.87 1.30 1.70
assign
 (resid 9 and name H1') (resid 10 and name H2') 5.33 1.30 1.70
assign
 (resid 9 and name H1') (resid 10 and name H2'') 6.68 2.00 2.00
assign
 (resid 9 and name H1') (resid 10 and name H8) 3.56 0.80 1.30
assign
 (resid 9 and name H8) (resid 10 and name H8) 5.04 1.30 1.70
assign
 (resid 10 and name H5'') (resid 10 and name H4') 2.43 0.50 0.90
assign
 (resid 10 and name H5'') (resid 10 and name H3') 2.59 0.50 0.90
assign
 (resid 10 and name H5'') (resid 10 and name H2') 3.65 0.80 1.30
assign
 (resid 10 and name H5'') (resid 10 and name H2'') 4.55 1.30 1.70
assign
 (resid 10 and name H5'') (resid 10 and name H1') 5.02 1.30 1.70
assign
 (resid 10 and name H5'') (resid 10 and name H8) 4.27 0.80 1.30
assign
 (resid 10 and name H5'') (resid 11 and name H5') 5.80 2.00 2.00
assign
 (resid 10 and name H5'') (resid 11 and (name H51 or name H52 or name H53)) 5.97 2.00 2.00
assign
 (resid 10 and name H5') (resid 10 and name H4') 2.47 0.50 0.90
assign
 (resid 10 and name H5') (resid 10 and name H3') 3.53 0.80 1.30
assign
 (resid 10 and name H5') (resid 10 and name H2') 3.89 0.80 1.30
assign
 (resid 10 and name H5') (resid 10 and name H2'') 4.72 1.30 1.70
assign
 (resid 10 and name H5') (resid 10 and name H1') 4.60 1.30 1.70
assign
 (resid 10 and name H5') (resid 10 and name H8) 3.91 0.80 1.30
assign
 (resid 10 and name H5') (resid 11 and name H5') 6.07 2.00 2.00
assign
 (resid 10 and name H5') (resid 11 and (name H51 or name H52 or name H53)) 6.41 2.00 2.00
assign
 (resid 10 and name H4') (resid 10 and name H3') 2.71 0.50 0.90
assign
 (resid 10 and name H4') (resid 10 and name H2') 3.52 0.80 1.30
assign
 (resid 10 and name H4') (resid 10 and name H2'') 3.69 0.80 1.30
assign
 (resid 10 and name H4') (resid 10 and name H1') 3.21 0.50 0.90
assign
 (resid 10 and name H4') (resid 10 and name H8) 4.39 0.80 1.30
assign
 (resid 10 and name H4') (resid 11 and name H5'') 4.87 1.30 1.70
assign
 (resid 10 and name H4') (resid 11 and name H5') 3.71 0.80 1.30
assign
 (resid 10 and name H4') (resid 11 and name H4') 5.31 1.30 1.70
assign
 (resid 10 and name H4') (resid 11 and (name H51 or name H52 or name H53)) 6.36 2.00 2.00
assign
 (resid 10 and name H4') (resid 11 and name H6) 5.44 1.30 1.70
assign
 (resid 10 and name H3') (resid 10 and name H2') 2.44 0.50 0.90
assign
 (resid 10 and name H3') (resid 10 and name H2'') 2.84 0.50 0.90
assign
 (resid 10 and name H3') (resid 10 and name H1') 3.82 0.80 1.30
assign
 (resid 10 and name H3') (resid 10 and name H8) 4.16 0.80 1.30
assign
 (resid 10 and name H3') (resid 11 and name H5'') 4.83 1.30 1.70
assign
 (resid 10 and name H3') (resid 11 and name H5') 3.88 0.80 1.30
assign
 (resid 10 and name H3') (resid 11 and name H4') 5.67 2.00 2.00
assign
 (resid 10 and name H3') (resid 11 and (name H51 or name H52 or name H53)) 4.81 1.30 1.70
assign
 (resid 10 and name H3') (resid 11 and name H6) 4.96 1.30 1.70
assign
 (resid 10 and name H2') (resid 10 and name H1') 3.04 0.50 0.90
assign
 (resid 10 and name H2') (resid 10 and name H8) 2.35 0.50 0.90
assign
 (resid 10 and name H2') (resid 11 and name H5'') 5.30 1.30 1.70
assign
 (resid 10 and name H2') (resid 11 and name H5') 4.48 0.80 1.30
assign
 (resid 10 and name H2') (resid 11 and name H4') 5.43 1.30 1.70
assign
 (resid 10 and name H2') (resid 11 and name H3') 5.57 2.00 2.00
assign
 (resid 10 and name H2') (resid 11 and name H2') 6.07 2.00 2.00
assign
 (resid 10 and name H2') (resid 11 and name H2'') 7.59 2.00 2.00
assign
 (resid 10 and name H2') (resid 11 and name H1') 6.46 2.00 2.00
assign
 (resid 10 and name H2') (resid 11 and (name H51 or name H52 or name H53)) 3.42 0.50 0.90
assign
 (resid 10 and name H2') (resid 11 and name H6) 3.91 0.80 1.30
assign
 (resid 10 and name H2'') (resid 10 and name H1') 2.45 0.50 0.90
assign
 (resid 10 and name H2'') (resid 10 and name H8) 3.73 0.80 1.30
assign
 (resid 10 and name H2'') (resid 11 and name H5'') 3.67 0.80 1.30
assign
 (resid 10 and name H2'') (resid 11 and name H5') 2.96 0.50 0.90
assign
 (resid 10 and name H2'') (resid 11 and name H4') 3.97 0.80 1.30
assign
 (resid 10 and name H2'') (resid 11 and name H3') 3.81 0.80 1.30
assign
 (resid 10 and name H2'') (resid 11 and name H2') 4.63 1.30 1.70
assign
 (resid 10 and name H2'') (resid 11 and name H2'') 5.92 2.00 2.00
assign
 (resid 10 and name H2'') (resid 11 and name H1') 4.92 1.30 1.70
assign
 (resid 10 and name H2'') (resid 11 and (name H51 or name H52 or name H53)) 3.55 0.80 1.30
assign
 (resid 10 and name H2'') (resid 11 and name H6) 2.59 0.50 0.90
assign
 (resid 10 and name H1') (resid 10 and name H2) 4.80 1.30 1.70
assign
 (resid 10 and name H1') (resid 10 and name H8) 3.47 0.50 0.90
assign
 (resid 10 and name H1') (resid 11 and name H5'') 4.15 0.80 1.30
assign
 (resid 10 and name H1') (resid 11 and name H5') 2.49 0.50 0.90
assign
 (resid 10 and name H1') (resid 11 and name H4') 3.62 0.80 1.30
assign
 (resid 10 and name H1') (resid 11 and name H3') 5.07 1.30 1.70
assign
 (resid 10 and name H1') (resid 11 and name H2') 5.17 1.30 1.70
assign
 (resid 10 and name H1') (resid 11 and name H2'') 5.20 1.30 1.70
assign
 (resid 10 and name H1') (resid 11 and name H1') 3.75 0.80 1.30
assign
 (resid 10 and name H1') (resid 11 and (name H51 or name H52 or name H53)) 4.97 1.30 1.70
assign
 (resid 10 and name H1') (resid 11 and name H6) 3.50 0.80 1.30
assign
 (resid 10 and name H2) (resid 11 and name H4') 4.47 0.80 1.30
assign
 (resid 10 and name H2) (resid 11 and name H2') 5.71 2.00 2.00
assign
 (resid 10 and name H2) (resid 11 and name H2'') 5.50 1.30 1.70
assign
 (resid 10 and name H2) (resid 11 and name H1') 3.37 0.50 0.90
assign
 (resid 10 and name H2) (resid 11 and name H6) 5.13 1.30 1.70
assign
 (resid 10 and name H2) (resid 26 and name HA1) 4.98 1.30 1.70
assign
 (resid 10 and name H2) (resid 27 and (name HNA or name HNB or name HNC)) 5.46 1.30 1.70
assign
 (resid 10 and name H2) (resid 27 and (name H2A or name H2B or name H2C)) 6.51 2.00 2.00
assign
 (resid 10 and name H8) (resid 11 and name H5'') 6.22 2.00 2.00
assign
 (resid 10 and name H8) (resid 11 and name H5') 5.45 1.30 1.70
assign
 (resid 10 and name H8) (resid 11 and (name H51 or name H52 or name H53)) 3.96 0.80 1.30
assign
 (resid 10 and name H8) (resid 11 and name H6) 5.11 1.30 1.70
assign
 (resid 11 and name H5'') (resid 11 and name H4') 2.44 0.50 0.90
assign
 (resid 11 and name H5'') (resid 11 and name H3') 2.43 0.50 0.90
assign
 (resid 11 and name H5'') (resid 11 and name H2') 4.29 0.80 1.30
assign
 (resid 11 and name H5'') (resid 11 and name H2'') 4.73 1.30 1.70
assign
 (resid 11 and name H5'') (resid 11 and name H1') 4.70 1.30 1.70
assign
 (resid 11 and name H5'') (resid 11 and (name H51 or name H52 or name H53)) 5.93 2.00 2.00
assign
 (resid 11 and name H5'') (resid 11 and name H6) 3.83 0.80 1.30
assign
 (resid 11 and name H5'') (resid 27 and (name HNA or name HNB or name HNC)) 7.38 2.00 2.00
assign
 (resid 11 and name H5') (resid 11 and name H4') 2.44 0.50 0.90
assign
 (resid 11 and name H5') (resid 11 and name H3') 3.51 0.80 1.30
assign
 (resid 11 and name H5') (resid 11 and name H2') 4.62 1.30 1.70
assign
 (resid 11 and name H5') (resid 11 and name H2'') 5.03 1.30 1.70
assign
 (resid 11 and name H5') (resid 11 and name H1') 4.30 0.80 1.30
assign
 (resid 11 and name H5') (resid 11 and (name H51 or name H52 or name H53)) 5.66 2.00 2.00
assign
 (resid 11 and name H5') (resid 11 and name H6) 3.75 0.80 1.30
assign
 (resid 11 and name H4') (resid 11 and name H3') 2.83 0.50 0.90
assign
 (resid 11 and name H4') (resid 11 and name H2') 3.78 0.80 1.30
assign
 (resid 11 and name H4') (resid 11 and name H2'') 3.44 0.50 0.90
assign
 (resid 11 and name H4') (resid 11 and name H1') 2.74 0.50 0.90
assign
 (resid 11 and name H4') (resid 11 and (name H51 or name H52 or name H53)) 6.04 2.00 2.00
assign
 (resid 11 and name H4') (resid 11 and name H6) 3.68 0.80 1.30
assign
 (resid 11 and name H4') (resid 12 and name H5') 4.81 1.30 1.70
assign
 (resid 11 and name H4') (resid 27 and (name HNA or name HNB or name HNC)) 5.37 1.30 1.70
assign
 (resid 11 and name H4') (resid 27 and name HA) 4.86 1.30 1.70
assign
 (resid 11 and name H4') (resid 27 and (name H2A or name H2B or name H2C)) 6.82 2.00 2.00
assign
 (resid 11 and name H3') (resid 11 and name H2') 2.46 0.50 0.90
assign
 (resid 11 and name H3') (resid 11 and name H2'') 3.01 0.50 0.90
assign
 (resid 11 and name H3') (resid 11 and name H1') 3.49 0.50 0.90
assign
 (resid 11 and name H3') (resid 11 and (name H51 or name H52 or name H53)) 5.71 2.00 2.00
assign
 (resid 11 and name H3') (resid 11 and name H6) 3.03 0.50 0.90
assign
 (resid 11 and name H3') (resid 12 and name H5'') 4.81 1.30 1.70
assign
 (resid 11 and name H3') (resid 12 and name H5') 4.25 0.80 1.30
assign
 (resid 11 and name H3') (resid 12 and name H4') 4.98 1.30 1.70
assign
 (resid 11 and name H3') (resid 12 and name H3') 4.00 0.80 1.30
assign
 (resid 11 and name H3') (resid 12 and name H2') 5.23 1.30 1.70
assign
 (resid 11 and name H3') (resid 12 and name H8) 4.33 0.80 1.30
assign
 (resid 11 and name H3') (resid 27 and (name HNA or name HNB or name HNC)) 5.40 1.30 1.70
assign
 (resid 11 and name H3') (resid 27 and name HA) 4.52 1.30 1.70
assign
 (resid 11 and name H2') (resid 11 and name H1') 3.08 0.50 0.90
assign
 (resid 11 and name H2') (resid 11 and (name H51 or name H52 or name H53)) 4.99 1.30 1.70
assign
 (resid 11 and name H2') (resid 11 and name H6) 2.42 0.50 0.90
assign
 (resid 11 and name H2') (resid 12 and name H5'') 5.94 2.00 2.00
assign
 (resid 11 and name H2') (resid 12 and name H5') 4.57 1.30 1.70
assign
 (resid 11 and name H2') (resid 12 and name H4') 4.70 1.30 1.70
assign
 (resid 11 and name H2') (resid 12 and name H3') 4.32 0.80 1.30
assign
 (resid 11 and name H2') (resid 12 and name H2') 4.30 0.80 1.30
assign
 (resid 11 and name H2') (resid 12 and name H2'') 5.52 2.00 2.00
assign
 (resid 11 and name H2') (resid 12 and name H1') 5.10 1.30 1.70
assign
 (resid 11 and name H2') (resid 12 and name H8) 3.24 0.50 0.90
assign
 (resid 11 and name H2') (resid 26 and name HA1) 6.74 2.00 2.00
assign
 (resid 11 and name H2') (resid 27 and (name HNA or name HNB or name HNC)) 4.77 1.30 1.70
assign
 (resid 11 and name H2') (resid 27 and name HA) 5.19 1.30 1.70
assign
 (resid 11 and name H2') (resid 27 and (name H1A or name H1B or name H1C)) 8.16 2.00 2.00
assign
 (resid 11 and name H2') (resid 27 and (name H2A or name H2B or name H2C)) 7.84 2.00 2.00
assign
 (resid 11 and name H2'') (resid 11 and name H1') 2.37 0.50 0.90
assign
 (resid 11 and name H2'') (resid 11 and (name H51 or name H52 or name H53)) 5.40 1.30 1.70
assign
 (resid 11 and name H2'') (resid 11 and name H6) 3.92 0.80 1.30
assign
 (resid 11 and name H2'') (resid 12 and name H5'') 4.78 1.30 1.70
assign
 (resid 11 and name H2'') (resid 12 and name H5') 3.15 0.50 0.90
assign
 (resid 11 and name H2'') (resid 12 and name H4') 3.60 0.80 1.30
assign
 (resid 11 and name H2'') (resid 12 and name H3') 4.04 0.80 1.30
assign
 (resid 11 and name H2'') (resid 12 and name H2') 4.36 0.80 1.30
assign
 (resid 11 and name H2'') (resid 12 and name H2'') 5.07 1.30 1.70
assign
 (resid 11 and name H2'') (resid 12 and name H1') 4.19 0.80 1.30
assign
 (resid 11 and name H2'') (resid 12 and name H8) 3.87 0.80 1.30
assign
 (resid 11 and name H2'') (resid 23 and name HN) 5.60 2.00 2.00
assign
 (resid 11 and name H2'') (resid 23 and (name H2A or name H2B or name H2C)) 6.36 2.00 2.00
assign
 (resid 11 and name H2'') (resid 26 and name HA1) 5.36 1.30 1.70
assign
 (resid 11 and name H2'') (resid 26 and name HA2) 5.56 2.00 2.00
assign
 (resid 11 and name H2'') (resid 27 and (name HNA or name HNB or name HNC)) 3.51 0.80 1.30
assign
 (resid 11 and name H2'') (resid 27 and name HA) 3.52 0.80 1.30
assign
 (resid 11 and name H2'') (resid 27 and (name H1A or name H1B or name H1C)) 6.09 2.00 2.00
assign
 (resid 11 and name H2'') (resid 27 and (name H2A or name H2B or name H2C)) 5.76 2.00 2.00
assign
 (resid 11 and name H1') (resid 11 and (name H51 or name H52 or name H53)) 5.77 2.00 2.00
assign
 (resid 11 and name H1') (resid 11 and name H6) 3.38 0.50 0.90
assign
 (resid 11 and name H1') (resid 12 and name H5'') 6.85 2.00 2.00
assign
 (resid 11 and name H1') (resid 12 and name H5') 4.55 1.30 1.70
assign
 (resid 11 and name H1') (resid 12 and name H4') 5.57 2.00 2.00
assign
 (resid 11 and name H1') (resid 12 and name H3') 5.97 2.00 2.00
assign
 (resid 11 and name H1') (resid 12 and name H1') 6.20 2.00 2.00
assign
 (resid 11 and name H1') (resid 12 and name H8) 5.28 1.30 1.70
assign
 (resid 11 and name H1') (resid 26 and name HA1) 4.75 1.30 1.70
assign
 (resid 11 and name H1') (resid 26 and name HA2) 5.64 2.00 2.00
assign
 (resid 11 and name H1') (resid 27 and (name HNA or name HNB or name HNC)) 3.52 0.80 1.30
assign
 (resid 11 and name H1') (resid 27 and name HA) 3.80 0.80 1.30
assign
 (resid 11 and name H1') (resid 27 and (name H1A or name H1B or name H1C)) 5.87 2.00 2.00
assign
 (resid 11 and name H1') (resid 27 and (name H2A or name H2B or name H2C)) 5.11 1.30 1.70
assign
 (resid 11 and (name H51 or name H52 or name H53))
 (resid 11 and name H6) 3.12 0.50 0.90
assign
 (resid 11 and (name H51 or name H52 or name H53))
 (resid 12 and name H8) 6.25 2.00 2.00
assign
 (resid 11 and (name H51 or name H52 or name H53))
 (resid 17 and (name H4A or name H4B or name H4C)) 7.30 2.00 2.00
assign
 (resid 11 and (name H51 or name H52 or name H53))
 (resid 17 and (name H6A or name H6B or name H6C)) 6.50 2.00 2.00
assign
 (resid 11 and name H6) (resid 12 and name H8) 4.59 1.30 1.70
assign
 (resid 11 and name H6) (resid 27 and (name HNA or name HNB or name HNC)) 6.24 2.00 2.00
assign
 (resid 12 and name H5'') (resid 12 and name H4') 2.56 0.50 0.90
assign
 (resid 12 and name H5'') (resid 12 and name H3') 3.08 0.50 0.90
assign
 (resid 12 and name H5'') (resid 12 and name H2') 5.06 1.30 1.70
assign
 (resid 12 and name H5'') (resid 12 and name H2'') 4.55 1.30 1.70
assign
 (resid 12 and name H5'') (resid 12 and name H1') 5.05 1.30 1.70
assign
 (resid 12 and name H5'') (resid 12 and name H8) 6.40 2.00 2.00
assign
 (resid 12 and name H5'') (resid 13 and name H5') 5.12 1.30 1.70
assign
 (resid 12 and name H5'') (resid 23 and name HN) 6.10 2.00 2.00
assign
 (resid 12 and name H5'') (resid 23 and name HB) 5.52 2.00 2.00
assign
 (resid 12 and name H5'') (resid 23 and (name H2A or name H2B or name H2C)) 5.96 2.00 2.00
assign
 (resid 12 and name H5'') (resid 27 and (name HNA or name HNB or name HNC)) 6.01 2.00 2.00
assign
 (resid 12 and name H5'') (resid 27 and name HA) 4.21 0.80 1.30
assign
 (resid 12 and name H5'') (resid 27 and name HB) 5.91 2.00 2.00
assign
 (resid 12 and name H5'') (resid 27 and (name H1A or name H1B or name H1C)) 4.39 0.80 1.30
assign
 (resid 12 and name H5'') (resid 27 and (name H2A or name H2B or name H2C)) 7.20 2.00 2.00
assign
 (resid 12 and name H5') (resid 12 and name H4') 1.99 0.30 0.50
assign
 (resid 12 and name H5') (resid 12 and name H3') 3.24 0.50 0.90
assign
 (resid 12 and name H5') (resid 12 and name H2') 4.87 1.30 1.70
assign
 (resid 12 and name H5') (resid 12 and name H2'') 4.68 1.30 1.70
assign
 (resid 12 and name H5') (resid 12 and name H1') 4.21 0.80 1.30
assign
 (resid 12 and name H5') (resid 12 and name H8) 4.90 1.30 1.70
assign
 (resid 12 and name H5') (resid 13 and name H5') 5.93 2.00 2.00
assign
 (resid 12 and name H5') (resid 23 and name HN) 5.81 2.00 2.00
assign
 (resid 12 and name H5') (resid 23 and name HB) 5.48 1.30 1.70
assign
 (resid 12 and name H5') (resid 23 and (name H2A or name H2B or name H2C)) 5.44 1.30 1.70
assign
 (resid 12 and name H5') (resid 27 and (name HNA or name HNB or name HNC)) 4.43 0.80 1.30
assign
 (resid 12 and name H5') (resid 27 and name HA) 2.40 0.50 0.90
assign
 (resid 12 and name H5') (resid 27 and name HB) 4.83 1.30 1.70
assign
 (resid 12 and name H5') (resid 27 and (name H1A or name H1B or name H1C)) 3.57 0.80 1.30
assign
 (resid 12 and name H5') (resid 27 and (name H2A or name H2B or name H2C)) 4.70 1.30 1.70
assign
 (resid 12 and name H4') (resid 12 and name H3') 2.73 0.50 0.90
assign
 (resid 12 and name H4') (resid 12 and name H2') 3.73 0.80 1.30
assign
 (resid 12 and name H4') (resid 12 and name H2'') 3.02 0.50 0.90
assign
 (resid 12 and name H4') (resid 12 and name H1') 2.73 0.50 0.90
assign
 (resid 12 and name H4') (resid 12 and name H8) 5.30 1.30 1.70
assign
 (resid 12 and name H4') (resid 13 and name H5'') 5.54 2.00 2.00
assign
 (resid 12 and name H4') (resid 13 and name H5') 3.99 0.80 1.30
assign
 (resid 12 and name H4') (resid 13 and name H4') 6.18 2.00 2.00
assign
 (resid 12 and name H4') (resid 17 and name H7) 5.36 1.30 1.70
assign
 (resid 12 and name H4') (resid 17 and name H8) 4.83 1.30 1.70
assign
 (resid 12 and name H4') (resid 20 and name HG1) 5.06 1.30 1.70
assign
 (resid 12 and name H4') (resid 20 and name HG2) 5.92 2.00 2.00
assign
 (resid 12 and name H4') (resid 20 and name HD1) 5.58 2.00 2.00
assign
 (resid 12 and name H4') (resid 20 and name HD2) 6.86 2.00 2.00
assign
 (resid 12 and name H4') (resid 23 and name HN) 4.66 1.30 1.70
assign
 (resid 12 and name H4') (resid 23 and name HA) 5.14 1.30 1.70
assign
 (resid 12 and name H4') (resid 23 and name HB) 4.28 0.80 1.30
assign
 (resid 12 and name H4') (resid 23 and (name H2A or name H2B or name H2C)) 3.45 0.50 0.90
assign
 (resid 12 and name H4') (resid 24 and name HN) 6.60 2.00 2.00
assign
 (resid 12 and name H4') (resid 27 and (name HNA or name HNB or name HNC)) 4.21 0.80 1.30
assign
 (resid 12 and name H4') (resid 27 and name HA) 2.72 0.50 0.90
assign
 (resid 12 and name H4') (resid 27 and name HB) 4.50 0.80 1.30
assign
 (resid 12 and name H4') (resid 27 and (name H1A or name H1B or name H1C)) 4.02 0.80 1.30
assign
 (resid 12 and name H4') (resid 27 and (name H2A or name H2B or name H2C)) 4.41 0.80 1.30
assign
 (resid 12 and name H3') (resid 12 and name H2') 2.40 0.50 0.90
assign
 (resid 12 and name H3') (resid 12 and name H2'') 3.12 0.50 0.90
assign
 (resid 12 and name H3') (resid 12 and name H1') 3.74 0.80 1.30
assign
 (resid 12 and name H3') (resid 12 and name H8) 3.30 0.50 0.90
assign
 (resid 12 and name H3') (resid 13 and name H5'') 5.30 1.30 1.70
assign
 (resid 12 and name H3') (resid 13 and name H5') 4.24 0.80 1.30
assign
 (resid 12 and name H3') (resid 17 and name H7) 4.94 1.30 1.70
assign
 (resid 12 and name H3') (resid 17 and name H8) 4.91 1.30 1.70
assign
 (resid 12 and name H3') (resid 17 and (name H6A or name H6B or name H6C)) 6.52 2.00 2.00
assign
 (resid 12 and name H3') (resid 23 and name HN) 6.23 2.00 2.00
assign
 (resid 12 and name H3') (resid 23 and (name H2A or name H2B or name H2C)) 5.82 2.00 2.00
assign
 (resid 12 and name H3') (resid 27 and (name HNA or name HNB or name HNC)) 5.74 2.00 2.00
assign
 (resid 12 and name H3') (resid 27 and name HA) 4.45 0.80 1.30
assign
 (resid 12 and name H3') (resid 27 and (name H1A or name H1B or name H1C)) 6.33 2.00 2.00
assign
 (resid 12 and name H2') (resid 12 and name H1') 3.09 0.50 0.90
assign
 (resid 12 and name H2') (resid 12 and name H8) 2.21 0.50 0.90
assign
 (resid 12 and name H2') (resid 13 and name H5'') 4.97 1.30 1.70
assign
 (resid 12 and name H2') (resid 13 and name H5') 4.17 0.80 1.30
assign
 (resid 12 and name H2') (resid 13 and name H4') 5.41 1.30 1.70
assign
 (resid 12 and name H2') (resid 13 and name H3') 5.09 1.30 1.70
assign
 (resid 12 and name H2') (resid 13 and name H1') 5.73 2.00 2.00
assign
 (resid 12 and name H2') (resid 13 and name H5) 6.07 2.00 2.00
assign
 (resid 12 and name H2') (resid 13 and name H6) 4.93 1.30 1.70
assign
 (resid 12 and name H2') (resid 17 and name H7) 2.93 0.50 0.90
assign
 (resid 12 and name H2') (resid 17 and name H8) 3.20 0.50 0.90
assign
 (resid 12 and name H2') (resid 17 and (name H6A or name H6B or name H6C)) 4.72 1.30 1.70
assign
 (resid 12 and name H2') (resid 20 and name HG1) 5.40 1.30 1.70
assign
 (resid 12 and name H2') (resid 20 and name HG2) 6.80 2.00 2.00
assign
 (resid 12 and name H2') (resid 20 and name HD1) 6.99 2.00 2.00
assign
 (resid 12 and name H2') (resid 23 and name HN) 4.64 1.30 1.70
assign
 (resid 12 and name H2') (resid 23 and name HA) 6.82 2.00 2.00
assign
 (resid 12 and name H2') (resid 23 and name HB) 6.34 2.00 2.00
assign
 (resid 12 and name H2') (resid 23 and (name H2A or name H2B or name H2C)) 5.54 2.00 2.00
assign
 (resid 12 and name H2') (resid 27 and (name HNA or name HNB or name HNC)) 6.22 2.00 2.00
assign
 (resid 12 and name H2') (resid 27 and name HA) 5.67 2.00 2.00
assign
 (resid 12 and name H2'') (resid 12 and name H1') 2.34 0.50 0.90
assign
 (resid 12 and name H2'') (resid 12 and name H8) 3.76 0.80 1.30
assign
 (resid 12 and name H2'') (resid 13 and name H5'') 3.94 0.80 1.30
assign
 (resid 12 and name H2'') (resid 13 and name H5') 2.71 0.50 0.90
assign
 (resid 12 and name H2'') (resid 13 and name H4') 4.05 0.80 1.30
assign
 (resid 12 and name H2'') (resid 13 and name H3') 4.06 0.80 1.30
assign
 (resid 12 and name H2'') (resid 13 and name H2') 5.22 1.30 1.70
assign
 (resid 12 and name H2'') (resid 13 and name H2'') 6.40 2.00 2.00
assign
 (resid 12 and name H2'') (resid 13 and name H1') 4.38 0.80 1.30
assign
 (resid 12 and name H2'') (resid 13 and name H6) 4.55 1.30 1.70
assign
 (resid 12 and name H2'') (resid 17 and name H7) 3.40 0.50 0.90
assign
 (resid 12 and name H2'') (resid 17 and name H8) 2.40 0.50 0.90
assign
 (resid 12 and name H2'') (resid 17 and (name H6A or name H6B or name H6C)) 5.29 1.30 1.70
assign
 (resid 12 and name H2'') (resid 20 and name HB1) 4.49 0.80 1.30
assign
 (resid 12 and name H2'') (resid 20 and name HB2) 5.89 2.00 2.00
assign
 (resid 12 and name H2'') (resid 20 and name HG1) 3.61 0.80 1.30
assign
 (resid 12 and name H2'') (resid 20 and name HG2) 4.45 0.80 1.30
assign
 (resid 12 and name H2'') (resid 20 and name HD1) 5.31 1.30 1.70
assign
 (resid 12 and name H2'') (resid 20 and name HD2) 5.95 2.00 2.00
assign
 (resid 12 and name H2'') (resid 23 and name HN) 4.54 1.30 1.70
assign
 (resid 12 and name H2'') (resid 23 and name HA) 5.27 1.30 1.70
assign
 (resid 12 and name H2'') (resid 23 and name HB) 4.99 1.30 1.70
assign
 (resid 12 and name H2'') (resid 23 and (name H2A or name H2B or name H2C)) 3.42 0.50 0.90
assign
 (resid 12 and name H2'') (resid 27 and (name HNA or name HNB or name HNC)) 6.39 2.00 2.00
assign
 (resid 12 and name H2'') (resid 27 and name HA) 5.41 1.30 1.70
assign
 (resid 12 and name H2'') (resid 27 and (name H1A or name H1B or name H1C)) 6.43 2.00 2.00
assign
 (resid 12 and name H1') (resid 12 and name H8) 3.64 0.80 1.30
assign
 (resid 12 and name H1') (resid 13 and name H5'') 5.92 2.00 2.00
assign
 (resid 12 and name H1') (resid 13 and name H5') 4.39 0.80 1.30
assign
 (resid 12 and name H1') (resid 13 and name H4') 5.57 2.00 2.00
assign
 (resid 12 and name H1') (resid 13 and name H1') 5.05 1.30 1.70
assign
 (resid 12 and name H1') (resid 17 and name H7) 4.23 0.80 1.30
assign
 (resid 12 and name H1') (resid 17 and name H8) 3.01 0.50 0.90
assign
 (resid 12 and name H1') (resid 17 and (name H6A or name H6B or name H6C)) 5.48 1.30 1.70
assign
 (resid 12 and name H1') (resid 20 and name HB1) 4.90 1.30 1.70
assign
 (resid 12 and name H1') (resid 20 and name HG1) 4.04 0.80 1.30
assign
 (resid 12 and name H1') (resid 20 and name HG2) 5.26 1.30 1.70
assign
 (resid 12 and name H1') (resid 20 and name HD1) 4.99 1.30 1.70
assign
 (resid 12 and name H1') (resid 20 and name HD2) 6.01 2.00 2.00
assign
 (resid 12 and name H1') (resid 23 and name HN) 2.61 0.50 0.90
assign
 (resid 12 and name H1') (resid 23 and name HA) 4.01 0.80 1.30
assign
 (resid 12 and name H1') (resid 23 and name HB) 4.05 0.80 1.30
assign
 (resid 12 and name H1') (resid 23 and (name H2A or name H2B or name H2C)) 3.14 0.50 0.90
assign
 (resid 12 and name H1') (resid 24 and name HN) 5.67 2.00 2.00
assign
 (resid 12 and name H1') (resid 26 and name HA1) 5.97 2.00 2.00
assign
 (resid 12 and name H1') (resid 26 and name HA2) 4.63 1.30 1.70
assign
 (resid 12 and name H1') (resid 27 and (name HNA or name HNB or name HNC)) 4.03 0.80 1.30
assign
 (resid 12 and name H1') (resid 27 and name HA) 3.69 0.80 1.30
assign
 (resid 12 and name H1') (resid 27 and name HB) 5.50 1.30 1.70
assign
 (resid 12 and name H1') (resid 27 and (name H1A or name H1B or name H1C)) 5.41 1.30 1.70
assign
 (resid 12 and name H1') (resid 27 and (name H2A or name H2B or name H2C)) 6.35 2.00 2.00
assign
 (resid 12 and name H8) (resid 13 and name H5'') 6.50 2.00 2.00
assign
 (resid 12 and name H8) (resid 13 and name H5') 5.92 2.00 2.00
assign
 (resid 12 and name H8) (resid 17 and name H7) 3.60 0.80 1.30
assign
 (resid 12 and name H8) (resid 17 and name H8) 4.30 0.80 1.30
assign
 (resid 12 and name H8) (resid 17 and (name H6A or name H6B or name H6C)) 4.13 0.80 1.30
assign
 (resid 12 and name H8) (resid 23 and name HN) 4.13 0.80 1.30
assign
 (resid 12 and name H8) (resid 23 and (name H2A or name H2B or name H2C)) 6.27 2.00 2.00
assign
 (resid 12 and name H8) (resid 27 and (name HNA or name HNB or name HNC)) 5.37 1.30 1.70
assign
 (resid 13 and name H5'') (resid 13 and name H4') 2.59 0.50 0.90
assign
 (resid 13 and name H5'') (resid 13 and name H3') 2.24 0.50 0.90
assign
 (resid 13 and name H5'') (resid 13 and name H2') 4.56 1.30 1.70
assign
 (resid 13 and name H5'') (resid 13 and name H2'') 4.50 0.80 1.30
assign
 (resid 13 and name H5'') (resid 13 and name H1') 4.75 1.30 1.70
assign
 (resid 13 and name H5'') (resid 13 and name H6) 4.56 1.30 1.70
assign
 (resid 13 and name H5'') (resid 14 and name H5'') 5.56 2.00 2.00
assign
 (resid 13 and name H5'') (resid 14 and name H5') 4.26 0.80 1.30
assign
 (resid 13 and name H5'') (resid 14 and name H4') 6.51 2.00 2.00
assign
 (resid 13 and name H5'') (resid 14 and (name H51 or name H52 or name H53)) 6.73 2.00 2.00
assign
 (resid 13 and name H5'') (resid 14 and name H6) 6.29 2.00 2.00
assign
 (resid 13 and name H5'') (resid 17 and name H7) 5.00 1.30 1.70
assign
 (resid 13 and name H5'') (resid 17 and name H8) 4.59 1.30 1.70
assign
 (resid 13 and name H5'') (resid 20 and name HB1) 5.36 1.30 1.70
assign
 (resid 13 and name H5'') (resid 20 and name HB2) 6.08 2.00 2.00
assign
 (resid 13 and name H5'') (resid 20 and name HG1) 4.76 1.30 1.70
assign
 (resid 13 and name H5'') (resid 20 and name HG2) 4.41 0.80 1.30
assign
 (resid 13 and name H5'') (resid 20 and name HD1) 6.14 2.00 2.00
assign
 (resid 13 and name H5'') (resid 20 and name HD2) 6.22 2.00 2.00
assign
 (resid 13 and name H5'') (resid 23 and name HA) 7.23 2.00 2.00
assign
 (resid 13 and name H5'') (resid 23 and name HB) 7.37 2.00 2.00
assign
 (resid 13 and name H5'') (resid 23 and (name H2A or name H2B or name H2C)) 5.57 2.00 2.00
assign
 (resid 13 and name H5') (resid 13 and name H4') 2.41 0.50 0.90
assign
 (resid 13 and name H5') (resid 13 and name H3') 3.15 0.50 0.90
assign
 (resid 13 and name H5') (resid 13 and name H2') 4.97 1.30 1.70
assign
 (resid 13 and name H5') (resid 13 and name H2'') 5.16 1.30 1.70
assign
 (resid 13 and name H5') (resid 13 and name H1') 4.24 0.80 1.30
assign
 (resid 13 and name H5') (resid 13 and name H6) 4.71 1.30 1.70
assign
 (resid 13 and name H5') (resid 14 and name H5'') 6.23 2.00 2.00
assign
 (resid 13 and name H5') (resid 14 and name H5') 4.48 0.80 1.30
assign
 (resid 13 and name H5') (resid 14 and name H4') 6.55 2.00 2.00
assign
 (resid 13 and name H5') (resid 17 and name H7) 4.70 1.30 1.70
assign
 (resid 13 and name H5') (resid 17 and name H8) 3.62 0.80 1.30
assign
 (resid 13 and name H5') (resid 20 and name HB1) 4.66 1.30 1.70
assign
 (resid 13 and name H5') (resid 20 and name HB2) 5.22 1.30 1.70
assign
 (resid 13 and name H5') (resid 20 and name HG1) 3.27 0.50 0.90
assign
 (resid 13 and name H5') (resid 20 and name HG2) 3.40 0.50 0.90
assign
 (resid 13 and name H5') (resid 20 and name HD1) 4.81 1.30 1.70
assign
 (resid 13 and name H5') (resid 20 and name HD2) 5.15 1.30 1.70
assign
 (resid 13 and name H5') (resid 23 and name HN) 5.89 2.00 2.00
assign
 (resid 13 and name H5') (resid 23 and name HA) 5.20 1.30 1.70
assign
 (resid 13 and name H5') (resid 23 and name HB) 5.26 1.30 1.70
assign
 (resid 13 and name H5') (resid 23 and (name H2A or name H2B or name H2C)) 3.97 0.80 1.30
assign
 (resid 13 and name H4') (resid 13 and name H3') 2.71 0.50 0.90
assign
 (resid 13 and name H4') (resid 13 and name H2') 3.78 0.80 1.30
assign
 (resid 13 and name H4') (resid 13 and name H2'') 2.90 0.50 0.90
assign
 (resid 13 and name H4') (resid 13 and name H1') 2.50 0.50 0.90
assign
 (resid 13 and name H4') (resid 13 and name H6) 4.17 0.80 1.30
assign
 (resid 13 and name H4') (resid 14 and name H5'') 4.31 0.80 1.30
assign
 (resid 13 and name H4') (resid 14 and name H5') 2.52 0.50 0.90
assign
 (resid 13 and name H4') (resid 14 and name H4') 4.35 0.80 1.30
assign
 (resid 13 and name H4') (resid 14 and name H3') 5.39 1.30 1.70
assign
 (resid 13 and name H4') (resid 14 and name H2') 5.90 2.00 2.00
assign
 (resid 13 and name H4') (resid 14 and name H1') 4.80 1.30 1.70
assign
 (resid 13 and name H4') (resid 14 and (name H51 or name H52 or name H53)) 5.65 2.00 2.00
assign
 (resid 13 and name H4') (resid 14 and name H6) 4.53 1.30 1.70
assign
 (resid 13 and name H4') (resid 17 and name H7) 4.51 1.30 1.70
assign
 (resid 13 and name H4') (resid 17 and name H8) 3.37 0.50 0.90
assign
 (resid 13 and name H4') (resid 19 and name HA) 6.90 2.00 2.00
assign
 (resid 13 and name H4') (resid 20 and name HA) 4.79 1.30 1.70
assign
 (resid 13 and name H4') (resid 20 and name HB1) 2.90 0.50 0.90
assign
 (resid 13 and name H4') (resid 20 and name HB2) 3.62 0.80 1.30
assign
 (resid 13 and name H4') (resid 20 and name HG1) 2.77 0.50 0.90
assign
 (resid 13 and name H4') (resid 20 and name HG2) 2.43 0.50 0.90
assign
 (resid 13 and name H4') (resid 20 and name HD1) 4.66 1.30 1.70
assign
 (resid 13 and name H4') (resid 20 and name HD2) 4.55 1.30 1.70
assign
 (resid 13 and name H4') (resid 21 and name HA1) 6.99 2.00 2.00
assign
 (resid 13 and name H4') (resid 21 and name HA2) 5.68 2.00 2.00
assign
 (resid 13 and name H4') (resid 23 and name HA) 5.59 2.00 2.00
assign
 (resid 13 and name H4') (resid 23 and name HB) 6.55 2.00 2.00
assign
 (resid 13 and name H4') (resid 23 and (name H2A or name H2B or name H2C)) 4.87 1.30 1.70
assign
 (resid 13 and name H3') (resid 13 and name H2') 2.26 0.50 0.90
assign
 (resid 13 and name H3') (resid 13 and name H2'') 3.02 0.50 0.90
assign
 (resid 13 and name H3') (resid 13 and name H1') 3.57 0.80 1.30
assign
 (resid 13 and name H3') (resid 13 and name H5) 4.98 1.30 1.70
assign
 (resid 13 and name H3') (resid 13 and name H6) 3.01 0.50 0.90
assign
 (resid 13 and name H3') (resid 14 and name H5'') 5.16 1.30 1.70
assign
 (resid 13 and name H3') (resid 14 and name H5') 3.85 0.80 1.30
assign
 (resid 13 and name H3') (resid 14 and name H4') 5.91 2.00 2.00
assign
 (resid 13 and name H3') (resid 14 and name H3') 5.87 2.00 2.00
assign
 (resid 13 and name H3') (resid 14 and (name H51 or name H52 or name H53)) 5.08 1.30 1.70
assign
 (resid 13 and name H3') (resid 14 and name H6) 5.02 1.30 1.70
assign
 (resid 13 and name H3') (resid 17 and name H7) 4.18 0.80 1.30
assign
 (resid 13 and name H3') (resid 17 and name H8) 4.17 0.80 1.30
assign
 (resid 13 and name H3') (resid 20 and name HB1) 4.62 1.30 1.70
assign
 (resid 13 and name H3') (resid 20 and name HB2) 6.22 2.00 2.00
assign
 (resid 13 and name H3') (resid 20 and name HG1) 5.08 1.30 1.70
assign
 (resid 13 and name H3') (resid 20 and name HG2) 5.23 1.30 1.70
assign
 (resid 13 and name H3') (resid 23 and (name H2A or name H2B or name H2C)) 6.38 2.00 2.00
assign
 (resid 13 and name H2') (resid 13 and name H1') 3.15 0.50 0.90
assign
 (resid 13 and name H2') (resid 13 and name H5) 4.24 0.80 1.30
assign
 (resid 13 and name H2') (resid 13 and name H6) 2.22 0.50 0.90
assign
 (resid 13 and name H2') (resid 14 and name H5'') 5.38 1.30 1.70
assign
 (resid 13 and name H2') (resid 14 and name H5') 4.20 0.80 1.30
assign
 (resid 13 and name H2') (resid 14 and name H4') 6.16 2.00 2.00
assign
 (resid 13 and name H2') (resid 14 and name H3') 5.58 2.00 2.00
assign
 (resid 13 and name H2') (resid 14 and name H2') 5.51 2.00 2.00
assign
 (resid 13 and name H2') (resid 14 and name H2'') 7.36 2.00 2.00
assign
 (resid 13 and name H2') (resid 14 and name H1') 6.32 2.00 2.00
assign
 (resid 13 and name H2') (resid 14 and (name H51 or name H52 or name H53)) 3.08 0.50 0.90
assign
 (resid 13 and name H2') (resid 14 and name H6) 3.45 0.50 0.90
assign
 (resid 13 and name H2') (resid 15 and (name H51 or name H52 or name H53)) 6.84 2.00 2.00
assign
 (resid 13 and name H2') (resid 17 and name H7) 4.16 0.80 1.30
assign
 (resid 13 and name H2') (resid 17 and name H8) 4.71 1.30 1.70
assign
 (resid 13 and name H2') (resid 17 and (name H6A or name H6B or name H6C)) 6.94 2.00 2.00
assign
 (resid 13 and name H2') (resid 20 and name HB1) 5.09 1.30 1.70
assign
 (resid 13 and name H2') (resid 20 and name HB2) 5.86 2.00 2.00
assign
 (resid 13 and name H2') (resid 20 and name HG1) 5.74 2.00 2.00
assign
 (resid 13 and name H2') (resid 20 and name HG2) 5.60 2.00 2.00
assign
 (resid 13 and name H2') (resid 23 and (name H2A or name H2B or name H2C)) 8.36 2.00 2.00
assign
 (resid 13 and name H2'') (resid 13 and name H1') 2.36 0.50 0.90
assign
 (resid 13 and name H2'') (resid 13 and name H5) 5.78 2.00 2.00
assign
 (resid 13 and name H2'') (resid 13 and name H6) 3.71 0.80 1.30
assign
 (resid 13 and name H2'') (resid 14 and name H5'') 3.86 0.80 1.30
assign
 (resid 13 and name H2'') (resid 14 and name H5') 2.81 0.50 0.90
assign
 (resid 13 and name H2'') (resid 14 and name H4') 4.28 0.80 1.30
assign
 (resid 13 and name H2'') (resid 14 and name H3') 3.98 0.80 1.30
assign
 (resid 13 and name H2'') (resid 14 and name H2') 4.34 0.80 1.30
assign
 (resid 13 and name H2'') (resid 14 and name H2'') 5.67 2.00 2.00
assign
 (resid 13 and name H2'') (resid 14 and name H1') 4.73 1.30 1.70
assign
 (resid 13 and name H2'') (resid 14 and (name H51 or name H52 or name H53)) 3.76 0.80 1.30
assign
 (resid 13 and name H2'') (resid 14 and name H6) 2.41 0.50 0.90
assign
 (resid 13 and name H2'') (resid 15 and (name H51 or name H52 or name H53)) 5.93 2.00 2.00
assign
 (resid 13 and name H2'') (resid 17 and name H7) 5.49 1.30 1.70
assign
 (resid 13 and name H2'') (resid 17 and name H8) 4.81 1.30 1.70
assign
 (resid 13 and name H2'') (resid 20 and name HA) 5.22 1.30 1.70
assign
 (resid 13 and name H2'') (resid 20 and name HB1) 3.55 0.80 1.30
assign
 (resid 13 and name H2'') (resid 20 and name HB2) 4.65 1.30 1.70
assign
 (resid 13 and name H2'') (resid 20 and name HG1) 4.87 1.30 1.70
assign
 (resid 13 and name H2'') (resid 20 and name HG2) 4.81 1.30 1.70
assign
 (resid 13 and name H2'') (resid 21 and name HA2) 5.74 2.00 2.00
assign
 (resid 13 and name H2'') (resid 23 and (name H2A or name H2B or name H2C)) 7.73 2.00 2.00
assign
 (resid 13 and name H1') (resid 13 and name H5) 5.11 1.30 1.70
assign
 (resid 13 and name H1') (resid 13 and name H6) 3.48 0.50 0.90
assign
 (resid 13 and name H1') (resid 14 and name H5'') 4.95 1.30 1.70
assign
 (resid 13 and name H1') (resid 14 and name H5') 3.43 0.50 0.90
assign
 (resid 13 and name H1') (resid 14 and name H4') 4.67 1.30 1.70
assign
 (resid 13 and name H1') (resid 14 and name H3') 4.57 1.30 1.70
assign
 (resid 13 and name H1') (resid 14 and name H2') 4.82 1.30 1.70
assign
 (resid 13 and name H1') (resid 14 and name H2'') 5.61 2.00 2.00
assign
 (resid 13 and name H1') (resid 14 and name H1') 3.98 0.80 1.30
assign
 (resid 13 and name H1') (resid 14 and (name H51 or name H52 or name H53)) 4.66 1.30 1.70
assign
 (resid 13 and name H1') (resid 14 and name H6) 3.57 0.80 1.30
assign
 (resid 13 and name H1') (resid 17 and name H7) 3.80 0.80 1.30
assign
 (resid 13 and name H1') (resid 17 and name H8) 2.86 0.50 0.90
assign
 (resid 13 and name H1') (resid 17 and (name H6A or name H6B or name H6C)) 6.39 2.00 2.00
assign
 (resid 13 and name H1') (resid 19 and name HA) 6.15 2.00 2.00
assign
 (resid 13 and name H1') (resid 20 and name HA) 4.16 0.80 1.30
assign
 (resid 13 and name H1') (resid 20 and name HB1) 2.32 0.50 0.90
assign
 (resid 13 and name H1') (resid 20 and name HB2) 3.63 0.80 1.30
assign
 (resid 13 and name H1') (resid 20 and name HG1) 3.52 0.80 1.30
assign
 (resid 13 and name H1') (resid 20 and name HG2) 4.05 0.80 1.30
assign
 (resid 13 and name H1') (resid 20 and name HD1) 5.60 2.00 2.00
assign
 (resid 13 and name H1') (resid 20 and name HD2) 5.55 2.00 2.00
assign
 (resid 13 and name H1') (resid 21 and (name HNA or name HNB or name HNC)) 6.36 2.00 2.00
assign
 (resid 13 and name H1') (resid 21 and name HA1) 5.14 1.30 1.70
assign
 (resid 13 and name H1') (resid 21 and name HA2) 4.19 0.80 1.30
assign
 (resid 13 and name H1') (resid 22 and (name HNA or name HNB or name HNC)) 5.60 2.00 2.00
assign
 (resid 13 and name H1') (resid 23 and name HA) 4.75 1.30 1.70
assign
 (resid 13 and name H1') (resid 23 and (name H2A or name H2B or name H2C)) 6.09 2.00 2.00
assign
 (resid 13 and name H5) (resid 13 and name H6) 2.35 0.50 0.90
assign
 (resid 13 and name H5) (resid 14 and (name H51 or name H52 or name H53)) 3.94 0.80 1.30
assign
 (resid 13 and name H5) (resid 14 and name H6) 6.22 2.00 2.00
assign
 (resid 13 and name H5) (resid 17 and name H7) 3.15 0.50 0.90
assign
 (resid 13 and name H5) (resid 17 and name H8) 4.74 1.30 1.70
assign
 (resid 13 and name H5) (resid 17 and (name H6A or name H6B or name H6C)) 4.01 0.80 1.30
assign
 (resid 13 and name H6) (resid 14 and name H5'') 6.98 2.00 2.00
assign
 (resid 13 and name H6) (resid 14 and name H5') 5.56 2.00 2.00
assign
 (resid 13 and name H6) (resid 14 and (name H51 or name H52 or name H53)) 3.77 0.80 1.30
assign
 (resid 13 and name H6) (resid 14 and name H6) 5.04 1.30 1.70
assign
 (resid 13 and name H6) (resid 17 and name H7) 2.94 0.50 0.90
assign
 (resid 13 and name H6) (resid 17 and name H8) 3.71 0.80 1.30
assign
 (resid 13 and name H6) (resid 17 and (name H6A or name H6B or name H6C)) 4.99 1.30 1.70
assign
 (resid 13 and name H6) (resid 20 and name HB1) 5.28 1.30 1.70
assign
 (resid 14 and name H5'') (resid 14 and name H4') 2.59 0.50 0.90
assign
 (resid 14 and name H5'') (resid 14 and name H3') 2.61 0.50 0.90
assign
 (resid 14 and name H5'') (resid 14 and name H2') 4.46 0.80 1.30
assign
 (resid 14 and name H5'') (resid 14 and name H2'') 5.16 1.30 1.70
assign
 (resid 14 and name H5'') (resid 14 and name H1') 4.72 1.30 1.70
assign
 (resid 14 and name H5'') (resid 14 and (name H51 or name H52 or name H53)) 5.90 2.00 2.00
assign
 (resid 14 and name H5'') (resid 14 and name H6) 4.01 0.80 1.30
assign
 (resid 14 and name H5'') (resid 15 and name H5'') 6.49 2.00 2.00
assign
 (resid 14 and name H5'') (resid 15 and name H5') 4.98 1.30 1.70
assign
 (resid 14 and name H5'') (resid 15 and (name H51 or name H52 or name H53)) 5.88 2.00 2.00
assign
 (resid 14 and name H5'') (resid 15 and name H6) 6.05 2.00 2.00
assign
 (resid 14 and name H5'') (resid 20 and name HA) 6.40 2.00 2.00
assign
 (resid 14 and name H5'') (resid 20 and name HB1) 4.57 1.30 1.70
assign
 (resid 14 and name H5'') (resid 20 and name HB2) 4.25 0.80 1.30
assign
 (resid 14 and name H5'') (resid 20 and name HG1) 5.94 2.00 2.00
assign
 (resid 14 and name H5'') (resid 20 and name HG2) 4.64 1.30 1.70
assign
 (resid 14 and name H5'') (resid 20 and name HD1) 7.19 2.00 2.00
assign
 (resid 14 and name H5'') (resid 20 and name HD2) 6.08 2.00 2.00
assign
 (resid 14 and name H5'') (resid 23 and (name H2A or name H2B or name H2C)) 8.83 2.00 2.00
assign
 (resid 14 and name H5') (resid 14 and name H4') 2.51 0.50 0.90
assign
 (resid 14 and name H5') (resid 14 and name H3') 3.25 0.50 0.90
assign
 (resid 14 and name H5') (resid 14 and name H2') 4.37 0.80 1.30
assign
 (resid 14 and name H5') (resid 14 and name H2'') 5.19 1.30 1.70
assign
 (resid 14 and name H5') (resid 14 and name H1') 4.44 0.80 1.30
assign
 (resid 14 and name H5') (resid 14 and (name H51 or name H52 or name H53)) 5.67 2.00 2.00
assign
 (resid 14 and name H5') (resid 14 and name H6) 3.72 0.80 1.30
assign
 (resid 14 and name H5') (resid 15 and name H5') 5.86 2.00 2.00
assign
 (resid 14 and name H5') (resid 15 and (name H51 or name H52 or name H53)) 6.03 2.00 2.00
assign
 (resid 14 and name H5') (resid 17 and name H8) 5.62 2.00 2.00
assign
 (resid 14 and name H5') (resid 20 and name HA) 5.62 2.00 2.00
assign
 (resid 14 and name H5') (resid 20 and name HB1) 3.31 0.50 0.90
assign
 (resid 14 and name H5') (resid 20 and name HB2) 3.04 0.50 0.90
assign
 (resid 14 and name H5') (resid 20 and name HG1) 4.19 0.80 1.30
assign
 (resid 14 and name H5') (resid 20 and name HG2) 3.08 0.50 0.90
assign
 (resid 14 and name H5') (resid 20 and name HD1) 5.89 2.00 2.00
assign
 (resid 14 and name H5') (resid 20 and name HD2) 4.75 1.30 1.70
assign
 (resid 14 and name H5') (resid 21 and (name HNA or name HNB or name HNC)) 7.22 2.00 2.00
assign
 (resid 14 and name H5') (resid 21 and name HA2) 6.19 2.00 2.00
assign
 (resid 14 and name H5') (resid 23 and (name H2A or name H2B or name H2C)) 7.63 2.00 2.00
assign
 (resid 14 and name H4') (resid 14 and name H3') 2.79 0.50 0.90
assign
 (resid 14 and name H4') (resid 14 and name H2') 3.83 0.80 1.30
assign
 (resid 14 and name H4') (resid 14 and name H2'') 3.44 0.50 0.90
assign
 (resid 14 and name H4') (resid 14 and name H1') 2.91 0.50 0.90
assign
 (resid 14 and name H4') (resid 14 and (name H51 or name H52 or name H53)) 6.35 2.00 2.00
assign
 (resid 14 and name H4') (resid 14 and name H6) 3.96 0.80 1.30
assign
 (resid 14 and name H4') (resid 15 and name H5'') 4.93 1.30 1.70
assign
 (resid 14 and name H4') (resid 15 and name H5') 3.50 0.80 1.30
assign
 (resid 14 and name H4') (resid 15 and name H4') 5.61 2.00 2.00
assign
 (resid 14 and name H4') (resid 15 and (name H51 or name H52 or name H53)) 6.16 2.00 2.00
assign
 (resid 14 and name H4') (resid 15 and name H6) 5.31 1.30 1.70
assign
 (resid 14 and name H4') (resid 19 and name HA) 5.98 2.00 2.00
assign
 (resid 14 and name H4') (resid 19 and (name H1A or name H1B or name H1C)) 6.62 2.00 2.00
assign
 (resid 14 and name H4') (resid 20 and name HA) 4.81 1.30 1.70
assign
 (resid 14 and name H4') (resid 20 and name HB1) 3.61 0.80 1.30
assign
 (resid 14 and name H4') (resid 20 and name HB2) 2.42 0.50 0.90
assign
 (resid 14 and name H4') (resid 20 and name HG1) 4.67 1.30 1.70
assign
 (resid 14 and name H4') (resid 20 and name HG2) 3.68 0.80 1.30
assign
 (resid 14 and name H4') (resid 20 and name HD1) 5.82 2.00 2.00
assign
 (resid 14 and name H4') (resid 20 and name HD2) 4.21 0.80 1.30
assign
 (resid 14 and name H4') (resid 21 and (name HNA or name HNB or name HNC)) 4.59 1.30 1.70
assign
 (resid 14 and name H4') (resid 21 and name HA1) 5.41 1.30 1.70
assign
 (resid 14 and name H4') (resid 21 and name HA2) 5.04 1.30 1.70
assign
 (resid 14 and name H4') (resid 23 and name HA) 6.29 2.00 2.00
assign
 (resid 14 and name H4') (resid 23 and (name H2A or name H2B or name H2C)) 7.66 2.00 2.00
assign
 (resid 14 and name H3') (resid 14 and name H2') 2.38 0.50 0.90
assign
 (resid 14 and name H3') (resid 14 and name H2'') 3.13 0.50 0.90
assign
 (resid 14 and name H3') (resid 14 and name H1') 3.65 0.80 1.30
assign
 (resid 14 and name H3') (resid 14 and (name H51 or name H52 or name H53)) 5.31 1.30 1.70
assign
 (resid 14 and name H3') (resid 14 and name H6) 2.99 0.50 0.90
assign
 (resid 14 and name H3') (resid 15 and name H5'') 4.90 1.30 1.70
assign
 (resid 14 and name H3') (resid 15 and name H5') 4.12 0.80 1.30
assign
 (resid 14 and name H3') (resid 15 and name H4') 6.24 2.00 2.00
assign
 (resid 14 and name H3') (resid 15 and name H2') 5.60 2.00 2.00
assign
 (resid 14 and name H3') (resid 15 and name H2'') 7.14 2.00 2.00
assign
 (resid 14 and name H3') (resid 15 and name H1') 5.88 2.00 2.00
assign
 (resid 14 and name H3') (resid 15 and (name H51 or name H52 or name H53)) 4.02 0.80 1.30
assign
 (resid 14 and name H3') (resid 15 and name H6) 3.78 0.80 1.30
assign
 (resid 14 and name H3') (resid 20 and name HB1) 4.72 1.30 1.70
assign
 (resid 14 and name H3') (resid 20 and name HB2) 4.96 1.30 1.70
assign
 (resid 14 and name H3') (resid 20 and name HG2) 5.86 2.00 2.00
assign
 (resid 14 and name H3') (resid 21 and (name HNA or name HNB or name HNC)) 5.88 2.00 2.00
assign
 (resid 14 and name H3') (resid 21 and name HA1) 6.01 2.00 2.00
assign
 (resid 14 and name H2') (resid 14 and name H1') 2.88 0.50 0.90
assign
 (resid 14 and name H2') (resid 14 and (name H51 or name H52 or name H53)) 4.48 0.80 1.30
assign
 (resid 14 and name H2') (resid 14 and name H6) 2.21 0.50 0.90
assign
 (resid 14 and name H2') (resid 15 and name H5'') 5.03 1.30 1.70
assign
 (resid 14 and name H2') (resid 15 and name H5') 4.07 0.80 1.30
assign
 (resid 14 and name H2') (resid 15 and name H4') 5.13 1.30 1.70
assign
 (resid 14 and name H2') (resid 15 and name H3') 5.92 2.00 2.00
assign
 (resid 14 and name H2') (resid 15 and name H2') 4.37 0.80 1.30
assign
 (resid 14 and name H2') (resid 15 and name H2'') 5.61 2.00 2.00
assign
 (resid 14 and name H2') (resid 15 and name H1') 4.41 0.80 1.30
assign
 (resid 14 and name H2') (resid 15 and (name H51 or name H52 or name H53)) 3.27 0.50 0.90
assign
 (resid 14 and name H2') (resid 15 and name H6) 2.75 0.50 0.90
assign
 (resid 14 and name H2') (resid 20 and name HA) 5.86 2.00 2.00
assign
 (resid 14 and name H2') (resid 20 and name HB1) 4.79 1.30 1.70
assign
 (resid 14 and name H2') (resid 20 and name HB2) 5.07 1.30 1.70
assign
 (resid 14 and name H2') (resid 21 and (name HNA or name HNB or name HNC)) 5.08 1.30 1.70
assign
 (resid 14 and name H2') (resid 21 and name HA1) 4.42 0.80 1.30
assign
 (resid 14 and name H2') (resid 21 and name HA2) 4.98 1.30 1.70
assign
 (resid 14 and name H2') (resid 22 and (name HNA or name HNB or name HNC)) 5.72 2.00 2.00
assign
 (resid 14 and name H2'') (resid 14 and name H1') 2.27 0.50 0.90
assign
 (resid 14 and name H2'') (resid 14 and (name H51 or name H52 or name H53)) 6.59 2.00 2.00
assign
 (resid 14 and name H2'') (resid 14 and name H6) 3.91 0.80 1.30
assign
 (resid 14 and name H2'') (resid 15 and name H5'') 3.94 0.80 1.30
assign
 (resid 14 and name H2'') (resid 15 and name H5') 2.78 0.50 0.90
assign
 (resid 14 and name H2'') (resid 15 and name H4') 3.68 0.80 1.30
assign
 (resid 14 and name H2'') (resid 15 and name H3') 4.72 1.30 1.70
assign
 (resid 14 and name H2'') (resid 15 and name H2') 3.79 0.80 1.30
assign
 (resid 14 and name H2'') (resid 15 and name H2'') 4.58 1.30 1.70
assign
 (resid 14 and name H2'') (resid 15 and name H1') 3.45 0.50 0.90
assign
 (resid 14 and name H2'') (resid 15 and (name H51 or name H52 or name H53)) 4.51 1.30 1.70
assign
 (resid 14 and name H2'') (resid 15 and name H6) 2.57 0.50 0.90
assign
 (resid 14 and name H2'') (resid 20 and name HA) 5.31 1.30 1.70
assign
 (resid 14 and name H2'') (resid 20 and name HB1) 4.69 1.30 1.70
assign
 (resid 14 and name H2'') (resid 20 and name HB2) 4.80 1.30 1.70
assign
 (resid 14 and name H2'') (resid 20 and name HG2) 6.76 2.00 2.00
assign
 (resid 14 and name H2'') (resid 21 and (name HNA or name HNB or name HNC)) 4.00 0.80 1.30
assign
 (resid 14 and name H2'') (resid 21 and name HA1) 4.13 0.80 1.30
assign
 (resid 14 and name H2'') (resid 21 and name HA2) 4.89 1.30 1.70
assign
 (resid 14 and name H2'') (resid 22 and (name HNA or name HNB or name HNC)) 6.64 2.00 2.00
assign
 (resid 14 and name H1') (resid 14 and (name H51 or name H52 or name H53)) 5.62 2.00 2.00
assign
 (resid 14 and name H1') (resid 14 and name H6) 3.44 0.50 0.90
assign
 (resid 14 and name H1') (resid 15 and name H5'') 4.83 1.30 1.70
assign
 (resid 14 and name H1') (resid 15 and name H5') 3.64 0.80 1.30
assign
 (resid 14 and name H1') (resid 15 and name H4') 4.35 0.80 1.30
assign
 (resid 14 and name H1') (resid 15 and name H3') 6.06 2.00 2.00
assign
 (resid 14 and name H1') (resid 15 and name H2') 5.61 2.00 2.00
assign
 (resid 14 and name H1') (resid 15 and name H2'') 6.53 2.00 2.00
assign
 (resid 14 and name H1') (resid 15 and name H1') 4.58 1.30 1.70
assign
 (resid 14 and name H1') (resid 15 and (name H51 or name H52 or name H53)) 6.00 2.00 2.00
assign
 (resid 14 and name H1') (resid 15 and name H6) 4.61 1.30 1.70
assign
 (resid 14 and name H1') (resid 19 and name HA) 4.67 1.30 1.70
assign
 (resid 14 and name H1') (resid 19 and (name H1A or name H1B or name H1C)) 7.86 2.00 2.00
assign
 (resid 14 and name H1') (resid 19 and (name H2A or name H2B or name H2C)) 6.45 2.00 2.00
assign
 (resid 14 and name H1') (resid 20 and name HA) 3.96 0.80 1.30
assign
 (resid 14 and name H1') (resid 20 and name HB1) 3.12 0.50 0.90
assign
 (resid 14 and name H1') (resid 20 and name HB2) 2.98 0.50 0.90
assign
 (resid 14 and name H1') (resid 20 and name HG1) 5.07 1.30 1.70
assign
 (resid 14 and name H1') (resid 20 and name HG2) 5.16 1.30 1.70
assign
 (resid 14 and name H1') (resid 20 and name HD1) 5.86 2.00 2.00
assign
 (resid 14 and name H1') (resid 20 and name HD2) 5.08 1.30 1.70
assign
 (resid 14 and name H1') (resid 21 and (name HNA or name HNB or name HNC)) 3.43 0.50 0.90
assign
 (resid 14 and name H1') (resid 21 and name HA1) 2.92 0.50 0.90
assign
 (resid 14 and name H1') (resid 21 and name HA2) 3.34 0.50 0.90
assign
 (resid 14 and name H1') (resid 22 and (name HNA or name HNB or name HNC)) 5.02 1.30 1.70
assign
 (resid 14 and name H1') (resid 22 and (name H1A or name H1B or name H1C)) 6.56 2.00 2.00
assign
 (resid 14 and name H1') (resid 23 and (name H2A or name H2B or name H2C)) 6.89 2.00 2.00
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 14 and name H6) 3.12 0.50 0.90
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 15 and (name H51 or name H52 or name H53)) 4.76 1.30 1.70
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 15 and name H6) 7.15 2.00 2.00
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 17 and name H7) 6.47 2.00 2.00
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 17 and name H8) 5.64 2.00 2.00
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 17 and (name H6A or name H6B or name H6C)) 6.85 2.00 2.00
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 20 and name HB1) 5.53 2.00 2.00
assign
 (resid 14 and (name H51 or name H52 or name H53))
 (resid 20 and name HB2) 7.25 2.00 2.00
assign
 (resid 14 and name H6) (resid 15 and name H5') 5.66 2.00 2.00
assign
 (resid 14 and name H6) (resid 15 and name H2') 6.67 2.00 2.00
assign
 (resid 14 and name H6) (resid 15 and (name H51 or name H52 or name H53)) 3.94 0.80 1.30
assign
 (resid 14 and name H6) (resid 15 and name H6) 4.98 1.30 1.70
assign
 (resid 14 and name H6) (resid 17 and name H8) 5.72 2.00 2.00
assign
 (resid 14 and name H6) (resid 20 and name HA) 5.26 1.30 1.70
assign
 (resid 14 and name H6) (resid 20 and name HB1) 4.35 0.80 1.30
assign
 (resid 14 and name H6) (resid 20 and name HB2) 4.78 1.30 1.70
assign
 (resid 14 and name H6) (resid 20 and name HG1) 6.07 2.00 2.00
assign
 (resid 14 and name H6) (resid 20 and name HG2) 5.95 2.00 2.00
assign
 (resid 14 and name H6) (resid 21 and (name HNA or name HNB or name HNC)) 6.08 2.00 2.00
assign
 (resid 14 and name H6) (resid 21 and name HA1) 5.18 1.30 1.70
assign
 (resid 14 and name H6) (resid 21 and name HA2) 5.04 1.30 1.70
assign
 (resid 15 and name H5'') (resid 15 and name H4') 2.61 0.50 0.90
assign
 (resid 15 and name H5'') (resid 15 and name H3') 2.62 0.50 0.90
assign
 (resid 15 and name H5'') (resid 15 and name H2') 3.72 0.80 1.30
assign
 (resid 15 and name H5'') (resid 15 and name H2'') 4.87 1.30 1.70
assign
 (resid 15 and name H5'') (resid 15 and name H1') 4.49 0.80 1.30
assign
 (resid 15 and name H5'') (resid 15 and (name H51 or name H52 or name H53)) 6.20 2.00 2.00
assign
 (resid 15 and name H5'') (resid 15 and name H6) 4.20 0.80 1.30
assign
 (resid 15 and name H5'') (resid 20 and name HB2) 6.33 2.00 2.00
assign
 (resid 15 and name H5'') (resid 21 and (name HNA or name HNB or name HNC)) 4.64 1.30 1.70
assign
 (resid 15 and name H5') (resid 15 and name H4') 2.40 0.50 0.90
assign
 (resid 15 and name H5') (resid 15 and name H3') 3.60 0.80 1.30
assign
 (resid 15 and name H5') (resid 15 and name H2') 4.08 0.80 1.30
assign
 (resid 15 and name H5') (resid 15 and name H2'') 5.18 1.30 1.70
assign
 (resid 15 and name H5') (resid 15 and name H1') 4.26 0.80 1.30
assign
 (resid 15 and name H5') (resid 15 and (name H51 or name H52 or name H53)) 5.98 2.00 2.00
assign
 (resid 15 and name H5') (resid 15 and name H6) 3.80 0.80 1.30
assign
 (resid 15 and name H5') (resid 20 and name HB1) 5.51 2.00 2.00
assign
 (resid 15 and name H5') (resid 20 and name HB2) 4.87 1.30 1.70
assign
 (resid 15 and name H5') (resid 21 and (name HNA or name HNB or name HNC)) 4.37 0.80 1.30
assign
 (resid 15 and name H5') (resid 21 and name HA1) 5.67 2.00 2.00
assign
 (resid 15 and name H4') (resid 15 and name H3') 2.73 0.50 0.90
assign
 (resid 15 and name H4') (resid 15 and name H2') 3.66 0.80 1.30
assign
 (resid 15 and name H4') (resid 15 and name H2'') 3.86 0.80 1.30
assign
 (resid 15 and name H4') (resid 15 and name H1') 2.92 0.50 0.90
assign
 (resid 15 and name H4') (resid 15 and (name H51 or name H52 or name H53)) 6.97 2.00 2.00
assign
 (resid 15 and name H4') (resid 15 and name H6) 4.33 0.80 1.30
assign
 (resid 15 and name H4') (resid 16 and name H5'') 5.92 2.00 2.00
assign
 (resid 15 and name H4') (resid 16 and name H5') 4.42 0.80 1.30
assign
 (resid 15 and name H4') (resid 16 and name H6) 6.30 2.00 2.00
assign
 (resid 15 and name H4') (resid 19 and (name H1A or name H1B or name H1C)) 6.61 2.00 2.00
assign
 (resid 15 and name H4') (resid 21 and (name HNA or name HNB or name HNC)) 3.56 0.80 1.30
assign
 (resid 15 and name H4') (resid 21 and name HA1) 5.24 1.30 1.70
assign
 (resid 15 and name H4') (resid 21 and name HA2) 6.25 2.00 2.00
assign
 (resid 15 and name H4') (resid 22 and (name H1A or name H1B or name H1C)) 6.71 2.00 2.00
assign
 (resid 15 and name H3') (resid 15 and name H2') 2.42 0.50 0.90
assign
 (resid 15 and name H3') (resid 15 and name H2'') 2.87 0.50 0.90
assign
 (resid 15 and name H3') (resid 15 and name H1') 3.81 0.80 1.30
assign
 (resid 15 and name H3') (resid 15 and (name H51 or name H52 or name H53)) 6.74 2.00 2.00
assign
 (resid 15 and name H3') (resid 15 and name H6) 3.82 0.80 1.30
assign
 (resid 15 and name H3') (resid 16 and name H5'') 5.38 1.30 1.70
assign
 (resid 15 and name H3') (resid 16 and name H5') 4.34 0.80 1.30
assign
 (resid 15 and name H3') (resid 16 and name H3') 5.65 2.00 2.00
assign
 (resid 15 and name H3') (resid 16 and name H5) 4.82 1.30 1.70
assign
 (resid 15 and name H3') (resid 16 and name H6) 5.05 1.30 1.70
assign
 (resid 15 and name H3') (resid 21 and (name HNA or name HNB or name HNC)) 5.29 1.30 1.70
assign
 (resid 15 and name H2') (resid 15 and name H1') 3.12 0.50 0.90
assign
 (resid 15 and name H2') (resid 15 and (name H51 or name H52 or name H53)) 4.71 1.30 1.70
assign
 (resid 15 and name H2') (resid 15 and name H6) 2.17 0.30 0.50
assign
 (resid 15 and name H2') (resid 16 and name H5'') 6.05 2.00 2.00
assign
 (resid 15 and name H2') (resid 16 and name H5') 4.85 1.30 1.70
assign
 (resid 15 and name H2') (resid 16 and name H4') 6.61 2.00 2.00
assign
 (resid 15 and name H2') (resid 16 and name H3') 5.96 2.00 2.00
assign
 (resid 15 and name H2') (resid 16 and name H2') 6.44 2.00 2.00
assign
 (resid 15 and name H2') (resid 16 and name H1') 6.45 2.00 2.00
assign
 (resid 15 and name H2') (resid 16 and name H5) 3.49 0.50 0.90
assign
 (resid 15 and name H2') (resid 16 and name H6) 3.88 0.80 1.30
assign
 (resid 15 and name H2') (resid 21 and (name HNA or name HNB or name HNC)) 5.32 1.30 1.70
assign
 (resid 15 and name H2'') (resid 15 and name H1') 2.32 0.50 0.90
assign
 (resid 15 and name H2'') (resid 15 and (name H51 or name H52 or name H53)) 5.97 2.00 2.00
assign
 (resid 15 and name H2'') (resid 15 and name H6) 3.63 0.80 1.30
assign
 (resid 15 and name H2'') (resid 16 and name H5'') 4.25 0.80 1.30
assign
 (resid 15 and name H2'') (resid 16 and name H5') 3.23 0.50 0.90
assign
 (resid 15 and name H2'') (resid 16 and name H4') 4.64 1.30 1.70
assign
 (resid 15 and name H2'') (resid 16 and name H3') 3.94 0.80 1.30
assign
 (resid 15 and name H2'') (resid 16 and name H2') 4.80 1.30 1.70
assign
 (resid 15 and name H2'') (resid 16 and name H2'') 5.71 2.00 2.00
assign
 (resid 15 and name H2'') (resid 16 and name H1') 4.34 0.80 1.30
assign
 (resid 15 and name H2'') (resid 16 and name H5) 3.51 0.80 1.30
assign
 (resid 15 and name H2'') (resid 16 and name H6) 2.67 0.50 0.90
assign
 (resid 15 and name H2'') (resid 21 and (name HNA or name HNB or name HNC)) 5.85 2.00 2.00
assign
 (resid 15 and name H1') (resid 15 and (name H51 or name H52 or name H53)) 5.84 2.00 2.00
assign
 (resid 15 and name H1') (resid 15 and name H6) 3.56 0.80 1.30
assign
 (resid 15 and name H1') (resid 16 and name H5'') 4.82 1.30 1.70
assign
 (resid 15 and name H1') (resid 16 and name H5') 3.30 0.50 0.90
assign
 (resid 15 and name H1') (resid 16 and name H4') 4.62 1.30 1.70
assign
 (resid 15 and name H1') (resid 16 and name H3') 4.78 1.30 1.70
assign
 (resid 15 and name H1') (resid 16 and name H2') 5.75 2.00 2.00
assign
 (resid 15 and name H1') (resid 16 and name H2'') 6.12 2.00 2.00
assign
 (resid 15 and name H1') (resid 16 and name H1') 4.58 1.30 1.70
assign
 (resid 15 and name H1') (resid 16 and name H5) 4.53 1.30 1.70
assign
 (resid 15 and name H1') (resid 16 and name H6) 3.98 0.80 1.30
assign
 (resid 15 and name H1') (resid 21 and (name HNA or name HNB or name HNC)) 4.39 0.80 1.30
assign
 (resid 15 and name H1') (resid 21 and name HA1) 4.18 0.80 1.30
assign
 (resid 15 and name H1') (resid 21 and name HA2) 5.88 2.00 2.00
assign
 (resid 15 and name H1') (resid 22 and (name HNA or name HNB or name HNC)) 5.88 2.00 2.00
assign
 (resid 15 and name H1') (resid 22 and (name H1A or name H1B or name H1C)) 6.28 2.00 2.00
assign
 (resid 15 and (name H51 or name H52 or name H53))
 (resid 15 and name H6) 3.03 0.50 0.90
assign
 (resid 15 and (name H51 or name H52 or name H53))
 (resid 16 and name H5) 4.65 1.30 1.70
assign
 (resid 15 and (name H51 or name H52 or name H53))
 (resid 16 and name H6) 6.29 2.00 2.00
assign
 (resid 15 and name H6) (resid 16 and name H5') 6.17 2.00 2.00
assign
 (resid 15 and name H6) (resid 16 and name H5) 3.92 0.80 1.30
assign
 (resid 15 and name H6) (resid 16 and name H6) 5.33 1.30 1.70
assign
 (resid 15 and name H6) (resid 21 and (name HNA or name HNB or name HNC)) 5.66 2.00 2.00
assign
 (resid 16 and name H5'') (resid 16 and name H4') 2.42 0.50 0.90
assign
 (resid 16 and name H5'') (resid 16 and name H3') 2.86 0.50 0.90
assign
 (resid 16 and name H5'') (resid 16 and name H2') 5.07 1.30 1.70
assign
 (resid 16 and name H5'') (resid 16 and name H2'') 4.95 1.30 1.70
assign
 (resid 16 and name H5'') (resid 16 and name H1') 5.15 1.30 1.70
assign
 (resid 16 and name H5'') (resid 16 and name H6) 4.36 0.80 1.30
assign
 (resid 16 and name H5'') (resid 21 and (name HNA or name HNB or name HNC)) 6.85 2.00 2.00
assign
 (resid 16 and name H5'') (resid 22 and (name H1A or name H1B or name H1C)) 7.32 2.00 2.00
assign
 (resid 16 and name H5') (resid 16 and name H4') 2.52 0.50 0.90
assign
 (resid 16 and name H5') (resid 16 and name H3') 3.42 0.50 0.90
assign
 (resid 16 and name H5') (resid 16 and name H2') 4.90 1.30 1.70
assign
 (resid 16 and name H5') (resid 16 and name H2'') 4.84 1.30 1.70
assign
 (resid 16 and name H5') (resid 16 and name H1') 4.21 0.80 1.30
assign
 (resid 16 and name H5') (resid 16 and name H5) 5.05 1.30 1.70
assign
 (resid 16 and name H5') (resid 16 and name H6) 4.14 0.80 1.30
assign
 (resid 16 and name H5') (resid 21 and (name HNA or name HNB or name HNC)) 5.30 1.30 1.70
assign
 (resid 16 and name H5') (resid 22 and (name H1A or name H1B or name H1C)) 6.22 2.00 2.00
assign
 (resid 16 and name H4') (resid 16 and name H3') 2.99 0.50 0.90
assign
 (resid 16 and name H4') (resid 16 and name H2') 3.94 0.80 1.30
assign
 (resid 16 and name H4') (resid 16 and name H2'') 3.16 0.50 0.90
assign
 (resid 16 and name H4') (resid 16 and name H1') 3.01 0.50 0.90
assign
 (resid 16 and name H4') (resid 16 and name H6) 4.01 0.80 1.30
assign
 (resid 16 and name H4') (resid 22 and (name H1A or name H1B or name H1C)) 6.19 2.00 2.00
assign
 (resid 16 and name H3') (resid 16 and name H2') 2.67 0.50 0.90
assign
 (resid 16 and name H3') (resid 16 and name H2'') 3.37 0.50 0.90
assign
 (resid 16 and name H3') (resid 16 and name H1') 3.96 0.80 1.30
assign
 (resid 16 and name H3') (resid 16 and name H5) 4.96 1.30 1.70
assign
 (resid 16 and name H3') (resid 16 and name H6) 2.76 0.50 0.90
assign
 (resid 16 and name H2') (resid 16 and name H1') 3.04 0.50 0.90
assign
 (resid 16 and name H2') (resid 16 and name H5) 4.35 0.80 1.30
assign
 (resid 16 and name H2') (resid 16 and name H6) 2.45 0.50 0.90
assign
 (resid 16 and name H2'') (resid 16 and name H1') 2.44 0.50 0.90
assign
 (resid 16 and name H2'') (resid 16 and name H5) 5.81 2.00 2.00
assign
 (resid 16 and name H2'') (resid 16 and name H6) 3.73 0.80 1.30
assign
 (resid 16 and name H1') (resid 16 and name H5) 5.14 1.30 1.70
assign
 (resid 16 and name H1') (resid 16 and name H6) 3.42 0.50 0.90
assign
 (resid 16 and name H1') (resid 22 and (name H1A or name H1B or name H1C)) 5.95 2.00 2.00
assign
 (resid 16 and name H5) (resid 16 and name H6) 2.46 0.50 0.90
assign
 (resid 17 and name H7) (resid 17 and name H8) 2.35 0.50 0.90
assign
 (resid 17 and name H7) (resid 17 and (name H6A or name H6B or name H6C)) 3.07 0.50 0.90
assign
 (resid 17 and name H7) (resid 20 and name HB1) 4.84 1.30 1.70
assign
 (resid 17 and name H7) (resid 20 and name HG1) 4.60 1.30 1.70
assign
 (resid 17 and name H7) (resid 20 and name HG2) 6.07 2.00 2.00
assign
 (resid 17 and name H7) (resid 23 and name HN) 5.03 1.30 1.70
assign
 (resid 17 and name H7) (resid 23 and (name H2A or name H2B or name H2C)) 5.63 2.00 2.00
assign
 (resid 17 and name H8) (resid 17 and (name H6A or name H6B or name H6C)) 4.87 1.30 1.70
assign
 (resid 17 and name H8) (resid 20 and name HA) 4.17 0.80 1.30
assign
 (resid 17 and name H8) (resid 20 and name HB1) 3.66 0.80 1.30
assign
 (resid 17 and name H8) (resid 20 and name HB2) 5.06 1.30 1.70
assign
 (resid 17 and name H8) (resid 20 and name HG1) 3.32 0.50 0.90
assign
 (resid 17 and name H8) (resid 20 and name HG2) 4.81 1.30 1.70
assign
 (resid 17 and name H8) (resid 20 and name HD1) 4.99 1.30 1.70
assign
 (resid 17 and name H8) (resid 20 and name HD2) 5.48 1.30 1.70
assign
 (resid 17 and name H8) (resid 21 and name HA2) 5.01 1.30 1.70
assign
 (resid 17 and name H8) (resid 23 and name HN) 3.71 0.80 1.30
assign
 (resid 17 and name H8) (resid 23 and name HA) 4.32 0.80 1.30
assign
 (resid 17 and name H8) (resid 23 and name HB) 5.02 1.30 1.70
assign
 (resid 17 and name H8) (resid 23 and (name H2A or name H2B or name H2C)) 3.78 0.80 1.30
assign
 (resid 17 and (name H4A or name H4B or name H4C))
 (resid 17 and (name H6A or name H6B or name H6C)) 4.39 0.80 1.30
assign
 (resid 18 and name HA) (resid 18 and name HB) 2.31 0.50 0.90
assign
 (resid 18 and name HA) (resid 18 and (name H2A or name H2B or name H2C)) 3.17 0.50 0.90
assign
 (resid 18 and name HA) (resid 19 and name HN) 2.26 0.50 0.90
assign
 (resid 18 and name HA) (resid 19 and name HA) 4.23 0.80 1.30
assign
 (resid 18 and name HA) (resid 19 and name HB) 4.45 0.80 1.30
assign
 (resid 18 and name HA) (resid 19 and (name H1A or name H1B or name H1C)) 6.08 2.00 2.00
assign
 (resid 18 and name HA) (resid 19 and (name H2A or name H2B or name H2C)) 4.44 0.80 1.30
assign
 (resid 18 and name HA) (resid 20 and name HA) 4.80 1.30 1.70
assign
 (resid 18 and name HA) (resid 22 and (name HNA or name HNB or name HNC)) 5.75 2.00 2.00
assign
 (resid 18 and name HA) (resid 22 and name HA) 4.32 0.80 1.30
assign
 (resid 18 and name HA) (resid 22 and (name H2A or name H2B or name H2C)) 6.36 2.00 2.00
assign
 (resid 18 and name HA) (resid 23 and name HN) 4.17 0.80 1.30
assign
 (resid 18 and name HA) (resid 23 and name HA) 4.29 0.80 1.30
assign
 (resid 18 and name HA) (resid 23 and name HB) 5.28 1.30 1.70
assign
 (resid 18 and name HA) (resid 23 and (name H2A or name H2B or name H2C)) 7.45 2.00 2.00
assign
 (resid 18 and name HA) (resid 24 and name HN) 4.38 0.80 1.30
assign
 (resid 18 and name HA) (resid 24 and name HA) 3.80 0.80 1.30
assign
 (resid 18 and name HA) (resid 24 and name HB) 4.71 1.30 1.70
assign
 (resid 18 and name HA) (resid 24 and (name H1A or name H1B or name H1C)) 5.35 1.30 1.70
assign
 (resid 18 and name HA) (resid 24 and (name H2A or name H2B or name H2C)) 5.90 2.00 2.00
assign
 (resid 18 and name HA) (resid 25 and name HA) 2.89 0.50 0.90
assign
 (resid 18 and name HA) (resid 25 and name HB1) 2.97 0.50 0.90
assign
 (resid 18 and name HA) (resid 25 and name HB2) 4.49 0.80 1.30
assign
 (resid 18 and name HA) (resid 25 and name HG1) 4.62 1.30 1.70
assign
 (resid 18 and name HA) (resid 25 and name HG2) 4.74 1.30 1.70
assign
 (resid 18 and name HA) (resid 25 and name HD1) 2.34 0.50 0.90
assign
 (resid 18 and name HA) (resid 25 and name HD2) 3.63 0.80 1.30
assign
 (resid 18 and name HA) (resid 26 and (name HNA or name HNB or name HNC)) 6.22 2.00 2.00
assign
 (resid 18 and name HA) (resid 26 and name HA1) 5.92 2.00 2.00
assign
 (resid 18 and name HA) (resid 26 and name HA2) 4.32 0.80 1.30
assign
 (resid 18 and name HA) (resid 27 and (name HNA or name HNB or name HNC)) 6.06 2.00 2.00
assign
 (resid 18 and name HB) (resid 18 and (name H2A or name H2B or name H2C)) 2.67 0.50 0.90
assign
 (resid 18 and name HB) (resid 19 and name HN) 2.56 0.50 0.90
assign
 (resid 18 and name HB) (resid 19 and name HA) 4.09 0.80 1.30
assign
 (resid 18 and name HB) (resid 19 and name HB) 3.93 0.80 1.30
assign
 (resid 18 and name HB) (resid 19 and (name H1A or name H1B or name H1C)) 5.69 2.00 2.00
assign
 (resid 18 and name HB) (resid 19 and (name H2A or name H2B or name H2C)) 2.92 0.50 0.90
assign
 (resid 18 and name HB) (resid 20 and name HA) 5.05 1.30 1.70
assign
 (resid 18 and name HB) (resid 22 and (name HNA or name HNB or name HNC)) 5.36 1.30 1.70
assign
 (resid 18 and name HB) (resid 22 and name HA) 3.66 0.80 1.30
assign
 (resid 18 and name HB) (resid 22 and (name H1A or name H1B or name H1C)) 5.53 2.00 2.00
assign
 (resid 18 and name HB) (resid 22 and (name H2A or name H2B or name H2C)) 4.52 1.30 1.70
assign
 (resid 18 and name HB) (resid 23 and name HA) 5.35 1.30 1.70
assign
 (resid 18 and name HB) (resid 24 and name HN) 5.83 2.00 2.00
assign
 (resid 18 and name HB) (resid 24 and name HA) 5.35 1.30 1.70
assign
 (resid 18 and name HB) (resid 24 and name HB) 5.05 1.30 1.70
assign
 (resid 18 and name HB) (resid 24 and (name H1A or name H1B or name H1C)) 6.14 2.00 2.00
assign
 (resid 18 and name HB) (resid 24 and (name H2A or name H2B or name H2C)) 6.79 2.00 2.00
assign
 (resid 18 and name HB) (resid 25 and name HA) 4.54 1.30 1.70
assign
 (resid 18 and name HB) (resid 25 and name HB1) 4.36 0.80 1.30
assign
 (resid 18 and name HB) (resid 25 and name HB2) 6.15 2.00 2.00
assign
 (resid 18 and name HB) (resid 25 and name HG1) 4.83 1.30 1.70
assign
 (resid 18 and name HB) (resid 25 and name HG2) 5.44 1.30 1.70
assign
 (resid 18 and name HB) (resid 25 and name HD1) 2.69 0.50 0.90
assign
 (resid 18 and name HB) (resid 25 and name HD2) 3.65 0.80 1.30
assign
 (resid 18 and name HB) (resid 26 and name HA2) 5.54 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 19 and name HN) 4.79 1.30 1.70
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 19 and name HA) 7.08 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 19 and name HB) 6.93 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 19 and (name H1A or name H1B or name H1C)) 8.19 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 19 and (name H2A or name H2B or name H2C)) 5.66 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 22 and (name HNA or name HNB or name HNC)) 6.34 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 22 and name HA) 4.12 0.80 1.30
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 22 and name HB) 6.45 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 22 and (name H1A or name H1B or name H1C)) 7.10 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 22 and (name H2A or name H2B or name H2C)) 4.60 1.30 1.70
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 24 and name HN) 7.78 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 24 and name HA) 6.96 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 24 and name HB) 7.55 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 24 and (name H1A or name H1B or name H1C)) 7.28 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 24 and (name H2A or name H2B or name H2C)) 8.71 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HA) 5.22 1.30 1.70
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HB1) 3.93 0.80 1.30
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HB2) 5.95 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HG1) 4.11 0.80 1.30
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HG2) 5.48 1.30 1.70
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD1) 2.48 0.50 0.90
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD2) 4.18 0.80 1.30
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 26 and name HA1) 8.56 2.00 2.00
assign
 (resid 18 and (name H2A or name H2B or name H2C))
 (resid 26 and name HA2) 6.25 2.00 2.00
assign
 (resid 19 and name HN) (resid 19 and name HA) 2.78 0.50 0.90
assign
 (resid 19 and name HN) (resid 19 and name HB) 2.28 0.50 0.90
assign
 (resid 19 and name HN) (resid 19 and (name H1A or name H1B or name H1C)) 4.43 0.80 1.30
assign
 (resid 19 and name HN) (resid 19 and (name H2A or name H2B or name H2C)) 3.04 0.50 0.90
assign
 (resid 19 and name HN) (resid 20 and name HA) 3.93 0.80 1.30
assign
 (resid 19 and name HN) (resid 20 and name HD1) 4.93 1.30 1.70
assign
 (resid 19 and name HN) (resid 20 and name HD2) 5.68 2.00 2.00
assign
 (resid 19 and name HN) (resid 21 and (name HNA or name HNB or name HNC)) 5.74 2.00 2.00
assign
 (resid 19 and name HN) (resid 21 and name HA1) 6.01 2.00 2.00
assign
 (resid 19 and name HN) (resid 21 and name HA2) 5.00 1.30 1.70
assign
 (resid 19 and name HN) (resid 22 and (name HNA or name HNB or name HNC)) 5.99 2.00 2.00
assign
 (resid 19 and name HN) (resid 22 and (name H1A or name H1B or name H1C)) 6.83 2.00 2.00
assign
 (resid 19 and name HN) (resid 22 and (name H2A or name H2B or name H2C)) 6.63 2.00 2.00
assign
 (resid 19 and name HN) (resid 23 and name HN) 5.28 1.30 1.70
assign
 (resid 19 and name HN) (resid 23 and name HA) 3.58 0.80 1.30
assign
 (resid 19 and name HN) (resid 23 and name HB) 5.34 1.30 1.70
assign
 (resid 19 and name HN) (resid 23 and (name H2A or name H2B or name H2C)) 7.01 2.00 2.00
assign
 (resid 19 and name HN) (resid 24 and name HN) 3.25 0.50 0.90
assign
 (resid 19 and name HN) (resid 24 and name HA) 3.77 0.80 1.30
assign
 (resid 19 and name HN) (resid 24 and name HB) 3.20 0.50 0.90
assign
 (resid 19 and name HN) (resid 24 and (name H1A or name H1B or name H1C)) 4.99 1.30 1.70
assign
 (resid 19 and name HN) (resid 24 and (name H2A or name H2B or name H2C)) 5.39 1.30 1.70
assign
 (resid 19 and name HN) (resid 25 and name HA) 3.80 0.80 1.30
assign
 (resid 19 and name HN) (resid 25 and name HB1) 4.59 1.30 1.70
assign
 (resid 19 and name HN) (resid 25 and name HB2) 6.08 2.00 2.00
assign
 (resid 19 and name HN) (resid 25 and name HG1) 5.73 2.00 2.00
assign
 (resid 19 and name HN) (resid 25 and name HG2) 5.83 2.00 2.00
assign
 (resid 19 and name HN) (resid 25 and name HD1) 3.30 0.50 0.90
assign
 (resid 19 and name HN) (resid 25 and name HD2) 4.01 0.80 1.30
assign
 (resid 19 and name HN) (resid 26 and name HA1) 6.64 2.00 2.00
assign
 (resid 19 and name HN) (resid 26 and name HA2) 5.17 1.30 1.70
assign
 (resid 19 and name HA) (resid 19 and name HB) 2.79 0.50 0.90
assign
 (resid 19 and name HA) (resid 19 and (name H1A or name H1B or name H1C)) 2.95 0.50 0.90
assign
 (resid 19 and name HA) (resid 19 and (name H2A or name H2B or name H2C)) 2.94 0.50 0.90
assign
 (resid 19 and name HA) (resid 20 and name HA) 2.03 0.30 0.50
assign
 (resid 19 and name HA) (resid 20 and name HB1) 4.23 0.80 1.30
assign
 (resid 19 and name HA) (resid 20 and name HB2) 3.99 0.80 1.30
assign
 (resid 19 and name HA) (resid 20 and name HG1) 4.53 1.30 1.70
assign
 (resid 19 and name HA) (resid 20 and name HG2) 5.28 1.30 1.70
assign
 (resid 19 and name HA) (resid 20 and name HD1) 4.36 0.80 1.30
assign
 (resid 19 and name HA) (resid 20 and name HD2) 4.49 0.80 1.30
assign
 (resid 19 and name HA) (resid 21 and (name HNA or name HNB or name HNC)) 3.76 0.80 1.30
assign
 (resid 19 and name HA) (resid 21 and name HA1) 3.94 0.80 1.30
assign
 (resid 19 and name HA) (resid 21 and name HA2) 3.01 0.50 0.90
assign
 (resid 19 and name HA) (resid 22 and (name HNA or name HNB or name HNC)) 4.56 1.30 1.70
assign
 (resid 19 and name HA) (resid 22 and name HA) 4.91 1.30 1.70
assign
 (resid 19 and name HA) (resid 22 and (name H1A or name H1B or name H1C)) 5.24 1.30 1.70
assign
 (resid 19 and name HA) (resid 22 and (name H2A or name H2B or name H2C)) 6.09 2.00 2.00
assign
 (resid 19 and name HA) (resid 23 and name HA) 3.69 0.80 1.30
assign
 (resid 19 and name HA) (resid 23 and name HB) 5.61 2.00 2.00
assign
 (resid 19 and name HA) (resid 23 and (name H2A or name H2B or name H2C)) 6.91 2.00 2.00
assign
 (resid 19 and name HA) (resid 24 and name HN) 4.20 0.80 1.30
assign
 (resid 19 and name HA) (resid 24 and name HB) 4.85 1.30 1.70
assign
 (resid 19 and name HA) (resid 24 and (name H1A or name H1B or name H1C)) 7.40 2.00 2.00
assign
 (resid 19 and name HA) (resid 24 and (name H2A or name H2B or name H2C)) 6.81 2.00 2.00
assign
 (resid 19 and name HB) (resid 19 and (name H1A or name H1B or name H1C)) 2.57 0.50 0.90
assign
 (resid 19 and name HB) (resid 19 and (name H2A or name H2B or name H2C)) 2.60 0.50 0.90
assign
 (resid 19 and name HB) (resid 20 and name HA) 4.41 0.80 1.30
assign
 (resid 19 and name HB) (resid 20 and name HD1) 4.71 1.30 1.70
assign
 (resid 19 and name HB) (resid 20 and name HD2) 4.76 1.30 1.70
assign
 (resid 19 and name HB) (resid 21 and (name HNA or name HNB or name HNC)) 5.21 1.30 1.70
assign
 (resid 19 and name HB) (resid 21 and name HA1) 6.37 2.00 2.00
assign
 (resid 19 and name HB) (resid 21 and name HA2) 5.51 2.00 2.00
assign
 (resid 19 and name HB) (resid 22 and (name H1A or name H1B or name H1C)) 7.49 2.00 2.00
assign
 (resid 19 and name HB) (resid 23 and name HA) 4.11 0.80 1.30
assign
 (resid 19 and name HB) (resid 23 and name HB) 5.24 1.30 1.70
assign
 (resid 19 and name HB) (resid 23 and (name H2A or name H2B or name H2C)) 7.32 2.00 2.00
assign
 (resid 19 and name HB) (resid 24 and name HN) 3.32 0.50 0.90
assign
 (resid 19 and name HB) (resid 24 and name HA) 4.61 1.30 1.70
assign
 (resid 19 and name HB) (resid 24 and name HB) 2.44 0.50 0.90
assign
 (resid 19 and name HB) (resid 24 and (name H1A or name H1B or name H1C)) 5.07 1.30 1.70
assign
 (resid 19 and name HB) (resid 24 and (name H2A or name H2B or name H2C)) 5.20 1.30 1.70
assign
 (resid 19 and name HB) (resid 25 and name HD1) 5.10 1.30 1.70
assign
 (resid 19 and name HB) (resid 25 and name HD2) 5.14 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 19 and (name H2A or name H2B or name H2C)) 3.30 0.50 0.90
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HA) 4.37 0.80 1.30
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HB1) 5.40 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HB2) 4.91 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HG1) 6.49 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HG2) 6.43 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HD1) 5.30 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 20 and name HD2) 4.37 0.80 1.30
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 21 and (name HNA or name HNB or name HNC)) 4.38 0.80 1.30
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 21 and name HA1) 5.68 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 21 and name HA2) 5.28 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 22 and (name HNA or name HNB or name HNC)) 7.24 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 22 and (name H1A or name H1B or name H1C)) 6.72 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 22 and (name H2A or name H2B or name H2C)) 8.82 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 23 and name HA) 5.23 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 23 and name HB) 6.73 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 23 and (name H2A or name H2B or name H2C)) 7.29 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 24 and name HN) 5.20 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 24 and name HA) 7.24 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 24 and name HB) 5.05 1.30 1.70
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 24 and (name H1A or name H1B or name H1C)) 7.22 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 24 and (name H2A or name H2B or name H2C)) 7.06 2.00 2.00
assign
 (resid 19 and (name H1A or name H1B or name H1C))
 (resid 25 and name HD1) 7.85 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 20 and name HA) 4.91 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 20 and name HB1) 6.21 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 20 and name HB2) 6.63 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 20 and name HG1) 7.79 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 20 and name HD1) 6.15 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 20 and name HD2) 6.64 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 21 and (name HNA or name HNB or name HNC)) 5.20 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 21 and name HA1) 5.47 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 21 and name HA2) 5.29 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 22 and (name HNA or name HNB or name HNC)) 6.07 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 22 and name HA) 5.95 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 22 and name HB) 6.30 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 22 and (name H1A or name H1B or name H1C)) 5.35 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 22 and (name H2A or name H2B or name H2C)) 5.85 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 23 and name HA) 5.49 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 23 and name HB) 6.82 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 23 and (name H2A or name H2B or name H2C)) 8.58 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 24 and name HN) 5.69 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 24 and name HA) 6.65 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 24 and name HB) 5.21 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 24 and (name H1A or name H1B or name H1C)) 7.03 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 24 and (name H2A or name H2B or name H2C)) 7.22 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 25 and name HA) 6.86 2.00 2.00
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD1) 5.06 1.30 1.70
assign
 (resid 19 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD2) 5.65 2.00 2.00
assign
 (resid 20 and name HA) (resid 20 and name HB1) 2.24 0.50 0.90
assign
 (resid 20 and name HA) (resid 20 and name HB2) 2.75 0.50 0.90
assign
 (resid 20 and name HA) (resid 20 and name HG1) 2.99 0.50 0.90
assign
 (resid 20 and name HA) (resid 20 and name HG2) 3.78 0.80 1.30
assign
 (resid 20 and name HA) (resid 20 and name HD1) 3.51 0.80 1.30
assign
 (resid 20 and name HA) (resid 20 and name HD2) 3.83 0.80 1.30
assign
 (resid 20 and name HA) (resid 21 and (name HNA or name HNB or name HNC)) 4.30 0.80 1.30
assign
 (resid 20 and name HA) (resid 21 and name HA1) 3.58 0.80 1.30
assign
 (resid 20 and name HA) (resid 21 and name HA2) 1.93 0.30 0.50
assign
 (resid 20 and name HA) (resid 22 and (name HNA or name HNB or name HNC)) 4.32 0.80 1.30
assign
 (resid 20 and name HA) (resid 22 and name HA) 5.30 1.30 1.70
assign
 (resid 20 and name HA) (resid 22 and name HB) 5.78 2.00 2.00
assign
 (resid 20 and name HA) (resid 22 and (name H1A or name H1B or name H1C)) 5.80 2.00 2.00
assign
 (resid 20 and name HA) (resid 22 and (name H2A or name H2B or name H2C)) 9.17 2.00 2.00
assign
 (resid 20 and name HA) (resid 23 and name HN) 4.60 1.30 1.70
assign
 (resid 20 and name HA) (resid 23 and name HA) 3.06 0.50 0.90
assign
 (resid 20 and name HA) (resid 23 and name HB) 5.05 1.30 1.70
assign
 (resid 20 and name HA) (resid 23 and (name H2A or name H2B or name H2C)) 5.37 1.30 1.70
assign
 (resid 20 and name HA) (resid 24 and name HN) 4.47 0.80 1.30
assign
 (resid 20 and name HB1) (resid 20 and name HB2) 1.76 0.30 0.50
assign
 (resid 20 and name HB1) (resid 20 and name HG1) 2.29 0.50 0.90
assign
 (resid 20 and name HB1) (resid 20 and name HG2) 2.66 0.50 0.90
assign
 (resid 20 and name HB1) (resid 20 and name HD1) 3.87 0.80 1.30
assign
 (resid 20 and name HB1) (resid 20 and name HD2) 3.75 0.80 1.30
assign
 (resid 20 and name HB1) (resid 21 and (name HNA or name HNB or name HNC)) 4.74 1.30 1.70
assign
 (resid 20 and name HB1) (resid 21 and name HA1) 3.90 0.80 1.30
assign
 (resid 20 and name HB1) (resid 21 and name HA2) 2.72 0.50 0.90
assign
 (resid 20 and name HB1) (resid 22 and (name HNA or name HNB or name HNC)) 4.71 1.30 1.70
assign
 (resid 20 and name HB1) (resid 22 and (name H1A or name H1B or name H1C)) 6.95 2.00 2.00
assign
 (resid 20 and name HB1) (resid 23 and name HA) 3.82 0.80 1.30
assign
 (resid 20 and name HB1) (resid 23 and name HB) 5.57 2.00 2.00
assign
 (resid 20 and name HB1) (resid 23 and (name H2A or name H2B or name H2C)) 5.09 1.30 1.70
assign
 (resid 20 and name HB1) (resid 24 and name HN) 5.66 2.00 2.00
assign
 (resid 20 and name HB2) (resid 20 and name HG1) 2.85 0.50 0.90
assign
 (resid 20 and name HB2) (resid 20 and name HG2) 2.26 0.50 0.90
assign
 (resid 20 and name HB2) (resid 20 and name HD1) 3.85 0.80 1.30
assign
 (resid 20 and name HB2) (resid 20 and name HD2) 2.72 0.50 0.90
assign
 (resid 20 and name HB2) (resid 21 and (name HNA or name HNB or name HNC)) 4.11 0.80 1.30
assign
 (resid 20 and name HB2) (resid 21 and name HA1) 4.29 0.80 1.30
assign
 (resid 20 and name HB2) (resid 21 and name HA2) 3.42 0.50 0.90
assign
 (resid 20 and name HB2) (resid 22 and (name HNA or name HNB or name HNC)) 5.37 1.30 1.70
assign
 (resid 20 and name HB2) (resid 23 and name HA) 4.68 1.30 1.70
assign
 (resid 20 and name HB2) (resid 23 and name HB) 5.92 2.00 2.00
assign
 (resid 20 and name HB2) (resid 23 and (name H2A or name H2B or name H2C)) 5.37 1.30 1.70
assign
 (resid 20 and name HB2) (resid 24 and name HN) 6.00 2.00 2.00
assign
 (resid 20 and name HG1) (resid 20 and name HG2) 1.75 0.30 0.50
assign
 (resid 20 and name HG1) (resid 20 and name HD1) 2.37 0.50 0.90
assign
 (resid 20 and name HG1) (resid 20 and name HD2) 2.85 0.50 0.90
assign
 (resid 20 and name HG1) (resid 21 and (name HNA or name HNB or name HNC)) 5.88 2.00 2.00
assign
 (resid 20 and name HG1) (resid 21 and name HA1) 5.77 2.00 2.00
assign
 (resid 20 and name HG1) (resid 21 and name HA2) 4.19 0.80 1.30
assign
 (resid 20 and name HG1) (resid 22 and (name HNA or name HNB or name HNC)) 5.61 2.00 2.00
assign
 (resid 20 and name HG1) (resid 23 and name HN) 4.32 0.80 1.30
assign
 (resid 20 and name HG1) (resid 23 and name HA) 2.94 0.50 0.90
assign
 (resid 20 and name HG1) (resid 23 and name HB) 4.45 0.80 1.30
assign
 (resid 20 and name HG1) (resid 23 and (name H2A or name H2B or name H2C)) 3.17 0.50 0.90
assign
 (resid 20 and name HG1) (resid 24 and name HN) 4.80 1.30 1.70
assign
 (resid 20 and name HG1) (resid 24 and (name H2A or name H2B or name H2C)) 7.38 2.00 2.00
assign
 (resid 20 and name HG2) (resid 20 and name HD1) 2.77 0.50 0.90
assign
 (resid 20 and name HG2) (resid 20 and name HD2) 2.24 0.50 0.90
assign
 (resid 20 and name HG2) (resid 21 and (name HNA or name HNB or name HNC)) 5.75 2.00 2.00
assign
 (resid 20 and name HG2) (resid 21 and name HA1) 6.41 2.00 2.00
assign
 (resid 20 and name HG2) (resid 21 and name HA2) 5.05 1.30 1.70
assign
 (resid 20 and name HG2) (resid 22 and (name HNA or name HNB or name HNC)) 6.56 2.00 2.00
assign
 (resid 20 and name HG2) (resid 23 and name HN) 5.51 2.00 2.00
assign
 (resid 20 and name HG2) (resid 23 and name HA) 4.22 0.80 1.30
assign
 (resid 20 and name HG2) (resid 23 and name HB) 5.17 1.30 1.70
assign
 (resid 20 and name HG2) (resid 23 and (name H2A or name H2B or name H2C)) 3.94 0.80 1.30
assign
 (resid 20 and name HG2) (resid 24 and name HN) 5.75 2.00 2.00
assign
 (resid 20 and name HG2) (resid 24 and (name H2A or name H2B or name H2C)) 8.01 2.00 2.00
assign
 (resid 20 and name HD1) (resid 20 and name HD2) 1.70 0.30 0.50
assign
 (resid 20 and name HD1) (resid 21 and name HA1) 7.07 2.00 2.00
assign
 (resid 20 and name HD1) (resid 21 and name HA2) 5.46 1.30 1.70
assign
 (resid 20 and name HD1) (resid 23 and name HN) 4.53 1.30 1.70
assign
 (resid 20 and name HD1) (resid 23 and name HA) 2.17 0.30 0.50
assign
 (resid 20 and name HD1) (resid 23 and name HB) 2.72 0.50 0.90
assign
 (resid 20 and name HD1) (resid 23 and (name H2A or name H2B or name H2C)) 2.64 0.50 0.90
assign
 (resid 20 and name HD1) (resid 24 and name HN) 3.03 0.50 0.90
assign
 (resid 20 and name HD1) (resid 24 and name HA) 5.72 2.00 2.00
assign
 (resid 20 and name HD1) (resid 24 and name HB) 4.86 1.30 1.70
assign
 (resid 20 and name HD1) (resid 24 and (name H1A or name H1B or name H1C)) 7.58 2.00 2.00
assign
 (resid 20 and name HD1) (resid 24 and (name H2A or name H2B or name H2C)) 4.61 1.30 1.70
assign
 (resid 20 and name HD1) (resid 27 and name HB) 5.71 2.00 2.00
assign
 (resid 20 and name HD1) (resid 27 and (name H1A or name H1B or name H1C)) 6.72 2.00 2.00
assign
 (resid 20 and name HD2) (resid 21 and (name HNA or name HNB or name HNC)) 5.74 2.00 2.00
assign
 (resid 20 and name HD2) (resid 21 and name HA1) 6.45 2.00 2.00
assign
 (resid 20 and name HD2) (resid 21 and name HA2) 5.39 1.30 1.70
assign
 (resid 20 and name HD2) (resid 23 and name HN) 5.64 2.00 2.00
assign
 (resid 20 and name HD2) (resid 23 and name HA) 3.67 0.80 1.30
assign
 (resid 20 and name HD2) (resid 23 and name HB) 4.40 0.80 1.30
assign
 (resid 20 and name HD2) (resid 23 and (name H2A or name H2B or name H2C)) 4.29 0.80 1.30
assign
 (resid 20 and name HD2) (resid 24 and name HN) 4.16 0.80 1.30
assign
 (resid 20 and name HD2) (resid 24 and name HB) 5.44 1.30 1.70
assign
 (resid 20 and name HD2) (resid 24 and (name H2A or name H2B or name H2C)) 5.99 2.00 2.00
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 21 and name HA1) 2.88 0.50 0.90
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 21 and name HA2) 3.83 0.80 1.30
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 22 and (name HNA or name HNB or name HNC)) 5.39 1.30 1.70
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 22 and name HA) 6.70 2.00 2.00
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 22 and name HB) 5.92 2.00 2.00
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 22 and (name H1A or name H1B or name H1C)) 4.15 0.80 1.30
assign
 (resid 21 and (name HNA or name HNB or name HNC))
 (resid 22 and (name H2A or name H2B or name H2C)) 6.80 2.00 2.00
assign
 (resid 21 and name HA1) (resid 21 and name HA2) 1.72 0.30 0.50
assign
 (resid 21 and name HA1) (resid 22 and (name HNA or name HNB or name HNC)) 2.94 0.50 0.90
assign
 (resid 21 and name HA1) (resid 22 and name HA) 4.74 1.30 1.70
assign
 (resid 21 and name HA1) (resid 22 and name HB) 4.34 0.80 1.30
assign
 (resid 21 and name HA1) (resid 22 and (name H1A or name H1B or name H1C)) 3.57 0.80 1.30
assign
 (resid 21 and name HA1) (resid 22 and (name H2A or name H2B or name H2C)) 6.29 2.00 2.00
assign
 (resid 21 and name HA1) (resid 23 and name HA) 6.12 2.00 2.00
assign
 (resid 21 and name HA1) (resid 23 and (name H2A or name H2B or name H2C)) 9.80 2.00 2.00
assign
 (resid 21 and name HA2) (resid 22 and (name HNA or name HNB or name HNC)) 3.05 0.50 0.90
assign
 (resid 21 and name HA2) (resid 22 and name HA) 4.64 1.30 1.70
assign
 (resid 21 and name HA2) (resid 22 and name HB) 4.99 1.30 1.70
assign
 (resid 21 and name HA2) (resid 22 and (name H1A or name H1B or name H1C)) 4.60 1.30 1.70
assign
 (resid 21 and name HA2) (resid 22 and (name H2A or name H2B or name H2C)) 6.84 2.00 2.00
assign
 (resid 21 and name HA2) (resid 23 and name HA) 4.50 1.30 1.70
assign
 (resid 21 and name HA2) (resid 23 and (name H2A or name H2B or name H2C)) 7.17 2.00 2.00
assign
 (resid 22 and (name HNA or name HNB or name HNC))
 (resid 22 and name HA) 2.69 0.50 0.90
assign
 (resid 22 and (name HNA or name HNB or name HNC))
 (resid 22 and name HB) 3.26 0.50 0.90
assign
 (resid 22 and (name HNA or name HNB or name HNC))
 (resid 22 and (name H1A or name H1B or name H1C)) 3.69 0.80 1.30
assign
 (resid 22 and (name HNA or name HNB or name HNC))
 (resid 22 and (name H2A or name H2B or name H2C)) 5.27 1.30 1.70
assign
 (resid 22 and (name HNA or name HNB or name HNC))
 (resid 23 and name HA) 6.33 2.00 2.00
assign
 (resid 22 and name HA) (resid 22 and name HB) 2.33 0.50 0.90
assign
 (resid 22 and name HA) (resid 22 and (name H1A or name H1B or name H1C)) 3.72 0.80 1.30
assign
 (resid 22 and name HA) (resid 22 and (name H2A or name H2B or name H2C)) 3.27 0.50 0.90
assign
 (resid 22 and name HB) (resid 22 and (name H1A or name H1B or name H1C)) 2.61 0.50 0.90
assign
 (resid 22 and name HB) (resid 22 and (name H2A or name H2B or name H2C)) 2.60 0.50 0.90
assign
 (resid 22 and (name H1A or name H1B or name H1C))
 (resid 22 and (name H2A or name H2B or name H2C)) 3.35 0.50 0.90
assign
 (resid 22 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD1) 7.52 2.00 2.00
assign
 (resid 23 and name HN) (resid 23 and name HA) 3.04 0.50 0.90
assign
 (resid 23 and name HN) (resid 23 and name HB) 3.79 0.80 1.30
assign
 (resid 23 and name HN) (resid 23 and (name H2A or name H2B or name H2C)) 4.13 0.80 1.30
assign
 (resid 23 and name HN) (resid 24 and name HN) 4.48 0.80 1.30
assign
 (resid 23 and name HN) (resid 24 and name HA) 4.47 0.80 1.30
assign
 (resid 23 and name HN) (resid 24 and (name H2A or name H2B or name H2C)) 6.17 2.00 2.00
assign
 (resid 23 and name HN) (resid 25 and name HA) 4.14 0.80 1.30
assign
 (resid 23 and name HN) (resid 25 and name HB1) 4.26 0.80 1.30
assign
 (resid 23 and name HN) (resid 26 and name HA1) 5.15 1.30 1.70
assign
 (resid 23 and name HN) (resid 26 and name HA2) 3.84 0.80 1.30
assign
 (resid 23 and name HN) (resid 27 and (name HNA or name HNB or name HNC)) 4.63 1.30 1.70
assign
 (resid 23 and name HN) (resid 27 and name HA) 4.77 1.30 1.70
assign
 (resid 23 and name HN) (resid 27 and (name H1A or name H1B or name H1C)) 7.21 2.00 2.00
assign
 (resid 23 and name HN) (resid 27 and (name H2A or name H2B or name H2C)) 7.94 2.00 2.00
assign
 (resid 23 and name HA) (resid 23 and name HB) 2.32 0.50 0.90
assign
 (resid 23 and name HA) (resid 23 and (name H2A or name H2B or name H2C)) 3.11 0.50 0.90
assign
 (resid 23 and name HA) (resid 24 and name HN) 2.27 0.50 0.90
assign
 (resid 23 and name HA) (resid 24 and name HA) 4.57 1.30 1.70
assign
 (resid 23 and name HA) (resid 24 and name HB) 4.26 0.80 1.30
assign
 (resid 23 and name HA) (resid 24 and (name H1A or name H1B or name H1C)) 6.41 2.00 2.00
assign
 (resid 23 and name HA) (resid 24 and (name H2A or name H2B or name H2C)) 4.60 1.30 1.70
assign
 (resid 23 and name HA) (resid 25 and name HA) 4.47 0.80 1.30
assign
 (resid 23 and name HA) (resid 26 and name HA2) 4.76 1.30 1.70
assign
 (resid 23 and name HA) (resid 27 and (name HNA or name HNB or name HNC)) 5.52 2.00 2.00
assign
 (resid 23 and name HA) (resid 27 and name HB) 5.32 1.30 1.70
assign
 (resid 23 and name HA) (resid 27 and (name H1A or name H1B or name H1C)) 6.74 2.00 2.00
assign
 (resid 23 and name HB) (resid 23 and (name H2A or name H2B or name H2C)) 2.67 0.50 0.90
assign
 (resid 23 and name HB) (resid 24 and name HN) 2.26 0.50 0.90
assign
 (resid 23 and name HB) (resid 24 and name HA) 3.53 0.80 1.30
assign
 (resid 23 and name HB) (resid 24 and name HB) 4.16 0.80 1.30
assign
 (resid 23 and name HB) (resid 24 and (name H1A or name H1B or name H1C)) 5.82 2.00 2.00
assign
 (resid 23 and name HB) (resid 24 and (name H2A or name H2B or name H2C)) 3.09 0.50 0.90
assign
 (resid 23 and name HB) (resid 25 and name HA) 4.04 0.80 1.30
assign
 (resid 23 and name HB) (resid 26 and (name HNA or name HNB or name HNC)) 5.49 1.30 1.70
assign
 (resid 23 and name HB) (resid 26 and name HA1) 4.72 1.30 1.70
assign
 (resid 23 and name HB) (resid 26 and name HA2) 3.91 0.80 1.30
assign
 (resid 23 and name HB) (resid 27 and (name HNA or name HNB or name HNC)) 4.66 1.30 1.70
assign
 (resid 23 and name HB) (resid 27 and name HA) 3.93 0.80 1.30
assign
 (resid 23 and name HB) (resid 27 and name HB) 3.13 0.50 0.90
assign
 (resid 23 and name HB) (resid 27 and (name H1A or name H1B or name H1C)) 4.51 1.30 1.70
assign
 (resid 23 and name HB) (resid 27 and (name H2A or name H2B or name H2C)) 5.21 1.30 1.70
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 24 and name HN) 4.47 0.80 1.30
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 24 and name HA) 6.70 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 24 and name HB) 6.88 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 24 and (name H1A or name H1B or name H1C)) 8.09 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 24 and (name H2A or name H2B or name H2C)) 5.66 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 25 and name HA) 6.68 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 26 and name HA1) 7.86 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 26 and name HA2) 6.20 2.00 2.00
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 27 and (name HNA or name HNB or name HNC)) 5.49 1.30 1.70
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 27 and name HA) 4.29 0.80 1.30
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 27 and name HB) 4.72 1.30 1.70
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 27 and (name H1A or name H1B or name H1C)) 4.84 1.30 1.70
assign
 (resid 23 and (name H2A or name H2B or name H2C))
 (resid 27 and (name H2A or name H2B or name H2C)) 5.69 2.00 2.00
assign
 (resid 24 and name HN) (resid 24 and name HA) 2.61 0.50 0.90
assign
 (resid 24 and name HN) (resid 24 and name HB) 2.34 0.50 0.90
assign
 (resid 24 and name HN) (resid 24 and (name H1A or name H1B or name H1C)) 4.39 0.80 1.30
assign
 (resid 24 and name HN) (resid 24 and (name H2A or name H2B or name H2C)) 2.77 0.50 0.90
assign
 (resid 24 and name HN) (resid 25 and name HA) 3.67 0.80 1.30
assign
 (resid 24 and name HN) (resid 25 and name HB1) 5.17 1.30 1.70
assign
 (resid 24 and name HN) (resid 26 and (name HNA or name HNB or name HNC)) 5.67 2.00 2.00
assign
 (resid 24 and name HN) (resid 26 and name HA1) 5.45 1.30 1.70
assign
 (resid 24 and name HN) (resid 26 and name HA2) 4.28 0.80 1.30
assign
 (resid 24 and name HN) (resid 27 and (name HNA or name HNB or name HNC)) 5.96 2.00 2.00
assign
 (resid 24 and name HN) (resid 27 and name HB) 4.21 0.80 1.30
assign
 (resid 24 and name HN) (resid 27 and (name H1A or name H1B or name H1C)) 6.48 2.00 2.00
assign
 (resid 24 and name HN) (resid 27 and (name H2A or name H2B or name H2C)) 6.55 2.00 2.00
assign
 (resid 24 and name HA) (resid 24 and name HB) 2.76 0.50 0.90
assign
 (resid 24 and name HA) (resid 24 and (name H1A or name H1B or name H1C)) 2.92 0.50 0.90
assign
 (resid 24 and name HA) (resid 24 and (name H2A or name H2B or name H2C)) 2.87 0.50 0.90
assign
 (resid 24 and name HA) (resid 25 and name HA) 1.85 0.30 0.50
assign
 (resid 24 and name HA) (resid 25 and name HB1) 3.93 0.80 1.30
assign
 (resid 24 and name HA) (resid 25 and name HB2) 4.00 0.80 1.30
assign
 (resid 24 and name HA) (resid 25 and name HG1) 5.07 1.30 1.70
assign
 (resid 24 and name HA) (resid 25 and name HG2) 4.31 0.80 1.30
assign
 (resid 24 and name HA) (resid 25 and name HD1) 4.24 0.80 1.30
assign
 (resid 24 and name HA) (resid 25 and name HD2) 4.48 0.80 1.30
assign
 (resid 24 and name HA) (resid 26 and (name HNA or name HNB or name HNC)) 3.59 0.80 1.30
assign
 (resid 24 and name HA) (resid 26 and name HA1) 3.97 0.80 1.30
assign
 (resid 24 and name HA) (resid 26 and name HA2) 2.72 0.50 0.90
assign
 (resid 24 and name HA) (resid 27 and (name HNA or name HNB or name HNC)) 4.80 1.30 1.70
assign
 (resid 24 and name HA) (resid 27 and name HA) 5.46 1.30 1.70
assign
 (resid 24 and name HA) (resid 27 and name HB) 3.91 0.80 1.30
assign
 (resid 24 and name HA) (resid 27 and (name H1A or name H1B or name H1C)) 6.85 2.00 2.00
assign
 (resid 24 and name HA) (resid 27 and (name H2A or name H2B or name H2C)) 5.56 2.00 2.00
assign
 (resid 24 and name HB) (resid 24 and (name H1A or name H1B or name H1C)) 2.58 0.50 0.90
assign
 (resid 24 and name HB) (resid 24 and (name H2A or name H2B or name H2C)) 2.60 0.50 0.90
assign
 (resid 24 and name HB) (resid 25 and name HA) 4.19 0.80 1.30
assign
 (resid 24 and name HB) (resid 25 and name HB1) 6.14 2.00 2.00
assign
 (resid 24 and name HB) (resid 25 and name HD1) 4.97 1.30 1.70
assign
 (resid 24 and name HB) (resid 25 and name HD2) 4.60 1.30 1.70
assign
 (resid 24 and name HB) (resid 26 and (name HNA or name HNB or name HNC)) 5.51 2.00 2.00
assign
 (resid 24 and name HB) (resid 26 and name HA1) 6.42 2.00 2.00
assign
 (resid 24 and name HB) (resid 26 and name HA2) 5.05 1.30 1.70
assign
 (resid 24 and name HB) (resid 27 and name HB) 5.71 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 24 and (name H2A or name H2B or name H2C)) 3.28 0.50 0.90
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HA) 4.26 0.80 1.30
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HB1) 5.34 1.30 1.70
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HB2) 5.96 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HG1) 6.35 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HG2) 4.94 1.30 1.70
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HD1) 5.34 1.30 1.70
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 25 and name HD2) 4.18 0.80 1.30
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 26 and (name HNA or name HNB or name HNC)) 4.71 1.30 1.70
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 26 and name HA1) 6.22 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 26 and name HA2) 5.02 1.30 1.70
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 27 and (name HNA or name HNB or name HNC)) 7.07 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 27 and name HB) 6.63 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 27 and (name H1A or name H1B or name H1C)) 8.72 2.00 2.00
assign
 (resid 24 and (name H1A or name H1B or name H1C))
 (resid 27 and (name H2A or name H2B or name H2C)) 8.29 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 25 and name HA) 4.67 1.30 1.70
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 25 and name HB1) 6.23 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 25 and name HB2) 7.23 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 25 and name HG2) 7.24 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD1) 6.54 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 25 and name HD2) 6.46 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 26 and (name HNA or name HNB or name HNC)) 5.03 1.30 1.70
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 26 and name HA1) 5.75 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 26 and name HA2) 4.96 1.30 1.70
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 27 and (name HNA or name HNB or name HNC)) 6.27 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 27 and name HA) 6.72 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 27 and name HB) 3.76 0.80 1.30
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 27 and (name H1A or name H1B or name H1C)) 6.21 2.00 2.00
assign
 (resid 24 and (name H2A or name H2B or name H2C))
 (resid 27 and (name H2A or name H2B or name H2C)) 6.11 2.00 2.00
assign
 (resid 25 and name HA) (resid 25 and name HB1) 2.05 0.30 0.50
assign
 (resid 25 and name HA) (resid 25 and name HB2) 2.46 0.50 0.90
assign
 (resid 25 and name HA) (resid 25 and name HG1) 3.98 0.80 1.30
assign
 (resid 25 and name HA) (resid 25 and name HG2) 3.44 0.50 0.90
assign
 (resid 25 and name HA) (resid 25 and name HD1) 3.24 0.50 0.90
assign
 (resid 25 and name HA) (resid 25 and name HD2) 3.96 0.80 1.30
assign
 (resid 25 and name HA) (resid 26 and (name HNA or name HNB or name HNC)) 4.12 0.80 1.30
assign
 (resid 25 and name HA) (resid 26 and name HA1) 3.28 0.50 0.90
assign
 (resid 25 and name HA) (resid 26 and name HA2) 1.57 0.30 0.50
assign
 (resid 25 and name HA) (resid 27 and (name HNA or name HNB or name HNC)) 4.49 0.80 1.30
assign
 (resid 25 and name HA) (resid 27 and name HA) 5.62 2.00 2.00
assign
 (resid 25 and name HA) (resid 27 and name HB) 4.75 1.30 1.70
assign
 (resid 25 and name HA) (resid 27 and (name H1A or name H1B or name H1C)) 7.32 2.00 2.00
assign
 (resid 25 and name HA) (resid 27 and (name H2A or name H2B or name H2C)) 6.72 2.00 2.00
assign
 (resid 25 and name HB1) (resid 25 and name HB2) 1.71 0.30 0.50
assign
 (resid 25 and name HB1) (resid 25 and name HG1) 2.34 0.50 0.90
assign
 (resid 25 and name HB1) (resid 25 and name HG2) 2.92 0.50 0.90
assign
 (resid 25 and name HB1) (resid 25 and name HD1) 2.46 0.50 0.90
assign
 (resid 25 and name HB1) (resid 25 and name HD2) 3.52 0.80 1.30
assign
 (resid 25 and name HB1) (resid 26 and (name HNA or name HNB or name HNC)) 5.40 1.30 1.70
assign
 (resid 25 and name HB1) (resid 26 and name HA1) 3.94 0.80 1.30
assign
 (resid 25 and name HB1) (resid 26 and name HA2) 2.95 0.50 0.90
assign
 (resid 25 and name HB1) (resid 27 and (name HNA or name HNB or name HNC)) 5.00 1.30 1.70
assign
 (resid 25 and name HB2) (resid 25 and name HG1) 2.64 0.50 0.90
assign
 (resid 25 and name HB2) (resid 25 and name HG2) 2.32 0.50 0.90
assign
 (resid 25 and name HB2) (resid 25 and name HD1) 3.76 0.80 1.30
assign
 (resid 25 and name HB2) (resid 25 and name HD2) 3.98 0.80 1.30
assign
 (resid 25 and name HB2) (resid 26 and (name HNA or name HNB or name HNC)) 4.30 0.80 1.30
assign
 (resid 25 and name HB2) (resid 26 and name HA1) 3.35 0.50 0.90
assign
 (resid 25 and name HB2) (resid 26 and name HA2) 2.80 0.50 0.90
assign
 (resid 25 and name HB2) (resid 27 and (name HNA or name HNB or name HNC)) 4.58 1.30 1.70
assign
 (resid 25 and name HG1) (resid 25 and name HG2) 1.76 0.30 0.50
assign
 (resid 25 and name HG1) (resid 25 and name HD1) 2.30 0.50 0.90
assign
 (resid 25 and name HG1) (resid 25 and name HD2) 2.54 0.50 0.90
assign
 (resid 25 and name HG1) (resid 26 and (name HNA or name HNB or name HNC)) 5.90 2.00 2.00
assign
 (resid 25 and name HG1) (resid 26 and name HA1) 5.69 2.00 2.00
assign
 (resid 25 and name HG1) (resid 26 and name HA2) 4.64 1.30 1.70
assign
 (resid 25 and name HG1) (resid 27 and (name HNA or name HNB or name HNC)) 6.31 2.00 2.00
assign
 (resid 25 and name HG2) (resid 25 and name HD1) 2.97 0.50 0.90
assign
 (resid 25 and name HG2) (resid 25 and name HD2) 2.25 0.50 0.90
assign
 (resid 25 and name HG2) (resid 26 and (name HNA or name HNB or name HNC)) 5.01 1.30 1.70
assign
 (resid 25 and name HG2) (resid 26 and name HA1) 5.27 1.30 1.70
assign
 (resid 25 and name HG2) (resid 26 and name HA2) 4.51 1.30 1.70
assign
 (resid 25 and name HD1) (resid 25 and name HD2) 1.65 0.30 0.50
assign
 (resid 25 and name HD1) (resid 26 and (name HNA or name HNB or name HNC)) 6.46 2.00 2.00
assign
 (resid 25 and name HD1) (resid 26 and name HA1) 6.35 2.00 2.00
assign
 (resid 25 and name HD1) (resid 26 and name HA2) 4.57 1.30 1.70
assign
 (resid 25 and name HD2) (resid 26 and (name HNA or name HNB or name HNC)) 5.95 2.00 2.00
assign
 (resid 25 and name HD2) (resid 26 and name HA1) 6.70 2.00 2.00
assign
 (resid 25 and name HD2) (resid 26 and name HA2) 5.30 1.30 1.70
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 26 and name HA1) 2.92 0.50 0.90
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 26 and name HA2) 3.52 0.80 1.30
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 27 and (name HNA or name HNB or name HNC)) 5.17 1.30 1.70
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 27 and name HA) 5.87 2.00 2.00
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 27 and name HB) 4.31 0.80 1.30
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 27 and (name H1A or name H1B or name H1C)) 6.36 2.00 2.00
assign
 (resid 26 and (name HNA or name HNB or name HNC))
 (resid 27 and (name H2A or name H2B or name H2C)) 4.25 0.80 1.30
assign
 (resid 26 and name HA1) (resid 26 and name HA2) 1.74 0.30 0.50
assign
 (resid 26 and name HA1) (resid 27 and (name HNA or name HNB or name HNC)) 2.76 0.50 0.90
assign
 (resid 26 and name HA1) (resid 27 and name HA) 4.20 0.80 1.30
assign
 (resid 26 and name HA1) (resid 27 and name HB) 4.24 0.80 1.30
assign
 (resid 26 and name HA1) (resid 27 and (name H1A or name H1B or name H1C)) 6.34 2.00 2.00
assign
 (resid 26 and name HA1) (resid 27 and (name H2A or name H2B or name H2C)) 4.55 1.30 1.70
assign
 (resid 26 and name HA2) (resid 27 and (name HNA or name HNB or name HNC)) 3.01 0.50 0.90
assign
 (resid 26 and name HA2) (resid 27 and name HA) 4.47 0.80 1.30
assign
 (resid 26 and name HA2) (resid 27 and name HB) 3.97 0.80 1.30
assign
 (resid 26 and name HA2) (resid 27 and (name H1A or name H1B or name H1C)) 6.18 2.00 2.00
assign
 (resid 26 and name HA2) (resid 27 and (name H2A or name H2B or name H2C)) 5.22 1.30 1.70
assign
 (resid 27 and (name HNA or name HNB or name HNC))
 (resid 27 and name HA) 2.66 0.50 0.90
assign
 (resid 27 and (name HNA or name HNB or name HNC))
 (resid 27 and name HB) 4.34 0.80 1.30
assign
 (resid 27 and (name HNA or name HNB or name HNC))
 (resid 27 and (name H1A or name H1B or name H1C)) 4.79 1.30 1.70
assign
 (resid 27 and (name HNA or name HNB or name HNC))
 (resid 27 and (name H2A or name H2B or name H2C)) 4.57 1.30 1.70
assign
 (resid 27 and name HA) (resid 27 and name HB) 2.90 0.50 0.90
assign
 (resid 27 and name HA) (resid 27 and (name H1A or name H1B or name H1C)) 3.01 0.50 0.90
assign
 (resid 27 and name HA) (resid 27 and (name H2A or name H2B or name H2C)) 2.93 0.50 0.90
assign
 (resid 27 and name HB) (resid 27 and (name H1A or name H1B or name H1C)) 2.63 0.50 0.90
assign
 (resid 27 and name HB) (resid 27 and (name H2A or name H2B or name H2C)) 2.60 0.50 0.90
assign
 (resid 27 and (name H1A or name H1B or name H1C))
 (resid 27 and (name H2A or name H2B or name H2C)) 3.34 0.50 0.90

  Entry H atom name         Submitted Coord H atom name
    1   1H5*    G   1          1H5*        G   1  15.905  14.387  14.387
    2   2H5*    G   1          2H5*        G   1  16.274  12.812  12.812
    3    H4*    G   1           H4*        G   1  13.641  13.319  13.319
    4    H3*    G   1           H3*        G   1  14.754  10.783  10.783
    5   1H2*    G   1          1H2*        G   1  14.855  11.515  11.515
    6   2H2*    G   1          2H2*        G   1  13.343  10.565  10.565
    7    H1*    G   1           H1*        G   1  12.018  12.633  12.633
    8    H8     G   1           H8         G   1  15.238  13.687  13.687
    9    H1     G   1           H1         G   1  10.217  13.244  13.244
   10   1H2     G   1          1H2         G   1   8.719  11.752  11.752
   11   2H2     G   1          2H2         G   1   8.527  12.273  12.273
   12    H5T    G   1           H5T        G   1  17.384  13.144  13.144
   13   1H5*    A   2          1H5*        A   2   9.749  11.228  11.228
   14   2H5*    A   2          2H5*        A   2   9.540   9.822   9.822
   15    H4*    A   2           H4*        A   2   7.741  10.063  10.063
   16    H3*    A   2           H3*        A   2   9.078   7.711   7.711
   17   1H2*    A   2          1H2*        A   2  10.237   7.848   7.848
   18   2H2*    A   2          2H2*        A   2   8.797   6.969   6.969
   19    H1*    A   2           H1*        A   2   7.943   8.904   8.904
   20    H8     A   2           H8         A   2  11.534   9.528   9.528
   21   1H6     A   2          1H6         A   2  13.194  10.205  10.205
   22   2H6     A   2          2H6         A   2  12.326  10.582  10.582
   23    H2     A   2           H2         A   2   8.136   9.187   9.187
   24   1H5*    T   3          1H5*        T   3   6.235   6.931   6.931
   25   2H5*    T   3          2H5*        T   3   5.717   5.261   5.261
   26    H4*    T   3           H4*        T   3   6.657   5.602   5.602
   27    H3*    T   3           H3*        T   3   8.483   4.270   4.270
   28   1H2*    T   3          1H2*        T   3   9.964   3.751   3.751
   29   2H2*    T   3          2H2*        T   3   8.766   3.997   3.997
   30    H1*    T   3           H1*        T   3   8.711   6.111   6.111
   31    H3     T   3           H3         T   3  12.975   7.241   7.241
   32   1H5M    T   3          1H5         T   3  14.044   6.999   6.999
   33   2H5M    T   3          2H5         T   3  13.031   5.588   5.588
   34   3H5M    T   3          3H5         T   3  12.386   7.225   7.225
   35    H6     T   3           H6         T   3  10.711   5.523   5.523
   36   1H5*    G   4          1H5*        G   4   6.496   3.016   3.016
   37   2H5*    G   4          2H5*        G   4   5.434   3.956   3.956
   38    H4*    G   4           H4*        G   4   4.229   1.506   1.506
   39    H3*    G   4           H3*        G   4   6.108   0.887   0.887
   40   1H2*    G   4          1H2*        G   4   7.397  -0.756  -0.756
   41   2H2*    G   4          2H2*        G   4   6.060  -1.062  -1.062
   42    H1*    G   4           H1*        G   4   7.171   0.260   0.260
   43    H8     G   4           H8         G   4   8.758   0.795   0.795
   44    H1     G   4           H1         G   4  11.835   3.994   3.994
   45   1H2     G   4          1H2         G   4   9.153   2.937   2.937
   46   2H2     G   4          2H2         G   4  10.650   3.880   3.880
   47   1H5*    C   5          1H5*        C   5   3.056  -3.763  -3.763
   48   2H5*    C   5          2H5*        C   5   4.850  -3.839  -3.839
   49    H4*    C   5           H4*        C   5   3.435  -3.207  -3.207
   50    H3*    C   5           H3*        C   5   3.549  -5.605  -5.605
   51   1H2*    C   5          1H2*        C   5   5.116  -6.032  -6.032
   52   2H2*    C   5          2H2*        C   5   5.685  -6.441  -6.441
   53    H1*    C   5           H1*        C   5   6.716  -4.468  -4.468
   54   1H4     C   5          1H4         C   5  11.200  -4.630  -4.630
   55   2H4     C   5          2H4         C   5  11.957  -4.490  -4.490
   56    H5     C   5           H5         C   5   8.593  -4.797  -4.797
   57    H6     C   5           H6         C   5   6.673  -5.381  -5.381
   58   1H5*    T   6          1H5*        T   6   2.841  -5.754  -5.754
   59   2H5*    T   6          2H5*        T   6   2.287  -7.366  -7.366
   60    H4*    T   6           H4*        T   6   4.469  -6.673  -6.673
   61    H3*    T   6           H3*        T   6   4.227  -8.805  -8.805
   62   1H2*    T   6          1H2*        T   6   6.392  -9.360  -9.360
   63   2H2*    T   6          2H2*        T   6   6.660  -9.233  -9.233
   64    H1*    T   6           H1*        T   6   6.930  -7.029  -7.029
   65    H3     T   6           H3         T   6  11.054  -6.928  -6.928
   66   1H5M    T   6          1H5         T   6   7.995  -9.046  -9.046
   67   2H5M    T   6          2H5         T   6   7.570  -7.360  -7.360
   68   3H5M    T   6          3H5         T   6   9.247  -7.899  -7.899
   69    H6     T   6           H6         T   6   6.613  -7.749  -7.749
   70   1H5*    T   7          1H5*        T   7   5.157  -9.005  -9.005
   71   2H5*    T   7          2H5*        T   7   4.662 -10.164 -10.164
   72    H4*    T   7           H4*        T   7   6.965  -9.190  -9.190
   73    H3*    T   7           H3*        T   7   6.462 -11.880 -11.880
   74   1H2*    T   7          1H2*        T   7   7.479 -12.439 -12.439
   75   2H2*    T   7          2H2*        T   7   9.030 -12.352 -12.352
   76    H1*    T   7           H1*        T   7   9.537 -10.171 -10.171
   77    H3     T   7           H3         T   7  11.228 -10.416 -10.416
   78   1H5M    T   7          1H5         T   7   6.864 -13.275 -13.275
   79   2H5M    T   7          2H5         T   7   6.171 -11.665 -11.665
   80   3H5M    T   7          3H5         T   7   7.399 -12.344 -12.344
   81    H6     T   7           H6         T   7   7.033 -11.662 -11.662
   82   1H5*    C   8          1H5*        C   8  10.726 -10.754 -10.754
   83   2H5*    C   8          2H5*        C   8  11.221 -11.830 -11.830
   84    H4*    C   8           H4*        C   8  13.092 -11.331 -11.331
   85    H3*    C   8           H3*        C   8  11.886 -14.069 -14.069
   86   1H2*    C   8          1H2*        C   8  13.374 -14.581 -14.581
   87   2H2*    C   8          2H2*        C   8  14.671 -13.529 -13.529
   88    H1*    C   8           H1*        C   8  13.789 -11.744 -11.744
   89   1H4     C   8          1H4         C   8   9.623 -14.763 -14.763
   90   2H4     C   8          2H4         C   8  11.016 -14.206 -14.206
   91    H5     C   8           H5         C   8   9.618 -14.643 -14.643
   92    H6     C   8           H6         C   8  10.942 -13.948 -13.948
   93    H3T    C   8           H3T        C   8  13.102 -13.508 -13.508
   94   1H5*    G   9          1H5*        G   9  19.409 -15.423 -15.423
   95   2H5*    G   9          2H5*        G   9  20.163 -13.960 -13.960
   96    H4*    G   9           H4*        G   9  20.757 -14.254 -14.254
   97    H3*    G   9           H3*        G   9  19.995 -11.760 -11.760
   98   1H2*    G   9          1H2*        G   9  17.697 -12.280 -12.280
   99   2H2*    G   9          2H2*        G   9  18.171 -11.213 -11.213
  100    H1*    G   9           H1*        G   9  18.600 -13.188 -13.188
  101    H8     G   9           H8         G   9  16.220 -14.343 -14.343
  102    H1     G   9           H1         G   9  13.623 -13.125 -13.125
  103   1H2     G   9          1H2         G   9  16.789 -11.787 -11.787
  104   2H2     G   9          2H2         G   9  15.179 -12.136 -12.136
  105    H5T    G   9           H5T        G   9  18.040 -14.199 -14.199
  106   1H5*    A  10          1H5*        A  10  20.549 -11.745 -11.745
  107   2H5*    A  10          2H5*        A  10  21.657 -10.425 -10.425
  108    H4*    A  10           H4*        A  10  20.482 -10.364 -10.364
  109    H3*    A  10           H3*        A  10  20.814  -8.201  -8.201
  110   1H2*    A  10          1H2*        A  10  18.611  -8.225  -8.225
  111   2H2*    A  10          2H2*        A  10  18.425  -7.172  -7.172
  112    H1*    A  10           H1*        A  10  17.527  -8.958  -8.958
  113    H8     A  10           H8         A  10  17.373  -9.898  -9.898
  114   1H6     A  10          1H6         A  10  12.535 -10.282 -10.282
  115   2H6     A  10          2H6         A  10  11.297 -10.455 -10.455
  116    H2     A  10           H2         A  10  12.995  -8.842  -8.842
  117   1H5*    T  11          1H5*        T  11  18.814  -7.639  -7.639
  118   2H5*    T  11          2H5*        T  11  19.223  -6.141  -6.141
  119    H4*    T  11           H4*        T  11  16.846  -6.823  -6.823
  120    H3*    T  11           H3*        T  11  17.779  -4.229  -4.229
  121   1H2*    T  11          1H2*        T  11  16.111  -3.814  -3.814
  122   2H2*    T  11          2H2*        T  11  14.969  -3.891  -3.891
  123    H1*    T  11           H1*        T  11  14.486  -6.146  -6.146
  124    H3     T  11           H3         T  11  12.569  -6.360  -6.360
  125   1H5M    T  11          1H5         T  11  17.493  -4.561  -4.561
  126   2H5M    T  11          2H5         T  11  17.716  -6.324  -6.324
  127   3H5M    T  11          3H5         T  11  16.699  -5.581  -5.581
  128    H6     T  11           H6         T  11  16.877  -5.376  -5.376
  129   1H5*    G  12          1H5*        G  12  14.892  -2.866  -2.866
  130   2H5*    G  12          2H5*        G  12  15.838  -1.573  -1.573
  131    H4*    G  12           H4*        G  12  14.046  -1.047  -1.047
  132    H3*    G  12           H3*        G  12  16.698  -0.519  -0.519
  133   1H2*    G  12          1H2*        G  12  15.621   0.688   0.688
  134   2H2*    G  12          2H2*        G  12  14.353   1.339   1.339
  135    H1*    G  12           H1*        G  12  12.944  -0.390  -0.390
  136    H8     G  12           H8         G  12  16.098  -0.751  -0.751
  137    H1     G  12           H1         G  12  11.065  -3.709  -3.709
  138   1H2     G  12          1H2         G  12   9.439  -2.711  -2.711
  139   2H2     G  12          2H2         G  12   9.410  -3.737  -3.737
  140   1H5*    C  13          1H5*        C  13  14.197   2.999   2.999
  141   2H5*    C  13          2H5*        C  13  15.311   4.281   4.281
  142    H4*    C  13           H4*        C  13  13.131   4.989   4.989
  143    H3*    C  13           H3*        C  13  15.886   5.536   5.536
  144   1H2*    C  13          1H2*        C  13  15.246   6.900   6.900
  145   2H2*    C  13          2H2*        C  13  13.699   7.376   7.376
  146    H1*    C  13           H1*        C  13  12.528   5.518   5.518
  147   1H4     C  13          1H4         C  13  15.643   5.162   5.162
  148   2H4     C  13          2H4         C  13  13.962   4.669   4.669
  149    H5     C  13           H5         C  13  16.614   5.251   5.251
  150    H6     C  13           H6         C  13  16.030   5.384   5.384
  151   1H5*    T  14          1H5*        T  14  12.367   7.170   7.170
  152   2H5*    T  14          2H5*        T  14  12.205   8.762   8.762
  153    H4*    T  14           H4*        T  14  10.064   7.977   7.977
  154    H3*    T  14           H3*        T  14  11.513  10.305  10.305
  155   1H2*    T  14          1H2*        T  14  10.658  10.200  10.200
  156   2H2*    T  14          2H2*        T  14   8.962  10.035  10.035
  157    H1*    T  14           H1*        T  14   9.187   7.892   7.892
  158    H3     T  14           H3         T  14  10.825   7.438   7.438
  159   1H5M    T  14          1H5         T  14  14.591   9.945   9.945
  160   2H5M    T  14          2H5         T  14  15.008   8.264   8.264
  161   3H5M    T  14          3H5         T  14  15.019   8.808   8.808
  162    H6     T  14           H6         T  14  12.533   8.943   8.943
  163   1H5*    T  15          1H5*        T  15   7.523  10.227  10.227
  164   2H5*    T  15          2H5*        T  15   6.565  11.522  11.522
  165    H4*    T  15           H4*        T  15   5.537  10.409  10.409
  166    H3*    T  15           H3*        T  15   5.653  13.144  13.144
  167   1H2*    T  15          1H2*        T  15   7.352  13.424  13.424
  168   2H2*    T  15          2H2*        T  15   6.028  13.318  13.318
  169    H1*    T  15           H1*        T  15   6.393  11.069  11.069
  170    H3     T  15           H3         T  15  10.019  10.757  10.757
  171   1H5M    T  15          1H5         T  15  11.617  13.921  13.921
  172   2H5M    T  15          2H5         T  15  11.985  12.346  12.346
  173   3H5M    T  15          3H5         T  15  12.790  12.820  12.820
  174    H6     T  15           H6         T  15   9.281  12.517  12.517
  175   1H5*    C  16          1H5*        C  16   3.241  11.814  11.814
  176   2H5*    C  16          2H5*        C  16   1.902  12.972  12.972
  177    H4*    C  16           H4*        C  16   2.859  12.188  12.188
  178    H3*    C  16           H3*        C  16   3.494  14.986  14.986
  179   1H2*    C  16          1H2*        C  16   5.032  15.195  15.195
  180   2H2*    C  16          2H2*        C  16   4.091  14.100  14.100
  181    H1*    C  16           H1*        C  16   5.427  12.285  12.285
  182   1H4     C  16          1H4         C  16  10.783  15.204  15.204
  183   2H4     C  16          2H4         C  16  11.290  14.454  14.454
  184    H5     C  16           H5         C  16   8.341  15.319  15.319
  185    H6     C  16           H6         C  16   6.101  14.707  14.707
  186    H3T    C  16           H3T        C  16   1.398  14.505  14.505
  187   1HN2  PXZ  17          1H2       FLD  17   7.713  -2.513  -2.513
  188   2HN2  PXZ  17          2H2       FLD  17   7.191  -2.469  -2.469
  189    H7   PXZ  17           H7       FLD  17  15.006   2.813   2.813
  190    H8   PXZ  17           H8       FLD  17  13.150   2.709   2.709
  191   1H15  PXZ  17           H4A      FLD  17  12.983   0.240   0.240
  192   2H15  PXZ  17           H4B      FLD  17  13.297  -1.522  -1.522
  193   3H15  PXZ  17           H4C      FLD  17  12.050  -0.910  -0.910
  194   1H16  PXZ  17           H6A      FLD  17  16.114   2.317   2.317
  195   2H16  PXZ  17           H6B      FLD  17  15.716   0.663   0.663
  196   3H16  PXZ  17           H6C      FLD  17  15.005   2.054   2.054
  197    H    THR  18           HN       THR  18   8.344   1.028   1.028
  198    HA   THR  18           HA       THR  18   6.677  -0.513  -0.513
  199    HB   THR  18           HB       THR  18   4.630   0.731   0.731
  200   1HG2  THR  18           H2B      THR  18   5.659  -1.467  -1.467
  201   2HG2  THR  18           H2A      THR  18   5.391  -0.383  -0.383
  202   3HG2  THR  18           H2C      THR  18   4.050  -0.810  -0.810
  203   1HN   DVA  19           HN       BAL  19   5.783   0.744   0.744
  204    HA   DVA  19           HA       BAL  19   6.615   3.568   3.568
  205    HB   DVA  19           HB       BAL  19   4.752   1.851   1.851
  206   1HG1  DVA  19           H1A      BAL  19   5.694   3.933   3.933
  207   2HG1  DVA  19           H1B      BAL  19   4.902   4.880   4.880
  208   3HG1  DVA  19           H1C      BAL  19   3.937   3.907   3.907
  209   1HG2  DVA  19           H2A      BAL  19   2.979   2.641   2.641
  210   2HG2  DVA  19           H2B      BAL  19   3.949   3.961   3.961
  211   3HG2  DVA  19           H2C      BAL  19   4.263   2.303   2.303
  212    HA   PRO  20           HA       PRO  20   8.636   4.011   4.011
  213   1HB   PRO  20          2HB       PRO  20   9.660   5.897   5.897
  214   2HB   PRO  20          1HB       PRO  20  10.494   5.232   5.232
  215   1HG   PRO  20          2HG       PRO  20  11.081   4.412   4.412
  216   2HG   PRO  20          1HG       PRO  20  11.031   3.272   3.272
  217   1HD   PRO  20          2HD       PRO  20   8.966   3.763   3.763
  218   2HD   PRO  20          1HD       PRO  20   9.483   2.212   2.212
  219   1HA   SAR  21          1HA       SAR  21   7.739   6.721   6.721
  220   2HA   SAR  21          2HA       SAR  21   8.531   5.269   5.269
  221   1HN   SAR  21           HNA      SAR  21   6.489   8.063   8.063
  222   2HN   SAR  21           HNB      SAR  21   5.158   6.829   6.829
  223   3HN   SAR  21           HNC      SAR  21   5.812   7.452   7.452
  224   1HN   MVA  22           HNA      MVA  22   8.343   4.499   4.499
  225   2HN   MVA  22           HNB      MVA  22   7.870   6.147   6.147
  226   3HN   MVA  22           HNC      MVA  22   8.949   5.214   5.214
  227    HA   MVA  22           HA       MVA  22   6.574   3.472   3.472
  228    HB   MVA  22           HB       MVA  22   5.650   5.467   5.467
  229   1HG1  MVA  22           H1A      MVA  22   4.247   5.734   5.734
  230   2HG1  MVA  22           H1B      MVA  22   5.633   6.671   6.671
  231   3HG1  MVA  22           H1C      MVA  22   4.069   6.859   6.859
  232   1HG2  MVA  22           H2A      MVA  22   3.405   5.002   5.002
  233   2HG2  MVA  22           H2B      MVA  22   4.009   3.405   3.405
  234   3HG2  MVA  22           H2C      MVA  22   3.070   4.341   4.341
  235    H    THR  23           HN       THR  23  10.853  -0.477  -0.477
  236    HA   THR  23           HA       THR  23   9.179   1.200   1.200
  237    HB   THR  23           HB       THR  23   9.639  -0.581  -0.581
  238   1HG2  THR  23           H2B      THR  23  11.069   1.719   1.719
  239   2HG2  THR  23           H2A      THR  23  12.328   0.492   0.492
  240   3HG2  THR  23           H2C      THR  23  11.237   0.727   0.727
  241   1HN   DVA  24           HN       VAL  24   7.596  -0.153  -0.153
  242    HA   DVA  24           HA       VAL  24   6.822  -2.722  -2.722
  243    HB   DVA  24           HB       VAL  24   5.182  -0.582  -0.582
  244   1HG1  DVA  24           H1A      VAL  24   4.871  -3.603  -3.603
  245   2HG1  DVA  24           H1B      VAL  24   3.937  -2.586  -2.586
  246   3HG1  DVA  24           H1C      VAL  24   3.765  -2.392  -2.392
  247   1HG2  DVA  24           H2A      VAL  24   6.814  -0.849  -0.849
  248   2HG2  DVA  24           H2B      VAL  24   5.963  -2.350  -2.350
  249   3HG2  DVA  24           H2C      VAL  24   7.371  -2.369  -2.369
  250    HA   PRO  25           HA       PRO  25   7.420  -3.045  -3.045
  251   1HB   PRO  25          2HB       PRO  25   6.805  -5.120  -5.120
  252   2HB   PRO  25          1HB       PRO  25   6.974  -3.475  -3.475
  253   1HG   PRO  25          2HG       PRO  25   4.405  -4.802  -4.802
  254   2HG   PRO  25          1HG       PRO  25   4.752  -4.108  -4.108
  255   1HD   PRO  25          2HD       PRO  25   3.501  -2.640  -2.640
  256   2HD   PRO  25          1HD       PRO  25   4.816  -1.886  -1.886
  257   1HA   SAR  26          1HA       SAR  26   9.367  -5.451  -5.451
  258   2HA   SAR  26          2HA       SAR  26   8.704  -3.889  -3.889
  259   1HN   SAR  26           HNA      SAR  26   6.613  -6.635  -6.635
  260   2HN   SAR  26           HNB      SAR  26   8.422  -6.689  -6.689
  261   3HN   SAR  26           HNC      SAR  26   7.590  -5.459  -5.459
  262   1HN   MVA  27           HNA      MVA  27  11.611  -3.320  -3.320
  263   2HN   MVA  27           HNB      MVA  27  12.642  -4.555  -4.555
  264   3HN   MVA  27           HNC      MVA  27  11.124  -5.031  -5.031
  265    HA   MVA  27           HA       MVA  27  12.711  -3.899  -3.899
  266    HB   MVA  27           HB       MVA  27  10.187  -3.426  -3.426
  267   1HG1  MVA  27           H1A      MVA  27  13.081  -3.075  -3.075
  268   2HG1  MVA  27           H1B      MVA  27  11.674  -2.267  -2.267
  269   3HG1  MVA  27           H1C      MVA  27  12.110  -3.890  -3.890
  270   1HG2  MVA  27           H2A      MVA  27  10.630  -5.775  -5.775
  271   2HG2  MVA  27           H2B      MVA  27  12.177  -5.725  -5.725
  272   3HG2  MVA  27           H2C      MVA  27  10.670  -5.614  -5.614